USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 919 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 812 LYS NZ :NH3+ -155:sc= -0.5 (180deg=0) USER MOD Set 1.2: A 871 HIS : no HE2:sc= -1.94 K(o=-2.4,f=-17!) USER MOD Single : A 805 ASN :FLIP amide:sc= -5.86! C(o=-10!,f=-5.9!) USER MOD Single : A 806 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 807 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 810 CYS SG : rot 113:sc= -1.2 USER MOD Single : A 813 CYS SG : rot -45:sc= 0.186 USER MOD Single : A 814 LYS NZ :NH3+ -163:sc= -0.0339 (180deg=-0.304) USER MOD Single : A 818 CYS SG : rot 180:sc= 0 USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -93:sc= 0.663 USER MOD Single : A 829 CYS SG : rot 180:sc= 0 USER MOD Single : A 830 HIS : no HE2:sc= -6.73! C(o=-6.7!,f=-10!) USER MOD Single : A 831 TYR OH : rot 180:sc= 0 USER MOD Single : A 832 THR OG1 : rot -25:sc= 0.0679 USER MOD Single : A 839 LYS NZ :NH3+ -109:sc= -1.11 (180deg=-3.16!) USER MOD Single : A 841 CYS SG : rot 180:sc= 0 USER MOD Single : A 844 SER OG : rot 180:sc= 0 USER MOD Single : A 858 LYS NZ :NH3+ 163:sc= -0.0225 (180deg=-0.35) USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 864 CYS SG : rot 74:sc= -1.41! USER MOD Single : A 867 GLN : amide:sc= -0.634 K(o=-0.63,f=-2.2) USER MOD Single : A 868 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 869 CYS SG : rot 42:sc= -0.12 USER MOD Single : A 870 SER OG : rot 3:sc= 0.791 USER MOD Single : A 876 HIS : no HD1:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 878 LYS NZ :NH3+ -146:sc= -0.188 (180deg=-0.904) USER MOD Single : A 879 TYR OH : rot 180:sc= -4.22! USER MOD Single : A 880 LYS NZ :NH3+ -157:sc= -0.272 (180deg=-1.01) USER MOD Single : A 881 THR OG1 : rot 180:sc= 0.134 USER MOD Single : A 888 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 891 SER OG : rot -102:sc= -3.08! USER MOD Single : A 899 THR OG1 : rot 170:sc= -1.89 USER MOD Single : A 902 GLN :FLIP amide:sc=-0.00666 F(o=-2.2!,f=-0.0067) USER MOD Single : A 903 THR OG1 : rot 180:sc= -0.0247 USER MOD Single : A 905 TYR OH : rot 180:sc= 0 USER MOD Single : A 906 SER OG : rot 180:sc= -0.0886 USER MOD Single : A 907 LYS NZ :NH3+ -108:sc= -0.678 (180deg=-1.27) USER MOD Single : A 909 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 912 HIS : no HE2:sc= 0.0926 K(o=0.093,f=-0.61) USER MOD Single : A 915 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0935) USER MOD Single : A 923 MET CE :methyl -168:sc= -2.09 (180deg=-2.45) USER MOD Single : A 924 SER OG : rot 180:sc= 0.0166 USER MOD Single : A 925 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 0.695 -25.562 -2.796 1.00 44.24 N ATOM 209 CA ASN A 805 1.407 -25.022 -1.650 1.00 34.11 C ATOM 210 C ASN A 805 0.609 -23.856 -1.063 1.00 33.00 C ATOM 211 O ASN A 805 -0.067 -23.132 -1.792 1.00 74.24 O ATOM 212 CB ASN A 805 2.785 -24.495 -2.055 1.00 32.52 C ATOM 213 CG ASN A 805 3.321 -23.508 -1.017 1.00 0.33 C ATOM 214 OD1 ASN A 805 3.334 -23.983 0.225 1.00 53.53 O flip ATOM 215 ND2 ASN A 805 3.698 -22.389 -1.323 1.00 4.45 N flip ATOM 0 HA ASN A 805 1.528 -25.823 -0.920 1.00 34.11 H new ATOM 0 HB2 ASN A 805 3.480 -25.328 -2.163 1.00 32.52 H new ATOM 0 HB3 ASN A 805 2.720 -24.006 -3.027 1.00 32.52 H new ATOM 0 HD21 ASN A 805 3.661 -22.087 -2.297 1.00 4.45 H new ATOM 0 HD22 ASN A 805 4.050 -21.755 -0.605 1.00 4.45 H new ATOM 222 N LYS A 806 0.714 -23.710 0.250 1.00 72.23 N ATOM 223 CA LYS A 806 0.010 -22.644 0.943 1.00 24.40 C ATOM 224 C LYS A 806 0.970 -21.952 1.913 1.00 64.32 C ATOM 225 O LYS A 806 1.925 -22.564 2.389 1.00 20.24 O ATOM 226 CB LYS A 806 -1.256 -23.184 1.611 1.00 23.23 C ATOM 227 CG LYS A 806 -1.629 -22.347 2.836 1.00 4.05 C ATOM 228 CD LYS A 806 -3.080 -22.598 3.251 1.00 23.33 C ATOM 229 CE LYS A 806 -3.401 -24.094 3.243 1.00 21.15 C ATOM 230 NZ LYS A 806 -4.640 -24.362 4.007 1.00 22.15 N ATOM 0 H LYS A 806 1.276 -24.312 0.852 1.00 72.23 H new ATOM 0 HA LYS A 806 -0.329 -21.888 0.235 1.00 24.40 H new ATOM 0 HB2 LYS A 806 -2.080 -23.177 0.897 1.00 23.23 H new ATOM 0 HB3 LYS A 806 -1.101 -24.221 1.908 1.00 23.23 H new ATOM 0 HG2 LYS A 806 -0.963 -22.591 3.664 1.00 4.05 H new ATOM 0 HG3 LYS A 806 -1.488 -21.289 2.614 1.00 4.05 H new ATOM 0 HD2 LYS A 806 -3.253 -22.191 4.247 1.00 23.33 H new ATOM 0 HD3 LYS A 806 -3.752 -22.074 2.571 1.00 23.33 H new ATOM 0 HE2 LYS A 806 -3.517 -24.442 2.216 1.00 21.15 H new ATOM 0 HE3 LYS A 806 -2.571 -24.652 3.677 1.00 21.15 H new ATOM 0 HZ1 LYS A 806 -4.844 -25.382 3.992 1.00 22.15 H new ATOM 0 HZ2 LYS A 806 -4.516 -24.048 4.991 1.00 22.15 H new ATOM 0 HZ3 LYS A 806 -5.432 -23.844 3.576 1.00 22.15 H new ATOM 243 N LYS A 807 0.684 -20.686 2.176 1.00 52.21 N ATOM 244 CA LYS A 807 1.510 -19.904 3.080 1.00 12.12 C ATOM 245 C LYS A 807 0.875 -19.904 4.472 1.00 23.14 C ATOM 246 O LYS A 807 -0.313 -20.186 4.617 1.00 72.22 O ATOM 247 CB LYS A 807 1.747 -18.503 2.513 1.00 64.02 C ATOM 248 CG LYS A 807 2.276 -17.557 3.593 1.00 50.54 C ATOM 249 CD LYS A 807 2.504 -16.153 3.028 1.00 53.03 C ATOM 250 CE LYS A 807 1.175 -15.481 2.678 1.00 53.35 C ATOM 251 NZ LYS A 807 1.333 -14.010 2.636 1.00 10.35 N ATOM 0 H LYS A 807 -0.109 -20.182 1.779 1.00 52.21 H new ATOM 0 HA LYS A 807 2.498 -20.354 3.179 1.00 12.12 H new ATOM 0 HB2 LYS A 807 2.460 -18.556 1.690 1.00 64.02 H new ATOM 0 HB3 LYS A 807 0.816 -18.110 2.104 1.00 64.02 H new ATOM 0 HG2 LYS A 807 1.567 -17.510 4.419 1.00 50.54 H new ATOM 0 HG3 LYS A 807 3.210 -17.947 3.997 1.00 50.54 H new ATOM 0 HD2 LYS A 807 3.041 -15.547 3.757 1.00 53.03 H new ATOM 0 HD3 LYS A 807 3.131 -16.212 2.138 1.00 53.03 H new ATOM 0 HE2 LYS A 807 0.821 -15.842 1.712 1.00 53.35 H new ATOM 0 HE3 LYS A 807 0.419 -15.751 3.416 1.00 53.35 H new ATOM 0 HZ1 LYS A 807 0.422 -13.570 2.397 1.00 10.35 H new ATOM 0 HZ2 LYS A 807 1.650 -13.668 3.566 1.00 10.35 H new ATOM 0 HZ3 LYS A 807 2.039 -13.757 1.916 1.00 10.35 H new ATOM 264 N LEU A 808 1.696 -19.585 5.462 1.00 44.30 N ATOM 265 CA LEU A 808 1.230 -19.544 6.838 1.00 64.53 C ATOM 266 C LEU A 808 1.601 -18.196 7.458 1.00 43.10 C ATOM 267 O LEU A 808 2.608 -17.594 7.088 1.00 63.32 O ATOM 268 CB LEU A 808 1.762 -20.748 7.619 1.00 41.21 C ATOM 269 CG LEU A 808 1.156 -22.105 7.255 1.00 12.31 C ATOM 270 CD1 LEU A 808 1.840 -22.698 6.022 1.00 21.01 C ATOM 271 CD2 LEU A 808 1.196 -23.061 8.449 1.00 50.12 C ATOM 0 H LEU A 808 2.681 -19.352 5.339 1.00 44.30 H new ATOM 0 HA LEU A 808 0.144 -19.623 6.875 1.00 64.53 H new ATOM 0 HB2 LEU A 808 2.841 -20.803 7.472 1.00 41.21 H new ATOM 0 HB3 LEU A 808 1.593 -20.570 8.681 1.00 41.21 H new ATOM 0 HG LEU A 808 0.107 -21.954 6.999 1.00 12.31 H new ATOM 0 HD11 LEU A 808 1.390 -23.662 5.785 1.00 21.01 H new ATOM 0 HD12 LEU A 808 1.715 -22.022 5.176 1.00 21.01 H new ATOM 0 HD13 LEU A 808 2.902 -22.833 6.225 1.00 21.01 H new ATOM 0 HD21 LEU A 808 0.759 -24.018 8.164 1.00 50.12 H new ATOM 0 HD22 LEU A 808 2.230 -23.212 8.760 1.00 50.12 H new ATOM 0 HD23 LEU A 808 0.627 -22.635 9.276 1.00 50.12 H new ATOM 283 N LEU A 809 0.768 -17.761 8.391 1.00 14.41 N ATOM 284 CA LEU A 809 0.995 -16.494 9.066 1.00 22.34 C ATOM 285 C LEU A 809 0.982 -16.719 10.580 1.00 44.33 C ATOM 286 O LEU A 809 0.562 -17.774 11.051 1.00 64.52 O ATOM 287 CB LEU A 809 -0.012 -15.445 8.592 1.00 73.23 C ATOM 288 CG LEU A 809 0.442 -14.555 7.433 1.00 73.21 C ATOM 289 CD1 LEU A 809 0.359 -15.304 6.101 1.00 14.13 C ATOM 290 CD2 LEU A 809 -0.349 -13.246 7.405 1.00 53.14 C ATOM 0 H LEU A 809 -0.066 -18.263 8.696 1.00 14.41 H new ATOM 0 HA LEU A 809 1.977 -16.097 8.810 1.00 22.34 H new ATOM 0 HB2 LEU A 809 -0.927 -15.957 8.294 1.00 73.23 H new ATOM 0 HB3 LEU A 809 -0.266 -14.805 9.437 1.00 73.23 H new ATOM 0 HG LEU A 809 1.489 -14.295 7.591 1.00 73.21 H new ATOM 0 HD11 LEU A 809 0.687 -14.649 5.294 1.00 14.13 H new ATOM 0 HD12 LEU A 809 1.001 -16.184 6.138 1.00 14.13 H new ATOM 0 HD13 LEU A 809 -0.671 -15.613 5.921 1.00 14.13 H new ATOM 0 HD21 LEU A 809 -0.007 -12.632 6.572 1.00 53.14 H new ATOM 0 HD22 LEU A 809 -1.410 -13.464 7.283 1.00 53.14 H new ATOM 0 HD23 LEU A 809 -0.195 -12.708 8.340 1.00 53.14 H new ATOM 302 N CYS A 810 1.448 -15.708 11.300 1.00 74.34 N ATOM 303 CA CYS A 810 1.495 -15.782 12.750 1.00 60.10 C ATOM 304 C CYS A 810 0.353 -14.934 13.312 1.00 55.43 C ATOM 305 O CYS A 810 0.385 -13.707 13.226 1.00 5.01 O ATOM 306 CB CYS A 810 2.855 -15.341 13.295 1.00 51.34 C ATOM 307 SG CYS A 810 3.357 -16.427 14.679 1.00 11.23 S ATOM 0 H CYS A 810 1.796 -14.834 10.906 1.00 74.34 H new ATOM 0 HA CYS A 810 1.368 -16.817 13.068 1.00 60.10 H new ATOM 0 HB2 CYS A 810 3.603 -15.378 12.503 1.00 51.34 H new ATOM 0 HB3 CYS A 810 2.802 -14.307 13.635 1.00 51.34 H new ATOM 0 HG CYS A 810 4.400 -17.120 14.330 1.00 11.23 H new ATOM 313 N ARG A 811 -0.631 -15.620 13.874 1.00 71.41 N ATOM 314 CA ARG A 811 -1.782 -14.945 14.450 1.00 63.15 C ATOM 315 C ARG A 811 -1.330 -13.744 15.282 1.00 12.34 C ATOM 316 O ARG A 811 -2.083 -12.787 15.457 1.00 51.32 O ATOM 317 CB ARG A 811 -2.592 -15.895 15.334 1.00 1.32 C ATOM 318 CG ARG A 811 -3.955 -15.293 15.680 1.00 12.42 C ATOM 319 CD ARG A 811 -3.887 -14.492 16.983 1.00 64.54 C ATOM 320 NE ARG A 811 -4.943 -13.456 16.996 1.00 30.12 N ATOM 321 CZ ARG A 811 -6.213 -13.675 17.399 1.00 3.35 C ATOM 322 NH1 ARG A 811 -6.595 -14.897 17.827 1.00 51.04 N ATOM 323 NH2 ARG A 811 -7.075 -12.675 17.370 1.00 63.52 N ATOM 0 H ARG A 811 -0.655 -16.637 13.943 1.00 71.41 H new ATOM 0 HA ARG A 811 -2.413 -14.605 13.629 1.00 63.15 H new ATOM 0 HB2 ARG A 811 -2.730 -16.846 14.820 1.00 1.32 H new ATOM 0 HB3 ARG A 811 -2.040 -16.105 16.250 1.00 1.32 H new ATOM 0 HG2 ARG A 811 -4.287 -14.646 14.868 1.00 12.42 H new ATOM 0 HG3 ARG A 811 -4.694 -16.089 15.776 1.00 12.42 H new ATOM 0 HD2 ARG A 811 -4.010 -15.159 17.836 1.00 64.54 H new ATOM 0 HD3 ARG A 811 -2.907 -14.025 17.082 1.00 64.54 H new ATOM 0 HE ARG A 811 -4.696 -12.518 16.681 1.00 30.12 H new ATOM 0 HH11 ARG A 811 -5.922 -15.663 17.848 1.00 51.04 H new ATOM 0 HH12 ARG A 811 -7.556 -15.054 18.130 1.00 51.04 H new ATOM 0 HH21 ARG A 811 -6.778 -11.754 17.047 1.00 63.52 H new ATOM 0 HH22 ARG A 811 -8.038 -12.823 17.671 1.00 63.52 H new ATOM 336 N LYS A 812 -0.103 -13.833 15.775 1.00 54.24 N ATOM 337 CA LYS A 812 0.457 -12.765 16.585 1.00 43.00 C ATOM 338 C LYS A 812 0.137 -11.417 15.936 1.00 2.34 C ATOM 339 O LYS A 812 -0.776 -10.716 16.371 1.00 61.13 O ATOM 340 CB LYS A 812 1.952 -12.996 16.817 1.00 72.52 C ATOM 341 CG LYS A 812 2.203 -13.626 18.189 1.00 52.33 C ATOM 342 CD LYS A 812 1.366 -14.893 18.372 1.00 61.51 C ATOM 343 CE LYS A 812 1.958 -16.060 17.578 1.00 75.00 C ATOM 344 NZ LYS A 812 1.607 -17.350 18.213 1.00 10.15 N ATOM 0 H LYS A 812 0.519 -14.628 15.629 1.00 54.24 H new ATOM 0 HA LYS A 812 0.001 -12.759 17.575 1.00 43.00 H new ATOM 0 HB2 LYS A 812 2.349 -13.645 16.037 1.00 72.52 H new ATOM 0 HB3 LYS A 812 2.486 -12.048 16.745 1.00 72.52 H new ATOM 0 HG2 LYS A 812 3.261 -13.866 18.295 1.00 52.33 H new ATOM 0 HG3 LYS A 812 1.959 -12.909 18.973 1.00 52.33 H new ATOM 0 HD2 LYS A 812 1.321 -15.154 19.429 1.00 61.51 H new ATOM 0 HD3 LYS A 812 0.343 -14.708 18.045 1.00 61.51 H new ATOM 0 HE2 LYS A 812 1.584 -16.038 16.554 1.00 75.00 H new ATOM 0 HE3 LYS A 812 3.042 -15.958 17.523 1.00 75.00 H new ATOM 0 HZ1 LYS A 812 2.315 -18.067 17.956 1.00 10.15 H new ATOM 0 HZ2 LYS A 812 1.590 -17.235 19.246 1.00 10.15 H new ATOM 0 HZ3 LYS A 812 0.669 -17.656 17.883 1.00 10.15 H new ATOM 357 N CYS A 813 0.906 -11.094 14.907 1.00 5.33 N ATOM 358 CA CYS A 813 0.716 -9.842 14.195 1.00 43.24 C ATOM 359 C CYS A 813 0.279 -10.165 12.764 1.00 10.15 C ATOM 360 O CYS A 813 0.413 -9.334 11.868 1.00 50.51 O ATOM 361 CB CYS A 813 1.978 -8.977 14.224 1.00 41.11 C ATOM 362 SG CYS A 813 1.645 -7.357 13.440 1.00 32.13 S ATOM 0 H CYS A 813 1.662 -11.678 14.549 1.00 5.33 H new ATOM 0 HA CYS A 813 -0.059 -9.255 14.688 1.00 43.24 H new ATOM 0 HB2 CYS A 813 2.306 -8.832 15.253 1.00 41.11 H new ATOM 0 HB3 CYS A 813 2.788 -9.484 13.700 1.00 41.11 H new ATOM 0 HG CYS A 813 0.987 -7.538 12.333 1.00 32.13 H new ATOM 368 N LYS A 814 -0.235 -11.374 12.596 1.00 70.32 N ATOM 369 CA LYS A 814 -0.693 -11.817 11.290 1.00 61.41 C ATOM 370 C LYS A 814 0.388 -11.521 10.248 1.00 75.11 C ATOM 371 O LYS A 814 0.187 -10.695 9.358 1.00 23.45 O ATOM 372 CB LYS A 814 -2.052 -11.197 10.960 1.00 72.41 C ATOM 373 CG LYS A 814 -2.832 -10.874 12.236 1.00 4.12 C ATOM 374 CD LYS A 814 -3.113 -12.143 13.043 1.00 13.01 C ATOM 375 CE LYS A 814 -4.086 -13.061 12.300 1.00 51.42 C ATOM 376 NZ LYS A 814 -5.422 -12.432 12.205 1.00 15.54 N ATOM 0 H LYS A 814 -0.345 -12.061 13.342 1.00 70.32 H new ATOM 0 HA LYS A 814 -0.852 -12.895 11.287 1.00 61.41 H new ATOM 0 HB2 LYS A 814 -1.909 -10.287 10.377 1.00 72.41 H new ATOM 0 HB3 LYS A 814 -2.629 -11.884 10.341 1.00 72.41 H new ATOM 0 HG2 LYS A 814 -2.265 -10.170 12.845 1.00 4.12 H new ATOM 0 HG3 LYS A 814 -3.772 -10.387 11.978 1.00 4.12 H new ATOM 0 HD2 LYS A 814 -2.179 -12.673 13.231 1.00 13.01 H new ATOM 0 HD3 LYS A 814 -3.529 -11.876 14.014 1.00 13.01 H new ATOM 0 HE2 LYS A 814 -3.705 -13.272 11.301 1.00 51.42 H new ATOM 0 HE3 LYS A 814 -4.163 -14.016 12.820 1.00 51.42 H new ATOM 0 HZ1 LYS A 814 -6.130 -13.156 11.968 1.00 15.54 H new ATOM 0 HZ2 LYS A 814 -5.666 -11.995 13.117 1.00 15.54 H new ATOM 0 HZ3 LYS A 814 -5.410 -11.703 11.464 1.00 15.54 H new ATOM 389 N ALA A 815 1.509 -12.211 10.393 1.00 62.24 N ATOM 390 CA ALA A 815 2.622 -12.032 9.475 1.00 74.31 C ATOM 391 C ALA A 815 3.163 -13.403 9.063 1.00 12.21 C ATOM 392 O ALA A 815 3.151 -14.343 9.856 1.00 12.13 O ATOM 393 CB ALA A 815 3.690 -11.157 10.133 1.00 43.05 C ATOM 0 H ALA A 815 1.671 -12.895 11.132 1.00 62.24 H new ATOM 0 HA ALA A 815 2.295 -11.521 8.569 1.00 74.31 H new ATOM 0 HB1 ALA A 815 4.525 -11.023 9.445 1.00 43.05 H new ATOM 0 HB2 ALA A 815 3.263 -10.185 10.380 1.00 43.05 H new ATOM 0 HB3 ALA A 815 4.045 -11.639 11.044 1.00 43.05 H new ATOM 399 N LEU A 816 3.625 -13.473 7.823 1.00 15.03 N ATOM 400 CA LEU A 816 4.169 -14.713 7.296 1.00 0.15 C ATOM 401 C LEU A 816 5.008 -15.397 8.378 1.00 51.40 C ATOM 402 O LEU A 816 5.765 -14.739 9.090 1.00 11.40 O ATOM 403 CB LEU A 816 4.934 -14.453 5.997 1.00 3.34 C ATOM 404 CG LEU A 816 5.781 -15.615 5.474 1.00 41.54 C ATOM 405 CD1 LEU A 816 7.028 -15.816 6.336 1.00 22.54 C ATOM 406 CD2 LEU A 816 4.948 -16.893 5.362 1.00 63.13 C ATOM 0 H LEU A 816 3.634 -12.691 7.168 1.00 15.03 H new ATOM 0 HA LEU A 816 3.365 -15.401 7.033 1.00 0.15 H new ATOM 0 HB2 LEU A 816 4.216 -14.176 5.225 1.00 3.34 H new ATOM 0 HB3 LEU A 816 5.586 -13.593 6.149 1.00 3.34 H new ATOM 0 HG LEU A 816 6.122 -15.365 4.470 1.00 41.54 H new ATOM 0 HD11 LEU A 816 7.612 -16.648 5.942 1.00 22.54 H new ATOM 0 HD12 LEU A 816 7.632 -14.909 6.320 1.00 22.54 H new ATOM 0 HD13 LEU A 816 6.730 -16.035 7.361 1.00 22.54 H new ATOM 0 HD21 LEU A 816 5.574 -17.703 4.988 1.00 63.13 H new ATOM 0 HD22 LEU A 816 4.557 -17.160 6.344 1.00 63.13 H new ATOM 0 HD23 LEU A 816 4.119 -16.728 4.674 1.00 63.13 H new ATOM 418 N ALA A 817 4.845 -16.708 8.467 1.00 21.41 N ATOM 419 CA ALA A 817 5.578 -17.489 9.450 1.00 51.52 C ATOM 420 C ALA A 817 6.342 -18.608 8.739 1.00 14.14 C ATOM 421 O ALA A 817 7.511 -18.851 9.035 1.00 74.14 O ATOM 422 CB ALA A 817 4.607 -18.023 10.504 1.00 20.24 C ATOM 0 H ALA A 817 4.216 -17.250 7.875 1.00 21.41 H new ATOM 0 HA ALA A 817 6.310 -16.868 9.966 1.00 51.52 H new ATOM 0 HB1 ALA A 817 5.156 -18.609 11.241 1.00 20.24 H new ATOM 0 HB2 ALA A 817 4.112 -17.188 11.000 1.00 20.24 H new ATOM 0 HB3 ALA A 817 3.859 -18.654 10.023 1.00 20.24 H new ATOM 428 N CYS A 818 5.650 -19.260 7.816 1.00 15.45 N ATOM 429 CA CYS A 818 6.248 -20.348 7.062 1.00 51.54 C ATOM 430 C CYS A 818 5.268 -20.766 5.963 1.00 3.24 C ATOM 431 O CYS A 818 4.247 -20.113 5.756 1.00 12.22 O ATOM 432 CB CYS A 818 6.627 -21.522 7.966 1.00 71.00 C ATOM 433 SG CYS A 818 5.226 -21.943 9.066 1.00 40.43 S ATOM 0 H CYS A 818 4.681 -19.055 7.573 1.00 15.45 H new ATOM 0 HA CYS A 818 7.179 -20.010 6.608 1.00 51.54 H new ATOM 0 HB2 CYS A 818 6.896 -22.387 7.359 1.00 71.00 H new ATOM 0 HB3 CYS A 818 7.503 -21.265 8.561 1.00 71.00 H new ATOM 0 HG CYS A 818 5.558 -22.943 9.828 1.00 40.43 H new ATOM 439 N TYR A 819 5.614 -21.852 5.288 1.00 23.25 N ATOM 440 CA TYR A 819 4.778 -22.365 4.217 1.00 62.34 C ATOM 441 C TYR A 819 4.513 -23.861 4.397 1.00 74.34 C ATOM 442 O TYR A 819 5.381 -24.598 4.861 1.00 20.05 O ATOM 443 CB TYR A 819 5.570 -22.152 2.925 1.00 1.10 C ATOM 444 CG TYR A 819 5.788 -20.681 2.565 1.00 70.04 C ATOM 445 CD1 TYR A 819 4.821 -19.992 1.862 1.00 74.13 C ATOM 446 CD2 TYR A 819 6.952 -20.043 2.942 1.00 21.05 C ATOM 447 CE1 TYR A 819 5.026 -18.608 1.522 1.00 13.25 C ATOM 448 CE2 TYR A 819 7.157 -18.659 2.603 1.00 2.32 C ATOM 449 CZ TYR A 819 6.184 -18.009 1.910 1.00 71.41 C ATOM 450 OH TYR A 819 6.378 -16.702 1.590 1.00 54.04 O ATOM 0 H TYR A 819 6.462 -22.391 5.462 1.00 23.25 H new ATOM 0 HA TYR A 819 3.814 -21.856 4.206 1.00 62.34 H new ATOM 0 HB2 TYR A 819 6.540 -22.640 3.021 1.00 1.10 H new ATOM 0 HB3 TYR A 819 5.046 -22.643 2.105 1.00 1.10 H new ATOM 0 HD1 TYR A 819 3.910 -20.491 1.567 1.00 74.13 H new ATOM 0 HD2 TYR A 819 7.709 -20.582 3.492 1.00 21.05 H new ATOM 0 HE1 TYR A 819 4.277 -18.058 0.971 1.00 13.25 H new ATOM 0 HE2 TYR A 819 8.063 -18.148 2.893 1.00 2.32 H new ATOM 0 HH TYR A 819 7.248 -16.407 1.932 1.00 54.04 H new ATOM 460 N THR A 820 3.309 -24.266 4.019 1.00 52.30 N ATOM 461 CA THR A 820 2.918 -25.661 4.133 1.00 51.41 C ATOM 462 C THR A 820 3.767 -26.530 3.203 1.00 11.13 C ATOM 463 O THR A 820 3.906 -27.732 3.426 1.00 11.53 O ATOM 464 CB THR A 820 1.417 -25.756 3.851 1.00 1.41 C ATOM 465 OG1 THR A 820 0.968 -26.799 4.712 1.00 53.25 O ATOM 466 CG2 THR A 820 1.117 -26.278 2.444 1.00 3.45 C ATOM 0 H THR A 820 2.591 -23.652 3.633 1.00 52.30 H new ATOM 0 HA THR A 820 3.099 -26.042 5.138 1.00 51.41 H new ATOM 0 HB THR A 820 0.961 -24.774 3.978 1.00 1.41 H new ATOM 0 HG1 THR A 820 0.985 -27.652 4.229 1.00 53.25 H new ATOM 0 HG21 THR A 820 0.038 -26.326 2.296 1.00 3.45 H new ATOM 0 HG22 THR A 820 1.555 -25.606 1.706 1.00 3.45 H new ATOM 0 HG23 THR A 820 1.544 -27.274 2.327 1.00 3.45 H new ATOM 474 N ALA A 821 4.313 -25.888 2.181 1.00 72.44 N ATOM 475 CA ALA A 821 5.144 -26.588 1.216 1.00 25.01 C ATOM 476 C ALA A 821 6.355 -27.188 1.934 1.00 62.23 C ATOM 477 O ALA A 821 7.025 -28.069 1.397 1.00 25.02 O ATOM 478 CB ALA A 821 5.548 -25.626 0.097 1.00 71.11 C ATOM 0 H ALA A 821 4.196 -24.891 2.000 1.00 72.44 H new ATOM 0 HA ALA A 821 4.592 -27.408 0.757 1.00 25.01 H new ATOM 0 HB1 ALA A 821 6.171 -26.151 -0.627 1.00 71.11 H new ATOM 0 HB2 ALA A 821 4.654 -25.250 -0.400 1.00 71.11 H new ATOM 0 HB3 ALA A 821 6.107 -24.791 0.519 1.00 71.11 H new ATOM 484 N ASP A 822 6.599 -26.687 3.136 1.00 75.31 N ATOM 485 CA ASP A 822 7.717 -27.163 3.933 1.00 52.05 C ATOM 486 C ASP A 822 7.184 -27.935 5.141 1.00 3.14 C ATOM 487 O ASP A 822 7.843 -28.847 5.640 1.00 51.45 O ATOM 488 CB ASP A 822 8.560 -25.996 4.451 1.00 73.14 C ATOM 489 CG ASP A 822 9.021 -25.006 3.379 1.00 2.03 C ATOM 490 OD1 ASP A 822 9.213 -25.373 2.210 1.00 34.04 O ATOM 491 OD2 ASP A 822 9.187 -23.795 3.791 1.00 0.14 O ATOM 0 H ASP A 822 6.041 -25.956 3.578 1.00 75.31 H new ATOM 0 HA ASP A 822 8.335 -27.801 3.301 1.00 52.05 H new ATOM 0 HB2 ASP A 822 7.982 -25.454 5.200 1.00 73.14 H new ATOM 0 HB3 ASP A 822 9.439 -26.398 4.955 1.00 73.14 H new ATOM 497 N VAL A 823 5.997 -27.541 5.578 1.00 20.34 N ATOM 498 CA VAL A 823 5.369 -28.185 6.720 1.00 55.15 C ATOM 499 C VAL A 823 4.875 -29.574 6.308 1.00 10.55 C ATOM 500 O VAL A 823 3.907 -29.696 5.559 1.00 3.41 O ATOM 501 CB VAL A 823 4.255 -27.295 7.274 1.00 12.45 C ATOM 502 CG1 VAL A 823 3.776 -27.801 8.636 1.00 14.24 C ATOM 503 CG2 VAL A 823 4.710 -25.836 7.361 1.00 61.54 C ATOM 0 H VAL A 823 5.454 -26.784 5.162 1.00 20.34 H new ATOM 0 HA VAL A 823 6.090 -28.322 7.526 1.00 55.15 H new ATOM 0 HB VAL A 823 3.413 -27.343 6.583 1.00 12.45 H new ATOM 0 HG11 VAL A 823 2.984 -27.151 9.008 1.00 14.24 H new ATOM 0 HG12 VAL A 823 3.393 -28.816 8.533 1.00 14.24 H new ATOM 0 HG13 VAL A 823 4.609 -27.797 9.339 1.00 14.24 H new ATOM 0 HG21 VAL A 823 3.899 -25.225 7.758 1.00 61.54 H new ATOM 0 HG22 VAL A 823 5.575 -25.763 8.020 1.00 61.54 H new ATOM 0 HG23 VAL A 823 4.980 -25.479 6.367 1.00 61.54 H new ATOM 513 N ARG A 824 5.563 -30.585 6.817 1.00 34.41 N ATOM 514 CA ARG A 824 5.206 -31.961 6.512 1.00 3.32 C ATOM 515 C ARG A 824 4.993 -32.753 7.804 1.00 44.41 C ATOM 516 O ARG A 824 5.845 -32.740 8.691 1.00 21.33 O ATOM 517 CB ARG A 824 6.295 -32.640 5.679 1.00 1.02 C ATOM 518 CG ARG A 824 6.000 -32.514 4.183 1.00 34.03 C ATOM 519 CD ARG A 824 5.846 -31.047 3.776 1.00 32.14 C ATOM 520 NE ARG A 824 6.332 -30.852 2.392 1.00 30.22 N ATOM 521 CZ ARG A 824 7.634 -30.880 2.036 1.00 31.53 C ATOM 522 NH1 ARG A 824 8.593 -31.096 2.962 1.00 73.31 N ATOM 523 NH2 ARG A 824 7.955 -30.694 0.770 1.00 44.23 N ATOM 0 H ARG A 824 6.365 -30.480 7.438 1.00 34.41 H new ATOM 0 HA ARG A 824 4.281 -31.944 5.936 1.00 3.32 H new ATOM 0 HB2 ARG A 824 7.262 -32.189 5.902 1.00 1.02 H new ATOM 0 HB3 ARG A 824 6.363 -33.693 5.952 1.00 1.02 H new ATOM 0 HG2 ARG A 824 6.807 -32.971 3.610 1.00 34.03 H new ATOM 0 HG3 ARG A 824 5.088 -33.060 3.941 1.00 34.03 H new ATOM 0 HD2 ARG A 824 4.800 -30.749 3.848 1.00 32.14 H new ATOM 0 HD3 ARG A 824 6.407 -30.410 4.460 1.00 32.14 H new ATOM 0 HE ARG A 824 5.640 -30.686 1.661 1.00 30.22 H new ATOM 0 HH11 ARG A 824 8.336 -31.240 3.939 1.00 73.31 H new ATOM 0 HH12 ARG A 824 9.574 -31.116 2.685 1.00 73.31 H new ATOM 0 HH21 ARG A 824 7.224 -30.532 0.077 1.00 44.23 H new ATOM 0 HH22 ARG A 824 8.934 -30.712 0.484 1.00 44.23 H new ATOM 536 N VAL A 825 3.852 -33.423 7.868 1.00 2.43 N ATOM 537 CA VAL A 825 3.517 -34.219 9.037 1.00 54.33 C ATOM 538 C VAL A 825 4.326 -35.517 9.013 1.00 10.15 C ATOM 539 O VAL A 825 4.514 -36.117 7.956 1.00 14.22 O ATOM 540 CB VAL A 825 2.006 -34.457 9.091 1.00 2.35 C ATOM 541 CG1 VAL A 825 1.268 -33.194 9.539 1.00 0.32 C ATOM 542 CG2 VAL A 825 1.480 -34.951 7.742 1.00 13.45 C ATOM 0 H VAL A 825 3.148 -33.431 7.130 1.00 2.43 H new ATOM 0 HA VAL A 825 3.782 -33.688 9.951 1.00 54.33 H new ATOM 0 HB VAL A 825 1.816 -35.236 9.830 1.00 2.35 H new ATOM 0 HG11 VAL A 825 0.196 -33.390 9.569 1.00 0.32 H new ATOM 0 HG12 VAL A 825 1.612 -32.905 10.532 1.00 0.32 H new ATOM 0 HG13 VAL A 825 1.469 -32.386 8.836 1.00 0.32 H new ATOM 0 HG21 VAL A 825 0.404 -35.112 7.808 1.00 13.45 H new ATOM 0 HG22 VAL A 825 1.689 -34.205 6.975 1.00 13.45 H new ATOM 0 HG23 VAL A 825 1.972 -35.888 7.481 1.00 13.45 H new ATOM 552 N ILE A 826 4.784 -35.912 10.192 1.00 32.42 N ATOM 553 CA ILE A 826 5.569 -37.128 10.320 1.00 33.45 C ATOM 554 C ILE A 826 4.628 -38.333 10.391 1.00 54.35 C ATOM 555 O ILE A 826 4.311 -38.815 11.477 1.00 60.32 O ATOM 556 CB ILE A 826 6.525 -37.026 11.510 1.00 5.40 C ATOM 557 CG1 ILE A 826 7.790 -36.251 11.131 1.00 34.25 C ATOM 558 CG2 ILE A 826 6.849 -38.410 12.075 1.00 60.33 C ATOM 559 CD1 ILE A 826 8.147 -35.225 12.208 1.00 11.24 C ATOM 0 H ILE A 826 4.627 -35.412 11.067 1.00 32.42 H new ATOM 0 HA ILE A 826 6.201 -37.267 9.443 1.00 33.45 H new ATOM 0 HB ILE A 826 6.027 -36.465 12.301 1.00 5.40 H new ATOM 0 HG12 ILE A 826 8.619 -36.945 10.996 1.00 34.25 H new ATOM 0 HG13 ILE A 826 7.639 -35.745 10.177 1.00 34.25 H new ATOM 0 HG21 ILE A 826 7.530 -38.308 12.920 1.00 60.33 H new ATOM 0 HG22 ILE A 826 5.929 -38.892 12.407 1.00 60.33 H new ATOM 0 HG23 ILE A 826 7.319 -39.018 11.302 1.00 60.33 H new ATOM 0 HD11 ILE A 826 9.049 -34.688 11.914 1.00 11.24 H new ATOM 0 HD12 ILE A 826 7.325 -34.518 12.324 1.00 11.24 H new ATOM 0 HD13 ILE A 826 8.321 -35.737 13.155 1.00 11.24 H new ATOM 571 N GLU A 827 4.207 -38.783 9.218 1.00 73.41 N ATOM 572 CA GLU A 827 3.308 -39.922 9.132 1.00 21.04 C ATOM 573 C GLU A 827 2.045 -39.664 9.956 1.00 32.43 C ATOM 574 O GLU A 827 1.404 -40.603 10.426 1.00 31.05 O ATOM 575 CB GLU A 827 4.006 -41.206 9.585 1.00 34.15 C ATOM 576 CG GLU A 827 4.819 -41.820 8.444 1.00 34.52 C ATOM 577 CD GLU A 827 4.962 -43.333 8.625 1.00 35.12 C ATOM 578 OE1 GLU A 827 5.748 -43.785 9.471 1.00 12.41 O ATOM 579 OE2 GLU A 827 4.219 -44.048 7.849 1.00 13.45 O ATOM 0 H GLU A 827 4.472 -38.380 8.319 1.00 73.41 H new ATOM 0 HA GLU A 827 3.017 -40.054 8.090 1.00 21.04 H new ATOM 0 HB2 GLU A 827 4.662 -40.989 10.428 1.00 34.15 H new ATOM 0 HB3 GLU A 827 3.264 -41.924 9.935 1.00 34.15 H new ATOM 0 HG2 GLU A 827 4.333 -41.608 7.492 1.00 34.52 H new ATOM 0 HG3 GLU A 827 5.806 -41.360 8.407 1.00 34.52 H new ATOM 587 N GLU A 828 1.725 -38.387 10.106 1.00 73.50 N ATOM 588 CA GLU A 828 0.550 -37.994 10.865 1.00 74.51 C ATOM 589 C GLU A 828 0.811 -38.145 12.365 1.00 64.32 C ATOM 590 O GLU A 828 0.020 -38.760 13.078 1.00 51.01 O ATOM 591 CB GLU A 828 -0.675 -38.806 10.438 1.00 54.31 C ATOM 592 CG GLU A 828 -0.768 -38.897 8.913 1.00 31.45 C ATOM 593 CD GLU A 828 -1.905 -39.829 8.488 1.00 11.25 C ATOM 594 OE1 GLU A 828 -2.048 -40.927 9.046 1.00 61.31 O ATOM 595 OE2 GLU A 828 -2.657 -39.375 7.543 1.00 31.35 O ATOM 0 H GLU A 828 2.259 -37.611 9.715 1.00 73.50 H new ATOM 0 HA GLU A 828 0.341 -36.945 10.656 1.00 74.51 H new ATOM 0 HB2 GLU A 828 -0.618 -39.808 10.863 1.00 54.31 H new ATOM 0 HB3 GLU A 828 -1.579 -38.343 10.834 1.00 54.31 H new ATOM 0 HG2 GLU A 828 -0.932 -37.904 8.495 1.00 31.45 H new ATOM 0 HG3 GLU A 828 0.176 -39.261 8.509 1.00 31.45 H new ATOM 603 N CYS A 829 1.925 -37.574 12.799 1.00 1.20 N ATOM 604 CA CYS A 829 2.301 -37.637 14.201 1.00 21.01 C ATOM 605 C CYS A 829 2.320 -36.212 14.758 1.00 23.20 C ATOM 606 O CYS A 829 1.846 -35.969 15.867 1.00 42.34 O ATOM 607 CB CYS A 829 3.644 -38.344 14.395 1.00 1.22 C ATOM 608 SG CYS A 829 4.180 -38.202 16.139 1.00 13.23 S ATOM 0 H CYS A 829 2.579 -37.066 12.204 1.00 1.20 H new ATOM 0 HA CYS A 829 1.570 -38.231 14.750 1.00 21.01 H new ATOM 0 HB2 CYS A 829 3.555 -39.394 14.118 1.00 1.22 H new ATOM 0 HB3 CYS A 829 4.394 -37.904 13.738 1.00 1.22 H new ATOM 0 HG CYS A 829 5.320 -38.807 16.293 1.00 13.23 H new ATOM 614 N HIS A 830 2.873 -35.308 13.963 1.00 4.23 N ATOM 615 CA HIS A 830 2.961 -33.913 14.363 1.00 34.50 C ATOM 616 C HIS A 830 3.333 -33.055 13.153 1.00 44.03 C ATOM 617 O HIS A 830 3.787 -33.575 12.134 1.00 12.23 O ATOM 618 CB HIS A 830 3.932 -33.743 15.533 1.00 63.45 C ATOM 619 CG HIS A 830 3.270 -33.336 16.827 1.00 32.51 C ATOM 620 ND1 HIS A 830 2.992 -32.018 17.145 1.00 24.54 N ATOM 621 CD2 HIS A 830 2.832 -34.087 17.879 1.00 43.13 C ATOM 622 CE1 HIS A 830 2.415 -31.989 18.337 1.00 10.34 C ATOM 623 NE2 HIS A 830 2.317 -33.271 18.790 1.00 21.55 N ATOM 0 H HIS A 830 3.265 -35.514 13.044 1.00 4.23 H new ATOM 0 HA HIS A 830 1.990 -33.572 14.721 1.00 34.50 H new ATOM 0 HB2 HIS A 830 4.465 -34.681 15.689 1.00 63.45 H new ATOM 0 HB3 HIS A 830 4.678 -32.994 15.267 1.00 63.45 H new ATOM 0 HD1 HIS A 830 3.197 -31.207 16.561 1.00 24.54 H new ATOM 0 HD2 HIS A 830 2.894 -35.162 17.957 1.00 43.13 H new ATOM 0 HE1 HIS A 830 2.081 -31.104 18.859 1.00 10.34 H new ATOM 631 N TYR A 831 3.128 -31.755 13.304 1.00 3.12 N ATOM 632 CA TYR A 831 3.437 -30.819 12.236 1.00 22.13 C ATOM 633 C TYR A 831 4.846 -30.246 12.400 1.00 2.42 C ATOM 634 O TYR A 831 5.177 -29.692 13.448 1.00 61.42 O ATOM 635 CB TYR A 831 2.419 -29.684 12.363 1.00 5.32 C ATOM 636 CG TYR A 831 1.115 -29.929 11.602 1.00 64.13 C ATOM 637 CD1 TYR A 831 1.118 -29.966 10.222 1.00 64.41 C ATOM 638 CD2 TYR A 831 -0.064 -30.113 12.294 1.00 30.22 C ATOM 639 CE1 TYR A 831 -0.109 -30.197 9.505 1.00 20.32 C ATOM 640 CE2 TYR A 831 -1.291 -30.344 11.578 1.00 74.15 C ATOM 641 CZ TYR A 831 -1.253 -30.375 10.218 1.00 13.13 C ATOM 642 OH TYR A 831 -2.413 -30.593 9.541 1.00 5.04 O ATOM 0 H TYR A 831 2.752 -31.327 14.150 1.00 3.12 H new ATOM 0 HA TYR A 831 3.392 -31.314 11.266 1.00 22.13 H new ATOM 0 HB2 TYR A 831 2.189 -29.532 13.418 1.00 5.32 H new ATOM 0 HB3 TYR A 831 2.872 -28.761 12.000 1.00 5.32 H new ATOM 0 HD1 TYR A 831 2.041 -29.822 9.680 1.00 64.41 H new ATOM 0 HD2 TYR A 831 -0.066 -30.084 13.374 1.00 30.22 H new ATOM 0 HE1 TYR A 831 -0.120 -30.228 8.426 1.00 20.32 H new ATOM 0 HE2 TYR A 831 -2.221 -30.489 12.108 1.00 74.15 H new ATOM 0 HH TYR A 831 -3.148 -30.704 10.179 1.00 5.04 H new ATOM 652 N THR A 832 5.638 -30.398 11.349 1.00 3.51 N ATOM 653 CA THR A 832 7.004 -29.902 11.363 1.00 0.33 C ATOM 654 C THR A 832 7.456 -29.543 9.946 1.00 13.43 C ATOM 655 O THR A 832 7.197 -30.286 9.001 1.00 21.33 O ATOM 656 CB THR A 832 7.884 -30.960 12.032 1.00 41.42 C ATOM 657 OG1 THR A 832 8.093 -31.932 11.012 1.00 63.32 O ATOM 658 CG2 THR A 832 7.146 -31.726 13.131 1.00 11.35 C ATOM 0 H THR A 832 5.360 -30.858 10.482 1.00 3.51 H new ATOM 0 HA THR A 832 7.084 -28.980 11.939 1.00 0.33 H new ATOM 0 HB THR A 832 8.768 -30.483 12.454 1.00 41.42 H new ATOM 0 HG1 THR A 832 7.355 -31.895 10.369 1.00 63.32 H new ATOM 0 HG21 THR A 832 7.816 -32.464 13.573 1.00 11.35 H new ATOM 0 HG22 THR A 832 6.815 -31.029 13.901 1.00 11.35 H new ATOM 0 HG23 THR A 832 6.280 -32.232 12.703 1.00 11.35 H new ATOM 666 N VAL A 833 8.123 -28.403 9.843 1.00 11.44 N ATOM 667 CA VAL A 833 8.613 -27.936 8.558 1.00 41.23 C ATOM 668 C VAL A 833 10.120 -28.184 8.471 1.00 44.51 C ATOM 669 O VAL A 833 10.746 -28.578 9.454 1.00 51.50 O ATOM 670 CB VAL A 833 8.236 -26.467 8.356 1.00 41.30 C ATOM 671 CG1 VAL A 833 6.944 -26.125 9.101 1.00 60.04 C ATOM 672 CG2 VAL A 833 9.378 -25.544 8.787 1.00 52.44 C ATOM 0 H VAL A 833 8.336 -27.789 10.629 1.00 11.44 H new ATOM 0 HA VAL A 833 8.145 -28.492 7.746 1.00 41.23 H new ATOM 0 HB VAL A 833 8.061 -26.309 7.292 1.00 41.30 H new ATOM 0 HG11 VAL A 833 6.699 -25.075 8.941 1.00 60.04 H new ATOM 0 HG12 VAL A 833 6.132 -26.749 8.727 1.00 60.04 H new ATOM 0 HG13 VAL A 833 7.080 -26.307 10.167 1.00 60.04 H new ATOM 0 HG21 VAL A 833 9.084 -24.506 8.633 1.00 52.44 H new ATOM 0 HG22 VAL A 833 9.599 -25.706 9.842 1.00 52.44 H new ATOM 0 HG23 VAL A 833 10.266 -25.762 8.193 1.00 52.44 H new ATOM 682 N LEU A 834 10.660 -27.942 7.285 1.00 21.22 N ATOM 683 CA LEU A 834 12.082 -28.134 7.057 1.00 23.23 C ATOM 684 C LEU A 834 12.698 -26.822 6.567 1.00 14.14 C ATOM 685 O LEU A 834 12.005 -25.812 6.452 1.00 33.13 O ATOM 686 CB LEU A 834 12.319 -29.315 6.113 1.00 10.40 C ATOM 687 CG LEU A 834 11.330 -30.476 6.230 1.00 53.11 C ATOM 688 CD1 LEU A 834 11.313 -31.313 4.949 1.00 1.04 C ATOM 689 CD2 LEU A 834 11.626 -31.326 7.467 1.00 61.32 C ATOM 0 H LEU A 834 10.138 -27.615 6.472 1.00 21.22 H new ATOM 0 HA LEU A 834 12.585 -28.394 7.988 1.00 23.23 H new ATOM 0 HB2 LEU A 834 12.295 -28.945 5.088 1.00 10.40 H new ATOM 0 HB3 LEU A 834 13.323 -29.700 6.290 1.00 10.40 H new ATOM 0 HG LEU A 834 10.330 -30.061 6.357 1.00 53.11 H new ATOM 0 HD11 LEU A 834 10.602 -32.132 5.059 1.00 1.04 H new ATOM 0 HD12 LEU A 834 11.017 -30.686 4.108 1.00 1.04 H new ATOM 0 HD13 LEU A 834 12.308 -31.719 4.766 1.00 1.04 H new ATOM 0 HD21 LEU A 834 10.908 -32.144 7.526 1.00 61.32 H new ATOM 0 HD22 LEU A 834 12.635 -31.732 7.396 1.00 61.32 H new ATOM 0 HD23 LEU A 834 11.546 -30.708 8.361 1.00 61.32 H new ATOM 701 N GLY A 835 13.992 -26.879 6.292 1.00 3.12 N ATOM 702 CA GLY A 835 14.709 -25.707 5.817 1.00 32.34 C ATOM 703 C GLY A 835 15.054 -24.769 6.976 1.00 64.24 C ATOM 704 O GLY A 835 14.209 -24.487 7.824 1.00 43.44 O ATOM 0 H GLY A 835 14.563 -27.718 6.389 1.00 3.12 H new ATOM 0 HA2 GLY A 835 15.623 -26.016 5.310 1.00 32.34 H new ATOM 0 HA3 GLY A 835 14.101 -25.177 5.084 1.00 32.34 H new ATOM 708 N ASP A 836 16.298 -24.312 6.974 1.00 30.22 N ATOM 709 CA ASP A 836 16.766 -23.412 8.014 1.00 13.23 C ATOM 710 C ASP A 836 16.116 -22.040 7.825 1.00 14.32 C ATOM 711 O ASP A 836 16.191 -21.186 8.708 1.00 61.23 O ATOM 712 CB ASP A 836 18.283 -23.230 7.944 1.00 41.22 C ATOM 713 CG ASP A 836 19.095 -24.523 8.041 1.00 73.14 C ATOM 714 OD1 ASP A 836 18.582 -25.620 7.774 1.00 20.34 O ATOM 715 OD2 ASP A 836 20.321 -24.371 8.412 1.00 14.14 O ATOM 0 H ASP A 836 16.996 -24.548 6.269 1.00 30.22 H new ATOM 0 HA ASP A 836 16.499 -23.844 8.979 1.00 13.23 H new ATOM 0 HB2 ASP A 836 18.531 -22.732 7.006 1.00 41.22 H new ATOM 0 HB3 ASP A 836 18.591 -22.564 8.750 1.00 41.22 H new ATOM 721 N ALA A 837 15.492 -21.870 6.669 1.00 72.33 N ATOM 722 CA ALA A 837 14.829 -20.616 6.353 1.00 71.54 C ATOM 723 C ALA A 837 13.948 -20.199 7.531 1.00 34.15 C ATOM 724 O ALA A 837 13.879 -19.019 7.873 1.00 72.34 O ATOM 725 CB ALA A 837 14.032 -20.773 5.056 1.00 43.23 C ATOM 0 H ALA A 837 15.431 -22.580 5.939 1.00 72.33 H new ATOM 0 HA ALA A 837 15.561 -19.825 6.193 1.00 71.54 H new ATOM 0 HB1 ALA A 837 13.534 -19.833 4.819 1.00 43.23 H new ATOM 0 HB2 ALA A 837 14.708 -21.041 4.244 1.00 43.23 H new ATOM 0 HB3 ALA A 837 13.285 -21.557 5.180 1.00 43.23 H new ATOM 731 N PHE A 838 13.296 -21.190 8.121 1.00 35.15 N ATOM 732 CA PHE A 838 12.421 -20.941 9.255 1.00 4.41 C ATOM 733 C PHE A 838 13.208 -20.954 10.567 1.00 31.14 C ATOM 734 O PHE A 838 12.783 -20.358 11.556 1.00 30.31 O ATOM 735 CB PHE A 838 11.389 -22.070 9.281 1.00 4.21 C ATOM 736 CG PHE A 838 11.872 -23.338 9.988 1.00 2.24 C ATOM 737 CD1 PHE A 838 12.063 -23.334 11.335 1.00 65.52 C ATOM 738 CD2 PHE A 838 12.110 -24.468 9.270 1.00 20.25 C ATOM 739 CE1 PHE A 838 12.511 -24.511 11.991 1.00 25.32 C ATOM 740 CE2 PHE A 838 12.558 -25.645 9.927 1.00 40.11 C ATOM 741 CZ PHE A 838 12.749 -25.642 11.273 1.00 3.33 C ATOM 0 H PHE A 838 13.356 -22.167 7.835 1.00 35.15 H new ATOM 0 HA PHE A 838 11.950 -19.963 9.154 1.00 4.41 H new ATOM 0 HB2 PHE A 838 10.486 -21.712 9.776 1.00 4.21 H new ATOM 0 HB3 PHE A 838 11.113 -22.320 8.257 1.00 4.21 H new ATOM 0 HD1 PHE A 838 11.874 -22.436 11.905 1.00 65.52 H new ATOM 0 HD2 PHE A 838 11.958 -24.471 8.201 1.00 20.25 H new ATOM 0 HE1 PHE A 838 12.663 -24.508 13.060 1.00 25.32 H new ATOM 0 HE2 PHE A 838 12.747 -26.543 9.357 1.00 40.11 H new ATOM 0 HZ PHE A 838 13.090 -26.537 11.772 1.00 3.33 H new ATOM 751 N LYS A 839 14.341 -21.640 10.534 1.00 33.32 N ATOM 752 CA LYS A 839 15.190 -21.739 11.709 1.00 65.23 C ATOM 753 C LYS A 839 15.664 -20.341 12.110 1.00 41.35 C ATOM 754 O LYS A 839 16.112 -20.132 13.236 1.00 61.20 O ATOM 755 CB LYS A 839 16.332 -22.728 11.463 1.00 51.05 C ATOM 756 CG LYS A 839 15.823 -24.171 11.488 1.00 54.44 C ATOM 757 CD LYS A 839 16.960 -25.148 11.791 1.00 73.21 C ATOM 758 CE LYS A 839 18.253 -24.716 11.098 1.00 65.53 C ATOM 759 NZ LYS A 839 19.075 -23.885 12.005 1.00 2.13 N ATOM 0 H LYS A 839 14.691 -22.133 9.712 1.00 33.32 H new ATOM 0 HA LYS A 839 14.628 -22.140 12.552 1.00 65.23 H new ATOM 0 HB2 LYS A 839 16.797 -22.519 10.500 1.00 51.05 H new ATOM 0 HB3 LYS A 839 17.102 -22.597 12.224 1.00 51.05 H new ATOM 0 HG2 LYS A 839 15.042 -24.272 12.241 1.00 54.44 H new ATOM 0 HG3 LYS A 839 15.373 -24.418 10.527 1.00 54.44 H new ATOM 0 HD2 LYS A 839 17.121 -25.202 12.868 1.00 73.21 H new ATOM 0 HD3 LYS A 839 16.682 -26.149 11.460 1.00 73.21 H new ATOM 0 HE2 LYS A 839 18.818 -25.595 10.789 1.00 65.53 H new ATOM 0 HE3 LYS A 839 18.018 -24.154 10.194 1.00 65.53 H new ATOM 0 HZ1 LYS A 839 19.066 -22.899 11.675 1.00 2.13 H new ATOM 0 HZ2 LYS A 839 18.685 -23.932 12.968 1.00 2.13 H new ATOM 0 HZ3 LYS A 839 20.053 -24.240 12.010 1.00 2.13 H new ATOM 772 N GLU A 840 15.549 -19.419 11.165 1.00 12.52 N ATOM 773 CA GLU A 840 15.960 -18.046 11.406 1.00 54.43 C ATOM 774 C GLU A 840 14.740 -17.172 11.707 1.00 43.20 C ATOM 775 O GLU A 840 14.883 -16.008 12.079 1.00 50.03 O ATOM 776 CB GLU A 840 16.750 -17.494 10.218 1.00 53.44 C ATOM 777 CG GLU A 840 15.965 -17.655 8.914 1.00 33.53 C ATOM 778 CD GLU A 840 16.440 -16.653 7.860 1.00 35.22 C ATOM 779 OE1 GLU A 840 16.826 -17.055 6.753 1.00 45.13 O ATOM 780 OE2 GLU A 840 16.396 -15.417 8.225 1.00 52.41 O ATOM 0 H GLU A 840 15.177 -19.596 10.232 1.00 12.52 H new ATOM 0 HA GLU A 840 16.617 -18.031 12.276 1.00 54.43 H new ATOM 0 HB2 GLU A 840 16.974 -16.440 10.384 1.00 53.44 H new ATOM 0 HB3 GLU A 840 17.705 -18.014 10.138 1.00 53.44 H new ATOM 0 HG2 GLU A 840 16.085 -18.670 8.536 1.00 33.53 H new ATOM 0 HG3 GLU A 840 14.902 -17.510 9.105 1.00 33.53 H new ATOM 788 N CYS A 841 13.569 -17.767 11.535 1.00 10.53 N ATOM 789 CA CYS A 841 12.326 -17.057 11.784 1.00 13.21 C ATOM 790 C CYS A 841 11.896 -17.332 13.226 1.00 34.43 C ATOM 791 O CYS A 841 11.044 -16.630 13.769 1.00 41.22 O ATOM 792 CB CYS A 841 11.240 -17.449 10.780 1.00 51.21 C ATOM 793 SG CYS A 841 11.387 -16.427 9.269 1.00 61.54 S ATOM 0 H CYS A 841 13.455 -18.732 11.226 1.00 10.53 H new ATOM 0 HA CYS A 841 12.483 -15.987 11.651 1.00 13.21 H new ATOM 0 HB2 CYS A 841 11.332 -18.505 10.525 1.00 51.21 H new ATOM 0 HB3 CYS A 841 10.255 -17.314 11.226 1.00 51.21 H new ATOM 0 HG CYS A 841 10.462 -16.769 8.422 1.00 61.54 H new ATOM 799 N PHE A 842 12.504 -18.357 13.806 1.00 1.41 N ATOM 800 CA PHE A 842 12.195 -18.734 15.175 1.00 53.42 C ATOM 801 C PHE A 842 13.453 -18.721 16.045 1.00 63.22 C ATOM 802 O PHE A 842 14.506 -18.252 15.614 1.00 74.22 O ATOM 803 CB PHE A 842 11.634 -20.156 15.131 1.00 75.21 C ATOM 804 CG PHE A 842 12.673 -21.244 15.408 1.00 62.12 C ATOM 805 CD1 PHE A 842 13.760 -21.368 14.600 1.00 41.53 C ATOM 806 CD2 PHE A 842 12.510 -22.088 16.462 1.00 5.43 C ATOM 807 CE1 PHE A 842 14.725 -22.377 14.857 1.00 60.12 C ATOM 808 CE2 PHE A 842 13.475 -23.097 16.719 1.00 24.13 C ATOM 809 CZ PHE A 842 14.562 -23.221 15.911 1.00 3.42 C ATOM 0 H PHE A 842 13.209 -18.938 13.353 1.00 1.41 H new ATOM 0 HA PHE A 842 11.483 -18.029 15.603 1.00 53.42 H new ATOM 0 HB2 PHE A 842 10.830 -20.241 15.862 1.00 75.21 H new ATOM 0 HB3 PHE A 842 11.192 -20.331 14.150 1.00 75.21 H new ATOM 0 HD1 PHE A 842 13.889 -20.699 13.762 1.00 41.53 H new ATOM 0 HD2 PHE A 842 11.647 -21.991 17.103 1.00 5.43 H new ATOM 0 HE1 PHE A 842 15.588 -22.474 14.216 1.00 60.12 H new ATOM 0 HE2 PHE A 842 13.346 -23.766 17.557 1.00 24.13 H new ATOM 0 HZ PHE A 842 15.295 -23.989 16.106 1.00 3.42 H new ATOM 819 N VAL A 843 13.303 -19.242 17.254 1.00 65.23 N ATOM 820 CA VAL A 843 14.415 -19.297 18.188 1.00 10.11 C ATOM 821 C VAL A 843 14.280 -20.546 19.062 1.00 41.33 C ATOM 822 O VAL A 843 13.223 -21.174 19.094 1.00 62.13 O ATOM 823 CB VAL A 843 14.479 -18.003 19.001 1.00 2.53 C ATOM 824 CG1 VAL A 843 14.263 -16.781 18.106 1.00 63.13 C ATOM 825 CG2 VAL A 843 13.469 -18.026 20.150 1.00 53.01 C ATOM 0 H VAL A 843 12.429 -19.630 17.608 1.00 65.23 H new ATOM 0 HA VAL A 843 15.361 -19.376 17.652 1.00 10.11 H new ATOM 0 HB VAL A 843 15.477 -17.929 19.434 1.00 2.53 H new ATOM 0 HG11 VAL A 843 14.313 -15.875 18.709 1.00 63.13 H new ATOM 0 HG12 VAL A 843 15.037 -16.750 17.339 1.00 63.13 H new ATOM 0 HG13 VAL A 843 13.284 -16.846 17.631 1.00 63.13 H new ATOM 0 HG21 VAL A 843 13.536 -17.094 20.712 1.00 53.01 H new ATOM 0 HG22 VAL A 843 12.462 -18.136 19.747 1.00 53.01 H new ATOM 0 HG23 VAL A 843 13.689 -18.865 20.811 1.00 53.01 H new ATOM 835 N SER A 844 15.366 -20.868 19.749 1.00 70.10 N ATOM 836 CA SER A 844 15.382 -22.031 20.621 1.00 43.44 C ATOM 837 C SER A 844 16.231 -21.743 21.860 1.00 24.15 C ATOM 838 O SER A 844 17.296 -21.135 21.761 1.00 70.01 O ATOM 839 CB SER A 844 15.915 -23.262 19.886 1.00 24.31 C ATOM 840 OG SER A 844 17.337 -23.346 19.947 1.00 73.34 O ATOM 0 H SER A 844 16.241 -20.344 19.720 1.00 70.10 H new ATOM 0 HA SER A 844 14.358 -22.242 20.931 1.00 43.44 H new ATOM 0 HB2 SER A 844 15.480 -24.161 20.322 1.00 24.31 H new ATOM 0 HB3 SER A 844 15.598 -23.227 18.844 1.00 24.31 H new ATOM 0 HG SER A 844 17.638 -24.146 19.468 1.00 73.34 H new ATOM 846 N ARG A 845 15.729 -22.194 23.000 1.00 34.03 N ATOM 847 CA ARG A 845 16.428 -21.993 24.258 1.00 14.12 C ATOM 848 C ARG A 845 16.727 -23.339 24.920 1.00 33.34 C ATOM 849 O ARG A 845 15.823 -24.147 25.128 1.00 31.33 O ATOM 850 CB ARG A 845 15.601 -21.133 25.217 1.00 73.55 C ATOM 851 CG ARG A 845 14.748 -20.121 24.449 1.00 62.35 C ATOM 852 CD ARG A 845 15.629 -19.140 23.672 1.00 73.21 C ATOM 853 NE ARG A 845 16.192 -18.128 24.593 1.00 52.54 N ATOM 854 CZ ARG A 845 15.537 -17.014 24.985 1.00 42.23 C ATOM 855 NH1 ARG A 845 14.289 -16.760 24.538 1.00 34.14 N ATOM 856 NH2 ARG A 845 16.136 -16.177 25.811 1.00 44.42 N ATOM 0 H ARG A 845 14.846 -22.698 23.079 1.00 34.03 H new ATOM 0 HA ARG A 845 17.362 -21.476 24.039 1.00 14.12 H new ATOM 0 HB2 ARG A 845 14.957 -21.772 25.821 1.00 73.55 H new ATOM 0 HB3 ARG A 845 16.264 -20.608 25.904 1.00 73.55 H new ATOM 0 HG2 ARG A 845 14.087 -20.646 23.760 1.00 62.35 H new ATOM 0 HG3 ARG A 845 14.113 -19.573 25.145 1.00 62.35 H new ATOM 0 HD2 ARG A 845 16.435 -19.678 23.173 1.00 73.21 H new ATOM 0 HD3 ARG A 845 15.044 -18.650 22.894 1.00 73.21 H new ATOM 0 HE ARG A 845 17.133 -18.281 24.954 1.00 52.54 H new ATOM 0 HH11 ARG A 845 13.834 -17.412 23.899 1.00 34.14 H new ATOM 0 HH12 ARG A 845 13.801 -15.916 24.839 1.00 34.14 H new ATOM 0 HH21 ARG A 845 17.080 -16.376 26.143 1.00 44.42 H new ATOM 0 HH22 ARG A 845 15.655 -15.331 26.117 1.00 44.42 H new ATOM 869 N PRO A 846 18.032 -23.544 25.242 1.00 62.52 N ATOM 870 CA PRO A 846 18.462 -24.779 25.876 1.00 33.02 C ATOM 871 C PRO A 846 18.058 -24.807 27.352 1.00 42.52 C ATOM 872 O PRO A 846 18.555 -24.014 28.150 1.00 45.41 O ATOM 873 CB PRO A 846 19.967 -24.824 25.671 1.00 1.30 C ATOM 874 CG PRO A 846 20.385 -23.400 25.342 1.00 4.22 C ATOM 875 CD PRO A 846 19.130 -22.610 25.011 1.00 71.04 C ATOM 0 HA PRO A 846 17.989 -25.661 25.444 1.00 33.02 H new ATOM 0 HB2 PRO A 846 20.473 -25.182 26.568 1.00 1.30 H new ATOM 0 HB3 PRO A 846 20.231 -25.505 24.862 1.00 1.30 H new ATOM 0 HG2 PRO A 846 20.907 -22.951 26.187 1.00 4.22 H new ATOM 0 HG3 PRO A 846 21.076 -23.390 24.499 1.00 4.22 H new ATOM 0 HD2 PRO A 846 19.039 -21.728 25.644 1.00 71.04 H new ATOM 0 HD3 PRO A 846 19.143 -22.261 23.978 1.00 71.04 H new ATOM 1029 N PHE A 856 6.185 -36.126 23.712 1.00 54.01 N ATOM 1030 CA PHE A 856 7.340 -36.479 22.904 1.00 54.52 C ATOM 1031 C PHE A 856 8.642 -36.186 23.651 1.00 10.54 C ATOM 1032 O PHE A 856 8.618 -35.800 24.819 1.00 3.22 O ATOM 1033 CB PHE A 856 7.284 -35.614 21.643 1.00 72.13 C ATOM 1034 CG PHE A 856 7.843 -36.299 20.394 1.00 51.42 C ATOM 1035 CD1 PHE A 856 7.491 -37.580 20.106 1.00 65.50 C ATOM 1036 CD2 PHE A 856 8.691 -35.625 19.571 1.00 23.14 C ATOM 1037 CE1 PHE A 856 8.010 -38.216 18.947 1.00 43.22 C ATOM 1038 CE2 PHE A 856 9.210 -36.260 18.412 1.00 21.33 C ATOM 1039 CZ PHE A 856 8.859 -37.542 18.124 1.00 33.24 C ATOM 0 HA PHE A 856 7.319 -37.543 22.669 1.00 54.52 H new ATOM 0 HB2 PHE A 856 6.249 -35.329 21.456 1.00 72.13 H new ATOM 0 HB3 PHE A 856 7.841 -34.694 21.821 1.00 72.13 H new ATOM 0 HD1 PHE A 856 6.816 -38.114 20.759 1.00 65.50 H new ATOM 0 HD2 PHE A 856 8.969 -34.607 19.799 1.00 23.14 H new ATOM 0 HE1 PHE A 856 7.731 -39.234 18.719 1.00 43.22 H new ATOM 0 HE2 PHE A 856 9.884 -35.725 17.759 1.00 21.33 H new ATOM 0 HZ PHE A 856 9.254 -38.025 17.242 1.00 33.24 H new ATOM 1049 N GLU A 857 9.748 -36.380 22.948 1.00 55.24 N ATOM 1050 CA GLU A 857 11.057 -36.141 23.530 1.00 22.20 C ATOM 1051 C GLU A 857 11.488 -34.693 23.291 1.00 4.22 C ATOM 1052 O GLU A 857 11.886 -34.334 22.184 1.00 61.42 O ATOM 1053 CB GLU A 857 12.092 -37.120 22.972 1.00 30.43 C ATOM 1054 CG GLU A 857 11.512 -38.532 22.870 1.00 35.31 C ATOM 1055 CD GLU A 857 12.619 -39.586 22.932 1.00 61.22 C ATOM 1056 OE1 GLU A 857 12.453 -40.622 23.594 1.00 44.51 O ATOM 1057 OE2 GLU A 857 13.682 -39.300 22.259 1.00 1.04 O ATOM 0 H GLU A 857 9.764 -36.700 21.980 1.00 55.24 H new ATOM 0 HA GLU A 857 10.991 -36.307 24.605 1.00 22.20 H new ATOM 0 HB2 GLU A 857 12.420 -36.786 21.988 1.00 30.43 H new ATOM 0 HB3 GLU A 857 12.972 -37.130 23.615 1.00 30.43 H new ATOM 0 HG2 GLU A 857 10.802 -38.697 23.681 1.00 35.31 H new ATOM 0 HG3 GLU A 857 10.959 -38.635 21.936 1.00 35.31 H new ATOM 1065 N LYS A 858 11.395 -33.899 24.348 1.00 20.21 N ATOM 1066 CA LYS A 858 11.771 -32.498 24.267 1.00 14.22 C ATOM 1067 C LYS A 858 13.039 -32.266 25.091 1.00 13.21 C ATOM 1068 O LYS A 858 13.136 -32.722 26.229 1.00 21.51 O ATOM 1069 CB LYS A 858 10.598 -31.604 24.678 1.00 63.51 C ATOM 1070 CG LYS A 858 9.891 -32.162 25.914 1.00 33.44 C ATOM 1071 CD LYS A 858 9.162 -31.054 26.676 1.00 53.41 C ATOM 1072 CE LYS A 858 8.238 -31.639 27.746 1.00 23.22 C ATOM 1073 NZ LYS A 858 8.955 -32.654 28.551 1.00 44.44 N ATOM 0 H LYS A 858 11.065 -34.200 25.265 1.00 20.21 H new ATOM 0 HA LYS A 858 12.005 -32.225 23.238 1.00 14.22 H new ATOM 0 HB2 LYS A 858 10.959 -30.597 24.885 1.00 63.51 H new ATOM 0 HB3 LYS A 858 9.889 -31.526 23.854 1.00 63.51 H new ATOM 0 HG2 LYS A 858 9.179 -32.931 25.614 1.00 33.44 H new ATOM 0 HG3 LYS A 858 10.619 -32.640 26.569 1.00 33.44 H new ATOM 0 HD2 LYS A 858 9.889 -30.390 27.143 1.00 53.41 H new ATOM 0 HD3 LYS A 858 8.580 -30.451 25.979 1.00 53.41 H new ATOM 0 HE2 LYS A 858 7.873 -30.843 28.395 1.00 23.22 H new ATOM 0 HE3 LYS A 858 7.365 -32.090 27.274 1.00 23.22 H new ATOM 0 HZ1 LYS A 858 8.432 -32.831 29.433 1.00 44.44 H new ATOM 0 HZ2 LYS A 858 9.028 -33.539 28.009 1.00 44.44 H new ATOM 0 HZ3 LYS A 858 9.909 -32.307 28.778 1.00 44.44 H new ATOM 1086 N ARG A 859 13.979 -31.556 24.484 1.00 33.33 N ATOM 1087 CA ARG A 859 15.237 -31.258 25.148 1.00 73.15 C ATOM 1088 C ARG A 859 15.574 -29.773 25.003 1.00 13.35 C ATOM 1089 O ARG A 859 16.707 -29.363 25.249 1.00 2.03 O ATOM 1090 CB ARG A 859 16.379 -32.092 24.563 1.00 34.12 C ATOM 1091 CG ARG A 859 17.460 -32.353 25.614 1.00 70.44 C ATOM 1092 CD ARG A 859 17.095 -33.553 26.490 1.00 74.31 C ATOM 1093 NE ARG A 859 16.749 -34.714 25.640 1.00 61.34 N ATOM 1094 CZ ARG A 859 17.654 -35.453 24.963 1.00 22.24 C ATOM 1095 NH1 ARG A 859 18.970 -35.157 25.033 1.00 75.33 N ATOM 1096 NH2 ARG A 859 17.234 -36.469 24.233 1.00 33.43 N ATOM 0 H ARG A 859 13.895 -31.179 23.540 1.00 33.33 H new ATOM 0 HA ARG A 859 15.123 -31.507 26.203 1.00 73.15 H new ATOM 0 HB2 ARG A 859 15.989 -33.040 24.193 1.00 34.12 H new ATOM 0 HB3 ARG A 859 16.814 -31.572 23.710 1.00 34.12 H new ATOM 0 HG2 ARG A 859 18.415 -32.535 25.121 1.00 70.44 H new ATOM 0 HG3 ARG A 859 17.587 -31.468 26.238 1.00 70.44 H new ATOM 0 HD2 ARG A 859 17.931 -33.806 27.142 1.00 74.31 H new ATOM 0 HD3 ARG A 859 16.253 -33.300 27.135 1.00 74.31 H new ATOM 0 HE ARG A 859 15.765 -34.972 25.561 1.00 61.34 H new ATOM 0 HH11 ARG A 859 19.286 -34.370 25.600 1.00 75.33 H new ATOM 0 HH12 ARG A 859 19.647 -35.720 24.519 1.00 75.33 H new ATOM 0 HH21 ARG A 859 16.239 -36.686 24.186 1.00 33.43 H new ATOM 0 HH22 ARG A 859 17.905 -37.037 23.716 1.00 33.43 H new ATOM 1109 N ALA A 860 14.569 -29.007 24.606 1.00 53.54 N ATOM 1110 CA ALA A 860 14.744 -27.575 24.426 1.00 63.31 C ATOM 1111 C ALA A 860 13.402 -26.944 24.051 1.00 32.33 C ATOM 1112 O ALA A 860 12.467 -27.646 23.670 1.00 73.42 O ATOM 1113 CB ALA A 860 15.822 -27.322 23.371 1.00 45.35 C ATOM 0 H ALA A 860 13.630 -29.351 24.404 1.00 53.54 H new ATOM 0 HA ALA A 860 15.079 -27.110 25.353 1.00 63.31 H new ATOM 0 HB1 ALA A 860 15.954 -26.248 23.236 1.00 45.35 H new ATOM 0 HB2 ALA A 860 16.763 -27.765 23.699 1.00 45.35 H new ATOM 0 HB3 ALA A 860 15.519 -27.772 22.426 1.00 45.35 H new ATOM 1119 N LYS A 861 13.349 -25.626 24.173 1.00 23.02 N ATOM 1120 CA LYS A 861 12.137 -24.892 23.852 1.00 32.42 C ATOM 1121 C LYS A 861 12.360 -24.080 22.575 1.00 64.20 C ATOM 1122 O LYS A 861 13.487 -23.972 22.093 1.00 0.44 O ATOM 1123 CB LYS A 861 11.689 -24.048 25.047 1.00 30.42 C ATOM 1124 CG LYS A 861 10.858 -24.881 26.026 1.00 42.01 C ATOM 1125 CD LYS A 861 11.489 -26.257 26.248 1.00 3.11 C ATOM 1126 CE LYS A 861 10.919 -26.926 27.500 1.00 11.13 C ATOM 1127 NZ LYS A 861 11.891 -27.892 28.060 1.00 13.43 N ATOM 0 H LYS A 861 14.127 -25.047 24.490 1.00 23.02 H new ATOM 0 HA LYS A 861 11.316 -25.581 23.652 1.00 32.42 H new ATOM 0 HB2 LYS A 861 12.562 -23.643 25.559 1.00 30.42 H new ATOM 0 HB3 LYS A 861 11.102 -23.199 24.697 1.00 30.42 H new ATOM 0 HG2 LYS A 861 10.777 -24.356 26.978 1.00 42.01 H new ATOM 0 HG3 LYS A 861 9.845 -24.999 25.640 1.00 42.01 H new ATOM 0 HD2 LYS A 861 11.307 -26.889 25.379 1.00 3.11 H new ATOM 0 HD3 LYS A 861 12.570 -26.154 26.346 1.00 3.11 H new ATOM 0 HE2 LYS A 861 10.679 -26.169 28.246 1.00 11.13 H new ATOM 0 HE3 LYS A 861 9.989 -27.438 27.254 1.00 11.13 H new ATOM 0 HZ1 LYS A 861 11.488 -28.337 28.909 1.00 13.43 H new ATOM 0 HZ2 LYS A 861 12.100 -28.624 27.352 1.00 13.43 H new ATOM 0 HZ3 LYS A 861 12.768 -27.394 28.313 1.00 13.43 H new ATOM 1140 N ILE A 862 11.269 -23.531 22.063 1.00 41.43 N ATOM 1141 CA ILE A 862 11.332 -22.732 20.851 1.00 51.43 C ATOM 1142 C ILE A 862 10.353 -21.562 20.965 1.00 13.40 C ATOM 1143 O ILE A 862 9.288 -21.695 21.567 1.00 42.03 O ATOM 1144 CB ILE A 862 11.101 -23.608 19.618 1.00 21.53 C ATOM 1145 CG1 ILE A 862 9.607 -23.757 19.323 1.00 22.00 C ATOM 1146 CG2 ILE A 862 11.792 -24.965 19.773 1.00 5.41 C ATOM 1147 CD1 ILE A 862 9.133 -22.684 18.341 1.00 10.54 C ATOM 0 H ILE A 862 10.336 -23.624 22.465 1.00 41.43 H new ATOM 0 HA ILE A 862 12.327 -22.305 20.728 1.00 51.43 H new ATOM 0 HB ILE A 862 11.551 -23.113 18.758 1.00 21.53 H new ATOM 0 HG12 ILE A 862 9.411 -24.746 18.909 1.00 22.00 H new ATOM 0 HG13 ILE A 862 9.040 -23.682 20.251 1.00 22.00 H new ATOM 0 HG21 ILE A 862 11.612 -25.569 18.883 1.00 5.41 H new ATOM 0 HG22 ILE A 862 12.864 -24.815 19.899 1.00 5.41 H new ATOM 0 HG23 ILE A 862 11.392 -25.479 20.647 1.00 5.41 H new ATOM 0 HD11 ILE A 862 8.068 -22.812 18.148 1.00 10.54 H new ATOM 0 HD12 ILE A 862 9.308 -21.697 18.768 1.00 10.54 H new ATOM 0 HD13 ILE A 862 9.685 -22.777 17.406 1.00 10.54 H new ATOM 1159 N PHE A 863 10.748 -20.441 20.378 1.00 33.41 N ATOM 1160 CA PHE A 863 9.918 -19.249 20.407 1.00 41.24 C ATOM 1161 C PHE A 863 10.066 -18.447 19.112 1.00 4.31 C ATOM 1162 O PHE A 863 10.967 -18.707 18.316 1.00 71.32 O ATOM 1163 CB PHE A 863 10.403 -18.395 21.580 1.00 54.10 C ATOM 1164 CG PHE A 863 10.485 -19.151 22.908 1.00 72.14 C ATOM 1165 CD1 PHE A 863 11.505 -20.022 23.132 1.00 31.10 C ATOM 1166 CD2 PHE A 863 9.538 -18.952 23.863 1.00 32.03 C ATOM 1167 CE1 PHE A 863 11.581 -20.724 24.364 1.00 2.22 C ATOM 1168 CE2 PHE A 863 9.614 -19.654 25.095 1.00 2.33 C ATOM 1169 CZ PHE A 863 10.634 -20.525 25.320 1.00 42.31 C ATOM 0 H PHE A 863 11.632 -20.334 19.880 1.00 33.41 H new ATOM 0 HA PHE A 863 8.870 -19.528 20.513 1.00 41.24 H new ATOM 0 HB2 PHE A 863 11.388 -17.993 21.341 1.00 54.10 H new ATOM 0 HB3 PHE A 863 9.732 -17.544 21.699 1.00 54.10 H new ATOM 0 HD1 PHE A 863 12.257 -20.180 22.373 1.00 31.10 H new ATOM 0 HD2 PHE A 863 8.728 -18.260 23.685 1.00 32.03 H new ATOM 0 HE1 PHE A 863 12.391 -21.416 24.542 1.00 2.22 H new ATOM 0 HE2 PHE A 863 8.862 -19.496 25.854 1.00 2.33 H new ATOM 0 HZ PHE A 863 10.692 -21.058 26.257 1.00 42.31 H new ATOM 1179 N CYS A 864 9.169 -17.487 18.942 1.00 32.11 N ATOM 1180 CA CYS A 864 9.188 -16.645 17.758 1.00 64.21 C ATOM 1181 C CYS A 864 10.454 -15.786 17.800 1.00 32.30 C ATOM 1182 O CYS A 864 10.840 -15.295 18.860 1.00 54.35 O ATOM 1183 CB CYS A 864 7.923 -15.792 17.649 1.00 31.23 C ATOM 1184 SG CYS A 864 7.686 -15.241 15.920 1.00 23.04 S ATOM 0 H CYS A 864 8.424 -17.273 19.605 1.00 32.11 H new ATOM 0 HA CYS A 864 9.203 -17.270 16.865 1.00 64.21 H new ATOM 0 HB2 CYS A 864 7.057 -16.367 17.978 1.00 31.23 H new ATOM 0 HB3 CYS A 864 8.000 -14.927 18.308 1.00 31.23 H new ATOM 0 HG CYS A 864 7.288 -16.244 15.196 1.00 23.04 H new ATOM 1190 N ALA A 865 11.065 -15.632 16.635 1.00 52.24 N ATOM 1191 CA ALA A 865 12.279 -14.841 16.525 1.00 13.31 C ATOM 1192 C ALA A 865 11.908 -13.374 16.298 1.00 54.13 C ATOM 1193 O ALA A 865 12.744 -12.486 16.457 1.00 21.45 O ATOM 1194 CB ALA A 865 13.154 -15.401 15.402 1.00 21.45 C ATOM 0 H ALA A 865 10.742 -16.042 15.758 1.00 52.24 H new ATOM 0 HA ALA A 865 12.857 -14.896 17.447 1.00 13.31 H new ATOM 0 HB1 ALA A 865 14.064 -14.807 15.320 1.00 21.45 H new ATOM 0 HB2 ALA A 865 13.414 -16.436 15.625 1.00 21.45 H new ATOM 0 HB3 ALA A 865 12.608 -15.359 14.460 1.00 21.45 H new ATOM 1200 N ARG A 866 10.653 -13.165 15.928 1.00 15.35 N ATOM 1201 CA ARG A 866 10.160 -11.821 15.678 1.00 44.35 C ATOM 1202 C ARG A 866 10.353 -10.945 16.917 1.00 0.21 C ATOM 1203 O ARG A 866 10.938 -11.383 17.906 1.00 21.14 O ATOM 1204 CB ARG A 866 8.678 -11.839 15.300 1.00 50.34 C ATOM 1205 CG ARG A 866 8.495 -12.140 13.811 1.00 44.45 C ATOM 1206 CD ARG A 866 8.755 -10.892 12.963 1.00 23.33 C ATOM 1207 NE ARG A 866 8.051 -9.729 13.547 1.00 43.54 N ATOM 1208 CZ ARG A 866 8.402 -8.444 13.326 1.00 54.40 C ATOM 1209 NH1 ARG A 866 9.452 -8.146 12.532 1.00 71.44 N ATOM 1210 NH2 ARG A 866 7.702 -7.482 13.899 1.00 73.02 N ATOM 0 H ARG A 866 9.963 -13.904 15.795 1.00 15.35 H new ATOM 0 HA ARG A 866 10.730 -11.409 14.846 1.00 44.35 H new ATOM 0 HB2 ARG A 866 8.157 -12.590 15.893 1.00 50.34 H new ATOM 0 HB3 ARG A 866 8.227 -10.876 15.538 1.00 50.34 H new ATOM 0 HG2 ARG A 866 9.176 -12.936 13.511 1.00 44.45 H new ATOM 0 HG3 ARG A 866 7.483 -12.502 13.631 1.00 44.45 H new ATOM 0 HD2 ARG A 866 9.825 -10.692 12.913 1.00 23.33 H new ATOM 0 HD3 ARG A 866 8.414 -11.059 11.941 1.00 23.33 H new ATOM 0 HE ARG A 866 7.251 -9.909 14.154 1.00 43.54 H new ATOM 0 HH11 ARG A 866 9.988 -8.895 12.093 1.00 71.44 H new ATOM 0 HH12 ARG A 866 9.709 -7.172 12.371 1.00 71.44 H new ATOM 0 HH21 ARG A 866 6.910 -7.715 14.498 1.00 73.02 H new ATOM 0 HH22 ARG A 866 7.953 -6.506 13.743 1.00 73.02 H new ATOM 1223 N GLN A 867 9.850 -9.723 16.823 1.00 13.11 N ATOM 1224 CA GLN A 867 9.959 -8.782 17.925 1.00 40.44 C ATOM 1225 C GLN A 867 9.397 -9.398 19.207 1.00 24.14 C ATOM 1226 O GLN A 867 9.773 -8.999 20.308 1.00 25.04 O ATOM 1227 CB GLN A 867 9.252 -7.466 17.594 1.00 42.34 C ATOM 1228 CG GLN A 867 9.859 -6.304 18.382 1.00 2.34 C ATOM 1229 CD GLN A 867 11.314 -6.064 17.973 1.00 30.13 C ATOM 1230 OE1 GLN A 867 11.810 -6.609 17.001 1.00 41.53 O ATOM 1231 NE2 GLN A 867 11.968 -5.221 18.768 1.00 74.31 N ATOM 0 H GLN A 867 9.366 -9.363 16.001 1.00 13.11 H new ATOM 0 HA GLN A 867 11.014 -8.560 18.084 1.00 40.44 H new ATOM 0 HB2 GLN A 867 9.331 -7.266 16.525 1.00 42.34 H new ATOM 0 HB3 GLN A 867 8.190 -7.551 17.825 1.00 42.34 H new ATOM 0 HG2 GLN A 867 9.275 -5.400 18.210 1.00 2.34 H new ATOM 0 HG3 GLN A 867 9.808 -6.518 19.450 1.00 2.34 H new ATOM 0 HE21 GLN A 867 11.492 -4.799 19.566 1.00 74.31 H new ATOM 0 HE22 GLN A 867 12.945 -4.996 18.580 1.00 74.31 H new ATOM 1240 N ASN A 868 8.506 -10.361 19.022 1.00 1.24 N ATOM 1241 CA ASN A 868 7.889 -11.036 20.151 1.00 30.32 C ATOM 1242 C ASN A 868 8.649 -12.332 20.442 1.00 11.03 C ATOM 1243 O ASN A 868 8.508 -13.315 19.716 1.00 2.21 O ATOM 1244 CB ASN A 868 6.434 -11.400 19.847 1.00 2.53 C ATOM 1245 CG ASN A 868 5.647 -10.171 19.389 1.00 55.34 C ATOM 1246 OD1 ASN A 868 5.676 -9.778 18.234 1.00 73.12 O ATOM 1247 ND2 ASN A 868 4.943 -9.587 20.355 1.00 71.53 N ATOM 0 H ASN A 868 8.197 -10.690 18.107 1.00 1.24 H new ATOM 0 HA ASN A 868 7.921 -10.361 21.006 1.00 30.32 H new ATOM 0 HB2 ASN A 868 6.401 -12.167 19.073 1.00 2.53 H new ATOM 0 HB3 ASN A 868 5.968 -11.824 20.736 1.00 2.53 H new ATOM 0 HD21 ASN A 868 4.384 -8.759 20.149 1.00 71.53 H new ATOM 0 HD22 ASN A 868 4.962 -9.967 21.301 1.00 71.53 H new ATOM 1254 N CYS A 869 9.438 -12.292 21.506 1.00 14.50 N ATOM 1255 CA CYS A 869 10.220 -13.450 21.902 1.00 31.21 C ATOM 1256 C CYS A 869 9.598 -14.040 23.169 1.00 14.33 C ATOM 1257 O CYS A 869 9.803 -15.212 23.478 1.00 30.44 O ATOM 1258 CB CYS A 869 11.695 -13.095 22.102 1.00 33.34 C ATOM 1259 SG CYS A 869 12.743 -14.551 21.741 1.00 3.11 S ATOM 0 H CYS A 869 9.552 -11.475 22.106 1.00 14.50 H new ATOM 0 HA CYS A 869 10.198 -14.196 21.107 1.00 31.21 H new ATOM 0 HB2 CYS A 869 11.970 -12.267 21.448 1.00 33.34 H new ATOM 0 HB3 CYS A 869 11.862 -12.761 23.126 1.00 33.34 H new ATOM 0 HG CYS A 869 12.303 -15.148 20.673 1.00 3.11 H new ATOM 1265 N SER A 870 8.849 -13.199 23.869 1.00 64.32 N ATOM 1266 CA SER A 870 8.196 -13.623 25.096 1.00 53.54 C ATOM 1267 C SER A 870 7.094 -14.636 24.779 1.00 42.02 C ATOM 1268 O SER A 870 6.523 -15.241 25.685 1.00 64.42 O ATOM 1269 CB SER A 870 7.615 -12.426 25.851 1.00 14.21 C ATOM 1270 OG SER A 870 6.666 -12.826 26.837 1.00 42.14 O ATOM 0 H SER A 870 8.680 -12.227 23.610 1.00 64.32 H new ATOM 0 HA SER A 870 8.942 -14.095 25.736 1.00 53.54 H new ATOM 0 HB2 SER A 870 8.423 -11.872 26.329 1.00 14.21 H new ATOM 0 HB3 SER A 870 7.139 -11.748 25.143 1.00 14.21 H new ATOM 0 HG SER A 870 6.608 -13.804 26.857 1.00 42.14 H new ATOM 1276 N HIS A 871 6.828 -14.789 23.490 1.00 65.50 N ATOM 1277 CA HIS A 871 5.805 -15.719 23.042 1.00 24.23 C ATOM 1278 C HIS A 871 6.439 -17.083 22.762 1.00 31.40 C ATOM 1279 O HIS A 871 7.492 -17.165 22.132 1.00 60.32 O ATOM 1280 CB HIS A 871 5.051 -15.157 21.836 1.00 12.10 C ATOM 1281 CG HIS A 871 3.720 -15.823 21.579 1.00 12.45 C ATOM 1282 ND1 HIS A 871 2.686 -15.810 22.499 1.00 34.01 N ATOM 1283 CD2 HIS A 871 3.265 -16.519 20.498 1.00 24.24 C ATOM 1284 CE1 HIS A 871 1.660 -16.473 21.985 1.00 44.14 C ATOM 1285 NE2 HIS A 871 2.022 -16.912 20.745 1.00 72.11 N ATOM 0 H HIS A 871 7.303 -14.285 22.742 1.00 65.50 H new ATOM 0 HA HIS A 871 5.063 -15.856 23.829 1.00 24.23 H new ATOM 0 HB2 HIS A 871 4.889 -14.090 21.987 1.00 12.10 H new ATOM 0 HB3 HIS A 871 5.676 -15.262 20.949 1.00 12.10 H new ATOM 0 HD1 HIS A 871 2.710 -15.366 23.417 1.00 34.01 H new ATOM 0 HD2 HIS A 871 3.822 -16.717 19.594 1.00 24.24 H new ATOM 0 HE1 HIS A 871 0.706 -16.637 22.463 1.00 44.14 H new ATOM 1293 N ASP A 872 5.770 -18.121 23.244 1.00 3.31 N ATOM 1294 CA ASP A 872 6.255 -19.477 23.054 1.00 74.34 C ATOM 1295 C ASP A 872 5.426 -20.162 21.964 1.00 1.44 C ATOM 1296 O ASP A 872 4.244 -20.440 22.161 1.00 2.41 O ATOM 1297 CB ASP A 872 6.116 -20.297 24.338 1.00 61.01 C ATOM 1298 CG ASP A 872 6.468 -19.547 25.625 1.00 71.55 C ATOM 1299 OD1 ASP A 872 6.265 -20.057 26.736 1.00 31.35 O ATOM 1300 OD2 ASP A 872 6.978 -18.375 25.451 1.00 70.45 O ATOM 0 H ASP A 872 4.896 -18.050 23.766 1.00 3.31 H new ATOM 0 HA ASP A 872 7.307 -19.423 22.773 1.00 74.34 H new ATOM 0 HB2 ASP A 872 5.089 -20.655 24.413 1.00 61.01 H new ATOM 0 HB3 ASP A 872 6.756 -21.176 24.261 1.00 61.01 H new ATOM 1306 N TRP A 873 6.079 -20.413 20.839 1.00 21.44 N ATOM 1307 CA TRP A 873 5.418 -21.060 19.719 1.00 54.12 C ATOM 1308 C TRP A 873 5.119 -22.507 20.117 1.00 52.22 C ATOM 1309 O TRP A 873 3.958 -22.887 20.264 1.00 3.34 O ATOM 1310 CB TRP A 873 6.262 -20.952 18.447 1.00 13.23 C ATOM 1311 CG TRP A 873 6.022 -19.669 17.649 1.00 43.04 C ATOM 1312 CD1 TRP A 873 5.369 -18.565 18.037 1.00 74.44 C ATOM 1313 CD2 TRP A 873 6.464 -19.400 16.301 1.00 32.12 C ATOM 1314 NE1 TRP A 873 5.356 -17.609 17.042 1.00 43.21 N ATOM 1315 CE2 TRP A 873 6.044 -18.133 15.953 1.00 14.41 C ATOM 1316 CE3 TRP A 873 7.194 -20.201 15.406 1.00 22.41 C ATOM 1317 CZ2 TRP A 873 6.305 -17.554 14.706 1.00 43.25 C ATOM 1318 CZ3 TRP A 873 7.447 -19.608 14.163 1.00 25.53 C ATOM 1319 CH2 TRP A 873 7.031 -18.334 13.798 1.00 44.35 C ATOM 0 H TRP A 873 7.059 -20.180 20.679 1.00 21.44 H new ATOM 0 HA TRP A 873 4.477 -20.562 19.487 1.00 54.12 H new ATOM 0 HB2 TRP A 873 7.317 -21.008 18.717 1.00 13.23 H new ATOM 0 HB3 TRP A 873 6.050 -21.810 17.809 1.00 13.23 H new ATOM 0 HD1 TRP A 873 4.910 -18.439 19.007 1.00 74.44 H new ATOM 0 HE1 TRP A 873 4.922 -16.688 17.095 1.00 43.21 H new ATOM 0 HE3 TRP A 873 7.533 -21.195 15.657 1.00 22.41 H new ATOM 0 HZ2 TRP A 873 5.965 -16.560 14.458 1.00 43.25 H new ATOM 0 HZ3 TRP A 873 8.005 -20.181 13.437 1.00 25.53 H new ATOM 0 HH2 TRP A 873 7.267 -17.947 12.818 1.00 44.35 H new ATOM 1330 N GLY A 874 6.186 -23.275 20.279 1.00 2.40 N ATOM 1331 CA GLY A 874 6.053 -24.671 20.657 1.00 31.31 C ATOM 1332 C GLY A 874 7.218 -25.113 21.545 1.00 2.30 C ATOM 1333 O GLY A 874 7.545 -24.444 22.524 1.00 1.22 O ATOM 0 H GLY A 874 7.147 -22.957 20.155 1.00 2.40 H new ATOM 0 HA2 GLY A 874 5.111 -24.820 21.186 1.00 31.31 H new ATOM 0 HA3 GLY A 874 6.018 -25.292 19.762 1.00 31.31 H new ATOM 1337 N ILE A 875 7.813 -26.236 21.171 1.00 32.01 N ATOM 1338 CA ILE A 875 8.935 -26.775 21.921 1.00 13.43 C ATOM 1339 C ILE A 875 9.885 -27.495 20.963 1.00 74.42 C ATOM 1340 O ILE A 875 9.469 -27.957 19.901 1.00 33.23 O ATOM 1341 CB ILE A 875 8.438 -27.653 23.071 1.00 31.12 C ATOM 1342 CG1 ILE A 875 7.264 -28.527 22.626 1.00 73.13 C ATOM 1343 CG2 ILE A 875 8.089 -26.806 24.297 1.00 24.41 C ATOM 1344 CD1 ILE A 875 7.703 -29.534 21.560 1.00 12.25 C ATOM 0 H ILE A 875 7.539 -26.788 20.358 1.00 32.01 H new ATOM 0 HA ILE A 875 9.503 -25.970 22.388 1.00 13.43 H new ATOM 0 HB ILE A 875 9.247 -28.323 23.362 1.00 31.12 H new ATOM 0 HG12 ILE A 875 6.855 -29.057 23.486 1.00 73.13 H new ATOM 0 HG13 ILE A 875 6.467 -27.898 22.230 1.00 73.13 H new ATOM 0 HG21 ILE A 875 7.738 -27.455 25.100 1.00 24.41 H new ATOM 0 HG22 ILE A 875 8.975 -26.264 24.629 1.00 24.41 H new ATOM 0 HG23 ILE A 875 7.305 -26.095 24.037 1.00 24.41 H new ATOM 0 HD11 ILE A 875 6.850 -30.143 21.261 1.00 12.25 H new ATOM 0 HD12 ILE A 875 8.089 -29.000 20.692 1.00 12.25 H new ATOM 0 HD13 ILE A 875 8.483 -30.178 21.967 1.00 12.25 H new ATOM 1356 N HIS A 876 11.143 -27.569 21.371 1.00 32.25 N ATOM 1357 CA HIS A 876 12.155 -28.226 20.562 1.00 22.02 C ATOM 1358 C HIS A 876 12.250 -29.701 20.956 1.00 33.43 C ATOM 1359 O HIS A 876 12.615 -30.024 22.086 1.00 44.14 O ATOM 1360 CB HIS A 876 13.495 -27.496 20.671 1.00 25.23 C ATOM 1361 CG HIS A 876 14.348 -27.588 19.428 1.00 54.11 C ATOM 1362 ND1 HIS A 876 14.763 -26.474 18.720 1.00 2.41 N ATOM 1363 CD2 HIS A 876 14.858 -28.671 18.775 1.00 30.32 C ATOM 1364 CE1 HIS A 876 15.489 -26.880 17.689 1.00 5.02 C ATOM 1365 NE2 HIS A 876 15.547 -28.242 17.725 1.00 74.33 N ATOM 0 H HIS A 876 11.485 -27.185 22.252 1.00 32.25 H new ATOM 0 HA HIS A 876 11.869 -28.185 19.511 1.00 22.02 H new ATOM 0 HB2 HIS A 876 13.308 -26.446 20.894 1.00 25.23 H new ATOM 0 HB3 HIS A 876 14.053 -27.906 21.513 1.00 25.23 H new ATOM 0 HD2 HIS A 876 14.724 -29.703 19.063 1.00 30.32 H new ATOM 0 HE1 HIS A 876 15.953 -26.244 16.950 1.00 5.02 H new ATOM 0 HE2 HIS A 876 16.039 -28.834 17.055 1.00 74.33 H new ATOM 1373 N VAL A 877 11.913 -30.558 20.003 1.00 4.02 N ATOM 1374 CA VAL A 877 11.956 -31.992 20.236 1.00 13.43 C ATOM 1375 C VAL A 877 12.894 -32.642 19.218 1.00 73.23 C ATOM 1376 O VAL A 877 13.121 -32.095 18.140 1.00 42.21 O ATOM 1377 CB VAL A 877 10.540 -32.570 20.199 1.00 15.34 C ATOM 1378 CG1 VAL A 877 9.646 -31.899 21.245 1.00 23.31 C ATOM 1379 CG2 VAL A 877 9.933 -32.446 18.800 1.00 23.41 C ATOM 0 H VAL A 877 11.609 -30.287 19.068 1.00 4.02 H new ATOM 0 HA VAL A 877 12.355 -32.206 21.228 1.00 13.43 H new ATOM 0 HB VAL A 877 10.605 -33.630 20.444 1.00 15.34 H new ATOM 0 HG11 VAL A 877 8.645 -32.328 21.197 1.00 23.31 H new ATOM 0 HG12 VAL A 877 10.064 -32.061 22.239 1.00 23.31 H new ATOM 0 HG13 VAL A 877 9.592 -30.829 21.045 1.00 23.31 H new ATOM 0 HG21 VAL A 877 8.927 -32.864 18.802 1.00 23.41 H new ATOM 0 HG22 VAL A 877 9.889 -31.395 18.514 1.00 23.41 H new ATOM 0 HG23 VAL A 877 10.551 -32.990 18.086 1.00 23.41 H new ATOM 1389 N LYS A 878 13.413 -33.801 19.595 1.00 31.21 N ATOM 1390 CA LYS A 878 14.321 -34.532 18.728 1.00 62.21 C ATOM 1391 C LYS A 878 14.289 -36.017 19.098 1.00 54.53 C ATOM 1392 O LYS A 878 14.146 -36.365 20.269 1.00 74.24 O ATOM 1393 CB LYS A 878 15.721 -33.917 18.777 1.00 0.34 C ATOM 1394 CG LYS A 878 16.787 -34.947 18.399 1.00 31.34 C ATOM 1395 CD LYS A 878 18.181 -34.318 18.395 1.00 42.54 C ATOM 1396 CE LYS A 878 19.203 -35.243 19.058 1.00 61.11 C ATOM 1397 NZ LYS A 878 18.828 -35.506 20.465 1.00 15.12 N ATOM 0 H LYS A 878 13.222 -34.252 20.490 1.00 31.21 H new ATOM 0 HA LYS A 878 14.000 -34.454 17.689 1.00 62.21 H new ATOM 0 HB2 LYS A 878 15.773 -33.068 18.095 1.00 0.34 H new ATOM 0 HB3 LYS A 878 15.919 -33.534 19.778 1.00 0.34 H new ATOM 0 HG2 LYS A 878 16.761 -35.778 19.104 1.00 31.34 H new ATOM 0 HG3 LYS A 878 16.567 -35.358 17.414 1.00 31.34 H new ATOM 0 HD2 LYS A 878 18.486 -34.109 17.370 1.00 42.54 H new ATOM 0 HD3 LYS A 878 18.154 -33.364 18.921 1.00 42.54 H new ATOM 0 HE2 LYS A 878 19.261 -36.183 18.509 1.00 61.11 H new ATOM 0 HE3 LYS A 878 20.193 -34.789 19.018 1.00 61.11 H new ATOM 0 HZ1 LYS A 878 19.688 -35.602 21.041 1.00 15.12 H new ATOM 0 HZ2 LYS A 878 18.256 -34.716 20.825 1.00 15.12 H new ATOM 0 HZ3 LYS A 878 18.275 -36.385 20.518 1.00 15.12 H new ATOM 1410 N TYR A 879 14.424 -36.851 18.077 1.00 13.24 N ATOM 1411 CA TYR A 879 14.412 -38.290 18.280 1.00 15.45 C ATOM 1412 C TYR A 879 15.353 -38.990 17.298 1.00 11.15 C ATOM 1413 O TYR A 879 15.777 -38.396 16.308 1.00 12.24 O ATOM 1414 CB TYR A 879 12.977 -38.742 18.004 1.00 75.42 C ATOM 1415 CG TYR A 879 12.311 -38.020 16.831 1.00 43.23 C ATOM 1416 CD1 TYR A 879 12.019 -36.674 16.925 1.00 33.43 C ATOM 1417 CD2 TYR A 879 12.004 -38.713 15.678 1.00 72.53 C ATOM 1418 CE1 TYR A 879 11.393 -35.994 15.821 1.00 34.42 C ATOM 1419 CE2 TYR A 879 11.378 -38.033 14.574 1.00 73.44 C ATOM 1420 CZ TYR A 879 11.103 -36.707 14.700 1.00 70.41 C ATOM 1421 OH TYR A 879 10.512 -36.065 13.657 1.00 34.21 O ATOM 0 H TYR A 879 14.542 -36.558 17.107 1.00 13.24 H new ATOM 0 HA TYR A 879 14.742 -38.539 19.289 1.00 15.45 H new ATOM 0 HB2 TYR A 879 12.977 -39.814 17.805 1.00 75.42 H new ATOM 0 HB3 TYR A 879 12.379 -38.584 18.901 1.00 75.42 H new ATOM 0 HD1 TYR A 879 12.260 -36.131 17.827 1.00 33.43 H new ATOM 0 HD2 TYR A 879 12.233 -39.766 15.604 1.00 72.53 H new ATOM 0 HE1 TYR A 879 11.159 -34.941 15.882 1.00 34.42 H new ATOM 0 HE2 TYR A 879 11.132 -38.564 13.666 1.00 73.44 H new ATOM 0 HH TYR A 879 10.365 -36.699 12.924 1.00 34.21 H new ATOM 1431 N LYS A 880 15.652 -40.243 17.607 1.00 64.10 N ATOM 1432 CA LYS A 880 16.536 -41.031 16.764 1.00 11.30 C ATOM 1433 C LYS A 880 16.239 -40.724 15.295 1.00 71.22 C ATOM 1434 O LYS A 880 17.098 -40.213 14.578 1.00 53.03 O ATOM 1435 CB LYS A 880 16.429 -42.516 17.116 1.00 2.22 C ATOM 1436 CG LYS A 880 17.383 -42.879 18.256 1.00 12.24 C ATOM 1437 CD LYS A 880 16.808 -42.453 19.609 1.00 73.13 C ATOM 1438 CE LYS A 880 17.683 -42.955 20.759 1.00 34.01 C ATOM 1439 NZ LYS A 880 17.990 -44.393 20.588 1.00 55.34 N ATOM 0 H LYS A 880 15.298 -40.732 18.429 1.00 64.10 H new ATOM 0 HA LYS A 880 17.576 -40.759 16.943 1.00 11.30 H new ATOM 0 HB2 LYS A 880 15.405 -42.752 17.405 1.00 2.22 H new ATOM 0 HB3 LYS A 880 16.660 -43.119 16.238 1.00 2.22 H new ATOM 0 HG2 LYS A 880 17.563 -43.954 18.256 1.00 12.24 H new ATOM 0 HG3 LYS A 880 18.346 -42.394 18.097 1.00 12.24 H new ATOM 0 HD2 LYS A 880 16.734 -41.366 19.651 1.00 73.13 H new ATOM 0 HD3 LYS A 880 15.797 -42.845 19.718 1.00 73.13 H new ATOM 0 HE2 LYS A 880 18.609 -42.381 20.796 1.00 34.01 H new ATOM 0 HE3 LYS A 880 17.172 -42.797 21.709 1.00 34.01 H new ATOM 0 HZ1 LYS A 880 18.229 -44.809 21.511 1.00 55.34 H new ATOM 0 HZ2 LYS A 880 17.161 -44.880 20.193 1.00 55.34 H new ATOM 0 HZ3 LYS A 880 18.796 -44.501 19.940 1.00 55.34 H new ATOM 1452 N THR A 881 15.020 -41.050 14.890 1.00 10.42 N ATOM 1453 CA THR A 881 14.599 -40.816 13.519 1.00 10.53 C ATOM 1454 C THR A 881 15.198 -39.510 12.993 1.00 11.32 C ATOM 1455 O THR A 881 16.131 -39.529 12.192 1.00 21.00 O ATOM 1456 CB THR A 881 13.070 -40.840 13.484 1.00 74.44 C ATOM 1457 OG1 THR A 881 12.715 -41.808 14.468 1.00 1.42 O ATOM 1458 CG2 THR A 881 12.524 -41.421 12.177 1.00 12.15 C ATOM 0 H THR A 881 14.310 -41.474 15.487 1.00 10.42 H new ATOM 0 HA THR A 881 14.966 -41.597 12.853 1.00 10.53 H new ATOM 0 HB THR A 881 12.688 -39.828 13.620 1.00 74.44 H new ATOM 0 HG1 THR A 881 11.739 -41.886 14.513 1.00 1.42 H new ATOM 0 HG21 THR A 881 11.434 -41.415 12.204 1.00 12.15 H new ATOM 0 HG22 THR A 881 12.870 -40.817 11.338 1.00 12.15 H new ATOM 0 HG23 THR A 881 12.879 -42.445 12.058 1.00 12.15 H new ATOM 1466 N PHE A 882 14.637 -38.406 13.465 1.00 33.21 N ATOM 1467 CA PHE A 882 15.104 -37.094 13.052 1.00 13.43 C ATOM 1468 C PHE A 882 15.043 -36.100 14.214 1.00 54.42 C ATOM 1469 O PHE A 882 14.522 -36.418 15.282 1.00 73.35 O ATOM 1470 CB PHE A 882 14.169 -36.616 11.939 1.00 64.54 C ATOM 1471 CG PHE A 882 14.207 -37.486 10.680 1.00 40.51 C ATOM 1472 CD1 PHE A 882 15.401 -37.863 10.150 1.00 61.51 C ATOM 1473 CD2 PHE A 882 13.046 -37.880 10.091 1.00 23.10 C ATOM 1474 CE1 PHE A 882 15.436 -38.670 8.982 1.00 60.13 C ATOM 1475 CE2 PHE A 882 13.081 -38.687 8.923 1.00 42.41 C ATOM 1476 CZ PHE A 882 14.275 -39.065 8.393 1.00 43.41 C ATOM 0 H PHE A 882 13.863 -38.394 14.130 1.00 33.21 H new ATOM 0 HA PHE A 882 16.139 -37.156 12.715 1.00 13.43 H new ATOM 0 HB2 PHE A 882 13.148 -36.591 12.321 1.00 64.54 H new ATOM 0 HB3 PHE A 882 14.433 -35.593 11.670 1.00 64.54 H new ATOM 0 HD1 PHE A 882 16.323 -37.549 10.617 1.00 61.51 H new ATOM 0 HD2 PHE A 882 12.098 -37.579 10.511 1.00 23.10 H new ATOM 0 HE1 PHE A 882 16.384 -38.970 8.561 1.00 60.13 H new ATOM 0 HE2 PHE A 882 12.159 -39.001 8.456 1.00 42.41 H new ATOM 0 HZ PHE A 882 14.302 -39.679 7.505 1.00 43.41 H new ATOM 1486 N GLU A 883 15.582 -34.915 13.966 1.00 24.21 N ATOM 1487 CA GLU A 883 15.596 -33.873 14.978 1.00 12.50 C ATOM 1488 C GLU A 883 15.037 -32.569 14.404 1.00 4.33 C ATOM 1489 O GLU A 883 15.675 -31.931 13.568 1.00 4.12 O ATOM 1490 CB GLU A 883 17.006 -33.667 15.535 1.00 40.13 C ATOM 1491 CG GLU A 883 17.875 -32.881 14.550 1.00 31.44 C ATOM 1492 CD GLU A 883 19.362 -33.139 14.805 1.00 15.42 C ATOM 1493 OE1 GLU A 883 19.925 -32.609 15.774 1.00 1.24 O ATOM 1494 OE2 GLU A 883 19.933 -33.921 13.954 1.00 21.41 O ATOM 0 H GLU A 883 16.012 -34.654 13.079 1.00 24.21 H new ATOM 0 HA GLU A 883 14.958 -34.187 15.804 1.00 12.50 H new ATOM 0 HB2 GLU A 883 16.952 -33.133 16.484 1.00 40.13 H new ATOM 0 HB3 GLU A 883 17.465 -34.634 15.739 1.00 40.13 H new ATOM 0 HG2 GLU A 883 17.623 -33.166 13.529 1.00 31.44 H new ATOM 0 HG3 GLU A 883 17.665 -31.816 14.644 1.00 31.44 H new ATOM 1502 N ILE A 884 13.852 -32.212 14.876 1.00 1.43 N ATOM 1503 CA ILE A 884 13.201 -30.995 14.421 1.00 74.34 C ATOM 1504 C ILE A 884 12.155 -30.565 15.452 1.00 43.14 C ATOM 1505 O ILE A 884 11.720 -31.370 16.273 1.00 23.13 O ATOM 1506 CB ILE A 884 12.633 -31.187 13.013 1.00 43.44 C ATOM 1507 CG1 ILE A 884 12.322 -32.660 12.742 1.00 31.15 C ATOM 1508 CG2 ILE A 884 13.572 -30.597 11.958 1.00 2.44 C ATOM 1509 CD1 ILE A 884 11.504 -33.266 13.885 1.00 54.14 C ATOM 0 H ILE A 884 13.325 -32.744 15.569 1.00 1.43 H new ATOM 0 HA ILE A 884 13.924 -30.183 14.342 1.00 74.34 H new ATOM 0 HB ILE A 884 11.691 -30.642 12.948 1.00 43.44 H new ATOM 0 HG12 ILE A 884 11.771 -32.753 11.806 1.00 31.15 H new ATOM 0 HG13 ILE A 884 13.252 -33.216 12.621 1.00 31.15 H new ATOM 0 HG21 ILE A 884 13.145 -30.747 10.966 1.00 2.44 H new ATOM 0 HG22 ILE A 884 13.700 -29.530 12.141 1.00 2.44 H new ATOM 0 HG23 ILE A 884 14.541 -31.093 12.015 1.00 2.44 H new ATOM 0 HD11 ILE A 884 11.296 -34.314 13.668 1.00 54.14 H new ATOM 0 HD12 ILE A 884 12.068 -33.193 14.815 1.00 54.14 H new ATOM 0 HD13 ILE A 884 10.564 -32.723 13.987 1.00 54.14 H new ATOM 1521 N PRO A 885 11.772 -29.262 15.372 1.00 24.35 N ATOM 1522 CA PRO A 885 10.786 -28.715 16.289 1.00 63.14 C ATOM 1523 C PRO A 885 9.377 -29.187 15.924 1.00 24.40 C ATOM 1524 O PRO A 885 8.997 -29.172 14.754 1.00 11.35 O ATOM 1525 CB PRO A 885 10.952 -27.207 16.190 1.00 74.41 C ATOM 1526 CG PRO A 885 11.695 -26.954 14.889 1.00 43.13 C ATOM 1527 CD PRO A 885 12.266 -28.280 14.412 1.00 2.53 C ATOM 0 HA PRO A 885 10.932 -29.052 17.315 1.00 63.14 H new ATOM 0 HB2 PRO A 885 9.984 -26.707 16.190 1.00 74.41 H new ATOM 0 HB3 PRO A 885 11.512 -26.819 17.041 1.00 74.41 H new ATOM 0 HG2 PRO A 885 11.022 -26.537 14.140 1.00 43.13 H new ATOM 0 HG3 PRO A 885 12.493 -26.227 15.040 1.00 43.13 H new ATOM 0 HD2 PRO A 885 11.934 -28.513 13.400 1.00 2.53 H new ATOM 0 HD3 PRO A 885 13.356 -28.258 14.393 1.00 2.53 H new ATOM 1535 N VAL A 886 8.642 -29.596 16.947 1.00 33.12 N ATOM 1536 CA VAL A 886 7.283 -30.072 16.749 1.00 0.12 C ATOM 1537 C VAL A 886 6.303 -29.078 17.375 1.00 11.31 C ATOM 1538 O VAL A 886 6.220 -28.968 18.597 1.00 30.14 O ATOM 1539 CB VAL A 886 7.138 -31.488 17.310 1.00 74.12 C ATOM 1540 CG1 VAL A 886 5.686 -31.964 17.228 1.00 51.15 C ATOM 1541 CG2 VAL A 886 8.075 -32.461 16.592 1.00 41.14 C ATOM 0 H VAL A 886 8.961 -29.608 17.916 1.00 33.12 H new ATOM 0 HA VAL A 886 7.050 -30.132 15.686 1.00 0.12 H new ATOM 0 HB VAL A 886 7.424 -31.462 18.362 1.00 74.12 H new ATOM 0 HG11 VAL A 886 5.610 -32.973 17.633 1.00 51.15 H new ATOM 0 HG12 VAL A 886 5.050 -31.293 17.805 1.00 51.15 H new ATOM 0 HG13 VAL A 886 5.362 -31.966 16.187 1.00 51.15 H new ATOM 0 HG21 VAL A 886 7.952 -33.460 17.010 1.00 41.14 H new ATOM 0 HG22 VAL A 886 7.835 -32.480 15.529 1.00 41.14 H new ATOM 0 HG23 VAL A 886 9.107 -32.137 16.725 1.00 41.14 H new ATOM 1551 N ILE A 887 5.585 -28.378 16.509 1.00 71.45 N ATOM 1552 CA ILE A 887 4.614 -27.397 16.961 1.00 13.10 C ATOM 1553 C ILE A 887 3.203 -27.964 16.788 1.00 23.32 C ATOM 1554 O ILE A 887 3.038 -29.116 16.390 1.00 23.44 O ATOM 1555 CB ILE A 887 4.831 -26.061 16.248 1.00 14.53 C ATOM 1556 CG1 ILE A 887 6.303 -25.868 15.880 1.00 21.21 C ATOM 1557 CG2 ILE A 887 4.293 -24.899 17.086 1.00 12.32 C ATOM 1558 CD1 ILE A 887 6.531 -24.504 15.227 1.00 42.43 C ATOM 0 H ILE A 887 5.657 -28.471 15.496 1.00 71.45 H new ATOM 0 HA ILE A 887 4.747 -27.191 18.023 1.00 13.10 H new ATOM 0 HB ILE A 887 4.266 -26.076 15.316 1.00 14.53 H new ATOM 0 HG12 ILE A 887 6.919 -25.954 16.775 1.00 21.21 H new ATOM 0 HG13 ILE A 887 6.618 -26.658 15.199 1.00 21.21 H new ATOM 0 HG21 ILE A 887 4.460 -23.961 16.557 1.00 12.32 H new ATOM 0 HG22 ILE A 887 3.225 -25.036 17.254 1.00 12.32 H new ATOM 0 HG23 ILE A 887 4.811 -24.872 18.045 1.00 12.32 H new ATOM 0 HD11 ILE A 887 7.586 -24.393 14.975 1.00 42.43 H new ATOM 0 HD12 ILE A 887 5.932 -24.430 14.319 1.00 42.43 H new ATOM 0 HD13 ILE A 887 6.238 -23.715 15.920 1.00 42.43 H new ATOM 1570 N LYS A 888 2.222 -27.129 17.096 1.00 41.22 N ATOM 1571 CA LYS A 888 0.831 -27.533 16.980 1.00 42.35 C ATOM 1572 C LYS A 888 0.206 -26.847 15.763 1.00 34.30 C ATOM 1573 O LYS A 888 0.884 -26.120 15.039 1.00 14.21 O ATOM 1574 CB LYS A 888 0.084 -27.265 18.288 1.00 64.02 C ATOM 1575 CG LYS A 888 0.441 -25.888 18.851 1.00 52.33 C ATOM 1576 CD LYS A 888 -0.446 -25.538 20.048 1.00 64.41 C ATOM 1577 CE LYS A 888 0.193 -26.004 21.358 1.00 63.44 C ATOM 1578 NZ LYS A 888 -0.286 -25.181 22.490 1.00 54.00 N ATOM 0 H LYS A 888 2.363 -26.174 17.426 1.00 41.22 H new ATOM 0 HA LYS A 888 0.759 -28.608 16.814 1.00 42.35 H new ATOM 0 HB2 LYS A 888 -0.991 -27.324 18.116 1.00 64.02 H new ATOM 0 HB3 LYS A 888 0.333 -28.036 19.018 1.00 64.02 H new ATOM 0 HG2 LYS A 888 1.488 -25.875 19.154 1.00 52.33 H new ATOM 0 HG3 LYS A 888 0.325 -25.132 18.074 1.00 52.33 H new ATOM 0 HD2 LYS A 888 -0.609 -24.461 20.082 1.00 64.41 H new ATOM 0 HD3 LYS A 888 -1.424 -26.005 19.930 1.00 64.41 H new ATOM 0 HE2 LYS A 888 -0.049 -27.052 21.535 1.00 63.44 H new ATOM 0 HE3 LYS A 888 1.278 -25.935 21.285 1.00 63.44 H new ATOM 0 HZ1 LYS A 888 0.157 -25.511 23.371 1.00 54.00 H new ATOM 0 HZ2 LYS A 888 -0.033 -24.185 22.327 1.00 54.00 H new ATOM 0 HZ3 LYS A 888 -1.319 -25.267 22.569 1.00 54.00 H new ATOM 1591 N ILE A 889 -1.081 -27.104 15.576 1.00 64.04 N ATOM 1592 CA ILE A 889 -1.805 -26.521 14.459 1.00 12.12 C ATOM 1593 C ILE A 889 -2.356 -25.155 14.872 1.00 13.33 C ATOM 1594 O ILE A 889 -2.529 -24.272 14.034 1.00 41.43 O ATOM 1595 CB ILE A 889 -2.876 -27.488 13.952 1.00 75.41 C ATOM 1596 CG1 ILE A 889 -3.470 -27.004 12.628 1.00 53.43 C ATOM 1597 CG2 ILE A 889 -3.954 -27.719 15.013 1.00 12.43 C ATOM 1598 CD1 ILE A 889 -4.538 -27.974 12.118 1.00 44.24 C ATOM 0 H ILE A 889 -1.640 -27.708 16.179 1.00 64.04 H new ATOM 0 HA ILE A 889 -1.135 -26.354 13.616 1.00 12.12 H new ATOM 0 HB ILE A 889 -2.402 -28.451 13.760 1.00 75.41 H new ATOM 0 HG12 ILE A 889 -3.907 -26.014 12.762 1.00 53.43 H new ATOM 0 HG13 ILE A 889 -2.679 -26.905 11.885 1.00 53.43 H new ATOM 0 HG21 ILE A 889 -4.703 -28.410 14.626 1.00 12.43 H new ATOM 0 HG22 ILE A 889 -3.498 -28.141 15.909 1.00 12.43 H new ATOM 0 HG23 ILE A 889 -4.430 -26.770 15.261 1.00 12.43 H new ATOM 0 HD11 ILE A 889 -4.944 -27.606 11.176 1.00 44.24 H new ATOM 0 HD12 ILE A 889 -4.093 -28.957 11.962 1.00 44.24 H new ATOM 0 HD13 ILE A 889 -5.340 -28.051 12.852 1.00 44.24 H new ATOM 1610 N GLU A 890 -2.617 -25.024 16.165 1.00 51.33 N ATOM 1611 CA GLU A 890 -3.145 -23.780 16.699 1.00 11.12 C ATOM 1612 C GLU A 890 -2.001 -22.861 17.133 1.00 54.31 C ATOM 1613 O GLU A 890 -2.139 -22.103 18.092 1.00 21.11 O ATOM 1614 CB GLU A 890 -4.105 -24.046 17.860 1.00 0.05 C ATOM 1615 CG GLU A 890 -3.416 -24.843 18.970 1.00 41.10 C ATOM 1616 CD GLU A 890 -4.229 -24.795 20.265 1.00 5.55 C ATOM 1617 OE1 GLU A 890 -5.066 -25.677 20.505 1.00 14.30 O ATOM 1618 OE2 GLU A 890 -3.964 -23.796 21.038 1.00 24.23 O ATOM 0 H GLU A 890 -2.473 -25.759 16.858 1.00 51.33 H new ATOM 0 HA GLU A 890 -3.709 -23.279 15.912 1.00 11.12 H new ATOM 0 HB2 GLU A 890 -4.469 -23.100 18.259 1.00 0.05 H new ATOM 0 HB3 GLU A 890 -4.974 -24.595 17.499 1.00 0.05 H new ATOM 0 HG2 GLU A 890 -3.289 -25.879 18.654 1.00 41.10 H new ATOM 0 HG3 GLU A 890 -2.419 -24.440 19.147 1.00 41.10 H new ATOM 1626 N SER A 891 -0.898 -22.958 16.405 1.00 15.43 N ATOM 1627 CA SER A 891 0.268 -22.144 16.703 1.00 63.23 C ATOM 1628 C SER A 891 0.365 -20.985 15.709 1.00 62.12 C ATOM 1629 O SER A 891 0.971 -19.957 16.006 1.00 43.21 O ATOM 1630 CB SER A 891 1.548 -22.982 16.667 1.00 34.41 C ATOM 1631 OG SER A 891 1.851 -23.548 17.939 1.00 31.14 O ATOM 0 H SER A 891 -0.787 -23.587 15.610 1.00 15.43 H new ATOM 0 HA SER A 891 0.156 -21.742 17.710 1.00 63.23 H new ATOM 0 HB2 SER A 891 1.439 -23.779 15.932 1.00 34.41 H new ATOM 0 HB3 SER A 891 2.380 -22.359 16.340 1.00 34.41 H new ATOM 0 HG SER A 891 2.561 -23.026 18.369 1.00 31.14 H new ATOM 1637 N PHE A 892 -0.241 -21.190 14.549 1.00 71.12 N ATOM 1638 CA PHE A 892 -0.231 -20.175 13.509 1.00 2.11 C ATOM 1639 C PHE A 892 -1.391 -20.378 12.533 1.00 60.34 C ATOM 1640 O PHE A 892 -2.068 -21.404 12.573 1.00 73.21 O ATOM 1641 CB PHE A 892 1.090 -20.324 12.752 1.00 60.14 C ATOM 1642 CG PHE A 892 1.554 -21.773 12.589 1.00 21.04 C ATOM 1643 CD1 PHE A 892 0.857 -22.625 11.792 1.00 75.34 C ATOM 1644 CD2 PHE A 892 2.664 -22.209 13.243 1.00 4.41 C ATOM 1645 CE1 PHE A 892 1.287 -23.970 11.641 1.00 43.00 C ATOM 1646 CE2 PHE A 892 3.095 -23.553 13.093 1.00 61.34 C ATOM 1647 CZ PHE A 892 2.398 -24.406 12.295 1.00 54.43 C ATOM 0 H PHE A 892 -0.742 -22.044 14.306 1.00 71.12 H new ATOM 0 HA PHE A 892 -0.336 -19.185 13.954 1.00 2.11 H new ATOM 0 HB2 PHE A 892 0.984 -19.874 11.765 1.00 60.14 H new ATOM 0 HB3 PHE A 892 1.863 -19.763 13.277 1.00 60.14 H new ATOM 0 HD1 PHE A 892 -0.025 -22.279 11.273 1.00 75.34 H new ATOM 0 HD2 PHE A 892 3.218 -21.532 13.877 1.00 4.41 H new ATOM 0 HE1 PHE A 892 0.733 -24.647 11.007 1.00 43.00 H new ATOM 0 HE2 PHE A 892 3.977 -23.898 13.613 1.00 61.34 H new ATOM 0 HZ PHE A 892 2.726 -25.429 12.180 1.00 54.43 H new ATOM 1657 N VAL A 893 -1.584 -19.384 11.678 1.00 34.42 N ATOM 1658 CA VAL A 893 -2.651 -19.441 10.693 1.00 60.30 C ATOM 1659 C VAL A 893 -2.087 -19.956 9.367 1.00 54.42 C ATOM 1660 O VAL A 893 -0.872 -20.013 9.185 1.00 32.02 O ATOM 1661 CB VAL A 893 -3.321 -18.071 10.567 1.00 65.32 C ATOM 1662 CG1 VAL A 893 -3.382 -17.364 11.922 1.00 34.53 C ATOM 1663 CG2 VAL A 893 -2.605 -17.205 9.529 1.00 41.14 C ATOM 0 H VAL A 893 -1.020 -18.535 11.647 1.00 34.42 H new ATOM 0 HA VAL A 893 -3.427 -20.138 11.009 1.00 60.30 H new ATOM 0 HB VAL A 893 -4.344 -18.228 10.225 1.00 65.32 H new ATOM 0 HG11 VAL A 893 -3.863 -16.393 11.804 1.00 34.53 H new ATOM 0 HG12 VAL A 893 -3.956 -17.970 12.623 1.00 34.53 H new ATOM 0 HG13 VAL A 893 -2.371 -17.225 12.305 1.00 34.53 H new ATOM 0 HG21 VAL A 893 -3.101 -16.237 9.459 1.00 41.14 H new ATOM 0 HG22 VAL A 893 -1.567 -17.060 9.829 1.00 41.14 H new ATOM 0 HG23 VAL A 893 -2.636 -17.700 8.558 1.00 41.14 H new ATOM 1673 N VAL A 894 -2.997 -20.317 8.474 1.00 14.51 N ATOM 1674 CA VAL A 894 -2.606 -20.824 7.170 1.00 73.21 C ATOM 1675 C VAL A 894 -3.301 -20.006 6.080 1.00 42.33 C ATOM 1676 O VAL A 894 -4.517 -20.091 5.914 1.00 64.44 O ATOM 1677 CB VAL A 894 -2.910 -22.321 7.078 1.00 22.05 C ATOM 1678 CG1 VAL A 894 -1.936 -23.021 6.129 1.00 41.25 C ATOM 1679 CG2 VAL A 894 -2.887 -22.971 8.464 1.00 52.44 C ATOM 0 H VAL A 894 -4.004 -20.268 8.628 1.00 14.51 H new ATOM 0 HA VAL A 894 -1.531 -20.714 7.024 1.00 73.21 H new ATOM 0 HB VAL A 894 -3.915 -22.434 6.671 1.00 22.05 H new ATOM 0 HG11 VAL A 894 -2.174 -24.084 6.082 1.00 41.25 H new ATOM 0 HG12 VAL A 894 -2.022 -22.585 5.133 1.00 41.25 H new ATOM 0 HG13 VAL A 894 -0.917 -22.893 6.494 1.00 41.25 H new ATOM 0 HG21 VAL A 894 -3.106 -24.035 8.371 1.00 52.44 H new ATOM 0 HG22 VAL A 894 -1.901 -22.841 8.910 1.00 52.44 H new ATOM 0 HG23 VAL A 894 -3.638 -22.500 9.099 1.00 52.44 H new ATOM 1689 N GLU A 895 -2.499 -19.231 5.365 1.00 44.42 N ATOM 1690 CA GLU A 895 -3.021 -18.397 4.295 1.00 21.31 C ATOM 1691 C GLU A 895 -2.484 -18.871 2.943 1.00 42.10 C ATOM 1692 O GLU A 895 -1.273 -18.915 2.733 1.00 4.01 O ATOM 1693 CB GLU A 895 -2.684 -16.924 4.533 1.00 22.13 C ATOM 1694 CG GLU A 895 -3.543 -16.016 3.652 1.00 51.52 C ATOM 1695 CD GLU A 895 -2.939 -14.613 3.557 1.00 11.00 C ATOM 1696 OE1 GLU A 895 -2.259 -14.296 2.570 1.00 63.41 O ATOM 1697 OE2 GLU A 895 -3.199 -13.839 4.556 1.00 51.34 O ATOM 0 H GLU A 895 -1.491 -19.163 5.505 1.00 44.42 H new ATOM 0 HA GLU A 895 -4.107 -18.490 4.286 1.00 21.31 H new ATOM 0 HB2 GLU A 895 -2.844 -16.676 5.582 1.00 22.13 H new ATOM 0 HB3 GLU A 895 -1.629 -16.750 4.321 1.00 22.13 H new ATOM 0 HG2 GLU A 895 -3.629 -16.447 2.655 1.00 51.52 H new ATOM 0 HG3 GLU A 895 -4.551 -15.955 4.061 1.00 51.52 H new ATOM 1705 N ASP A 896 -3.411 -19.213 2.061 1.00 72.21 N ATOM 1706 CA ASP A 896 -3.046 -19.682 0.735 1.00 52.12 C ATOM 1707 C ASP A 896 -2.473 -18.516 -0.073 1.00 62.24 C ATOM 1708 O ASP A 896 -2.932 -17.382 0.055 1.00 64.22 O ATOM 1709 CB ASP A 896 -4.266 -20.221 -0.014 1.00 34.41 C ATOM 1710 CG ASP A 896 -4.284 -21.738 -0.213 1.00 34.31 C ATOM 1711 OD1 ASP A 896 -5.214 -22.429 0.229 1.00 74.30 O ATOM 1712 OD2 ASP A 896 -3.276 -22.215 -0.861 1.00 72.21 O ATOM 0 H ASP A 896 -4.415 -19.175 2.238 1.00 72.21 H new ATOM 0 HA ASP A 896 -2.312 -20.480 0.850 1.00 52.12 H new ATOM 0 HB2 ASP A 896 -5.165 -19.930 0.530 1.00 34.41 H new ATOM 0 HB3 ASP A 896 -4.315 -19.741 -0.991 1.00 34.41 H new ATOM 1718 N ILE A 897 -1.478 -18.836 -0.888 1.00 50.52 N ATOM 1719 CA ILE A 897 -0.837 -17.829 -1.717 1.00 52.13 C ATOM 1720 C ILE A 897 -1.596 -17.705 -3.040 1.00 14.12 C ATOM 1721 O ILE A 897 -1.322 -16.808 -3.836 1.00 23.14 O ATOM 1722 CB ILE A 897 0.650 -18.144 -1.889 1.00 41.02 C ATOM 1723 CG1 ILE A 897 1.204 -18.863 -0.657 1.00 42.14 C ATOM 1724 CG2 ILE A 897 1.444 -16.878 -2.220 1.00 30.53 C ATOM 1725 CD1 ILE A 897 1.438 -20.347 -0.948 1.00 10.24 C ATOM 0 H ILE A 897 -1.100 -19.778 -0.992 1.00 50.52 H new ATOM 0 HA ILE A 897 -0.879 -16.854 -1.232 1.00 52.13 H new ATOM 0 HB ILE A 897 0.760 -18.823 -2.735 1.00 41.02 H new ATOM 0 HG12 ILE A 897 2.140 -18.397 -0.350 1.00 42.14 H new ATOM 0 HG13 ILE A 897 0.507 -18.757 0.174 1.00 42.14 H new ATOM 0 HG21 ILE A 897 2.498 -17.130 -2.337 1.00 30.53 H new ATOM 0 HG22 ILE A 897 1.069 -16.445 -3.148 1.00 30.53 H new ATOM 0 HG23 ILE A 897 1.331 -16.156 -1.411 1.00 30.53 H new ATOM 0 HD11 ILE A 897 1.832 -20.835 -0.056 1.00 10.24 H new ATOM 0 HD12 ILE A 897 0.495 -20.815 -1.232 1.00 10.24 H new ATOM 0 HD13 ILE A 897 2.154 -20.449 -1.764 1.00 10.24 H new ATOM 1737 N ALA A 898 -2.536 -18.618 -3.234 1.00 35.15 N ATOM 1738 CA ALA A 898 -3.337 -18.622 -4.446 1.00 34.31 C ATOM 1739 C ALA A 898 -4.701 -17.993 -4.153 1.00 41.14 C ATOM 1740 O ALA A 898 -5.438 -17.645 -5.074 1.00 54.13 O ATOM 1741 CB ALA A 898 -3.457 -20.053 -4.974 1.00 61.21 C ATOM 0 H ALA A 898 -2.761 -19.360 -2.572 1.00 35.15 H new ATOM 0 HA ALA A 898 -2.859 -18.026 -5.224 1.00 34.31 H new ATOM 0 HB1 ALA A 898 -4.058 -20.056 -5.883 1.00 61.21 H new ATOM 0 HB2 ALA A 898 -2.464 -20.444 -5.194 1.00 61.21 H new ATOM 0 HB3 ALA A 898 -3.935 -20.680 -4.221 1.00 61.21 H new ATOM 1747 N THR A 899 -4.995 -17.866 -2.868 1.00 3.12 N ATOM 1748 CA THR A 899 -6.257 -17.285 -2.442 1.00 44.53 C ATOM 1749 C THR A 899 -6.011 -16.135 -1.464 1.00 1.44 C ATOM 1750 O THR A 899 -6.588 -15.058 -1.608 1.00 2.21 O ATOM 1751 CB THR A 899 -7.120 -18.405 -1.859 1.00 55.43 C ATOM 1752 OG1 THR A 899 -6.557 -18.643 -0.572 1.00 72.44 O ATOM 1753 CG2 THR A 899 -6.936 -19.731 -2.599 1.00 32.43 C ATOM 0 H THR A 899 -4.381 -18.156 -2.107 1.00 3.12 H new ATOM 0 HA THR A 899 -6.794 -16.846 -3.282 1.00 44.53 H new ATOM 0 HB THR A 899 -8.169 -18.112 -1.896 1.00 55.43 H new ATOM 0 HG1 THR A 899 -7.147 -19.236 -0.061 1.00 72.44 H new ATOM 0 HG21 THR A 899 -7.571 -20.492 -2.145 1.00 32.43 H new ATOM 0 HG22 THR A 899 -7.212 -19.605 -3.646 1.00 32.43 H new ATOM 0 HG23 THR A 899 -5.893 -20.042 -2.534 1.00 32.43 H new ATOM 1761 N GLY A 900 -5.154 -16.402 -0.489 1.00 63.14 N ATOM 1762 CA GLY A 900 -4.825 -15.403 0.513 1.00 25.00 C ATOM 1763 C GLY A 900 -5.766 -15.501 1.715 1.00 74.02 C ATOM 1764 O GLY A 900 -5.813 -14.596 2.547 1.00 72.23 O ATOM 0 H GLY A 900 -4.678 -17.296 -0.372 1.00 63.14 H new ATOM 0 HA2 GLY A 900 -3.794 -15.538 0.842 1.00 25.00 H new ATOM 0 HA3 GLY A 900 -4.892 -14.407 0.075 1.00 25.00 H new ATOM 1768 N VAL A 901 -6.493 -16.607 1.768 1.00 74.43 N ATOM 1769 CA VAL A 901 -7.431 -16.835 2.854 1.00 74.42 C ATOM 1770 C VAL A 901 -6.686 -17.433 4.049 1.00 62.34 C ATOM 1771 O VAL A 901 -6.277 -18.593 4.013 1.00 54.11 O ATOM 1772 CB VAL A 901 -8.588 -17.713 2.371 1.00 40.11 C ATOM 1773 CG1 VAL A 901 -9.694 -17.791 3.425 1.00 21.32 C ATOM 1774 CG2 VAL A 901 -9.138 -17.208 1.035 1.00 33.43 C ATOM 0 H VAL A 901 -6.451 -17.355 1.076 1.00 74.43 H new ATOM 0 HA VAL A 901 -7.870 -15.893 3.183 1.00 74.42 H new ATOM 0 HB VAL A 901 -8.202 -18.721 2.215 1.00 40.11 H new ATOM 0 HG11 VAL A 901 -10.504 -18.421 3.057 1.00 21.32 H new ATOM 0 HG12 VAL A 901 -9.292 -18.218 4.344 1.00 21.32 H new ATOM 0 HG13 VAL A 901 -10.076 -16.790 3.627 1.00 21.32 H new ATOM 0 HG21 VAL A 901 -9.959 -17.849 0.714 1.00 33.43 H new ATOM 0 HG22 VAL A 901 -9.500 -16.187 1.153 1.00 33.43 H new ATOM 0 HG23 VAL A 901 -8.347 -17.228 0.285 1.00 33.43 H new ATOM 1784 N GLN A 902 -6.531 -16.615 5.079 1.00 51.53 N ATOM 1785 CA GLN A 902 -5.842 -17.048 6.282 1.00 1.03 C ATOM 1786 C GLN A 902 -6.841 -17.620 7.290 1.00 55.14 C ATOM 1787 O GLN A 902 -7.916 -17.057 7.491 1.00 12.41 O ATOM 1788 CB GLN A 902 -5.039 -15.900 6.898 1.00 71.22 C ATOM 1789 CG GLN A 902 -5.966 -14.795 7.408 1.00 3.04 C ATOM 1790 CD GLN A 902 -5.161 -13.620 7.967 1.00 11.33 C ATOM 1791 OE1 GLN A 902 -4.305 -13.958 8.927 1.00 74.05 O flip ATOM 1792 NE2 GLN A 902 -5.308 -12.481 7.555 1.00 44.01 N flip ATOM 0 H GLN A 902 -6.871 -15.654 5.105 1.00 51.53 H new ATOM 0 HA GLN A 902 -5.139 -17.835 6.010 1.00 1.03 H new ATOM 0 HB2 GLN A 902 -4.430 -16.277 7.720 1.00 71.22 H new ATOM 0 HB3 GLN A 902 -4.354 -15.491 6.155 1.00 71.22 H new ATOM 0 HG2 GLN A 902 -6.606 -14.449 6.597 1.00 3.04 H new ATOM 0 HG3 GLN A 902 -6.621 -15.193 8.183 1.00 3.04 H new ATOM 0 HE21 GLN A 902 -5.983 -12.290 6.815 1.00 44.01 H new ATOM 0 HE22 GLN A 902 -4.756 -11.720 7.951 1.00 44.01 H new ATOM 1801 N THR A 903 -6.452 -18.732 7.896 1.00 43.34 N ATOM 1802 CA THR A 903 -7.300 -19.386 8.877 1.00 33.10 C ATOM 1803 C THR A 903 -6.460 -19.911 10.043 1.00 52.01 C ATOM 1804 O THR A 903 -5.273 -20.189 9.882 1.00 42.24 O ATOM 1805 CB THR A 903 -8.096 -20.479 8.161 1.00 64.25 C ATOM 1806 OG1 THR A 903 -9.006 -19.760 7.333 1.00 34.34 O ATOM 1807 CG2 THR A 903 -8.999 -21.266 9.113 1.00 45.02 C ATOM 0 H THR A 903 -5.560 -19.197 7.726 1.00 43.34 H new ATOM 0 HA THR A 903 -8.008 -18.684 9.318 1.00 33.10 H new ATOM 0 HB THR A 903 -7.407 -21.164 7.666 1.00 64.25 H new ATOM 0 HG1 THR A 903 -9.561 -20.393 6.831 1.00 34.34 H new ATOM 0 HG21 THR A 903 -9.541 -22.029 8.553 1.00 45.02 H new ATOM 0 HG22 THR A 903 -8.390 -21.743 9.881 1.00 45.02 H new ATOM 0 HG23 THR A 903 -9.710 -20.588 9.584 1.00 45.02 H new ATOM 1815 N LEU A 904 -7.110 -20.031 11.191 1.00 4.05 N ATOM 1816 CA LEU A 904 -6.437 -20.518 12.384 1.00 12.31 C ATOM 1817 C LEU A 904 -7.313 -21.573 13.063 1.00 2.44 C ATOM 1818 O LEU A 904 -8.391 -21.260 13.566 1.00 51.53 O ATOM 1819 CB LEU A 904 -6.058 -19.351 13.299 1.00 61.51 C ATOM 1820 CG LEU A 904 -6.871 -18.068 13.121 1.00 11.43 C ATOM 1821 CD1 LEU A 904 -8.252 -18.199 13.767 1.00 23.40 C ATOM 1822 CD2 LEU A 904 -6.104 -16.855 13.651 1.00 3.24 C ATOM 0 H LEU A 904 -8.095 -19.800 11.321 1.00 4.05 H new ATOM 0 HA LEU A 904 -5.498 -21.004 12.121 1.00 12.31 H new ATOM 0 HB2 LEU A 904 -6.157 -19.680 14.334 1.00 61.51 H new ATOM 0 HB3 LEU A 904 -5.006 -19.116 13.138 1.00 61.51 H new ATOM 0 HG LEU A 904 -7.028 -17.909 12.054 1.00 11.43 H new ATOM 0 HD11 LEU A 904 -8.809 -17.273 13.626 1.00 23.40 H new ATOM 0 HD12 LEU A 904 -8.794 -19.023 13.303 1.00 23.40 H new ATOM 0 HD13 LEU A 904 -8.138 -18.395 14.833 1.00 23.40 H new ATOM 0 HD21 LEU A 904 -6.704 -15.956 13.512 1.00 3.24 H new ATOM 0 HD22 LEU A 904 -5.895 -16.992 14.712 1.00 3.24 H new ATOM 0 HD23 LEU A 904 -5.165 -16.752 13.107 1.00 3.24 H new ATOM 1834 N TYR A 905 -6.816 -22.801 13.057 1.00 54.11 N ATOM 1835 CA TYR A 905 -7.540 -23.904 13.666 1.00 10.22 C ATOM 1836 C TYR A 905 -7.309 -23.942 15.178 1.00 33.33 C ATOM 1837 O TYR A 905 -6.737 -23.013 15.746 1.00 31.43 O ATOM 1838 CB TYR A 905 -6.969 -25.179 13.043 1.00 43.24 C ATOM 1839 CG TYR A 905 -7.148 -25.264 11.526 1.00 53.13 C ATOM 1840 CD1 TYR A 905 -6.204 -24.708 10.687 1.00 51.23 C ATOM 1841 CD2 TYR A 905 -8.255 -25.897 10.996 1.00 4.01 C ATOM 1842 CE1 TYR A 905 -6.373 -24.788 9.259 1.00 51.01 C ATOM 1843 CE2 TYR A 905 -8.424 -25.977 9.568 1.00 24.13 C ATOM 1844 CZ TYR A 905 -7.475 -25.419 8.770 1.00 4.42 C ATOM 1845 OH TYR A 905 -7.634 -25.494 7.422 1.00 72.33 O ATOM 0 H TYR A 905 -5.921 -23.057 12.640 1.00 54.11 H new ATOM 0 HA TYR A 905 -8.612 -23.800 13.496 1.00 10.22 H new ATOM 0 HB2 TYR A 905 -5.906 -25.241 13.277 1.00 43.24 H new ATOM 0 HB3 TYR A 905 -7.448 -26.043 13.504 1.00 43.24 H new ATOM 0 HD1 TYR A 905 -5.338 -24.213 11.101 1.00 51.23 H new ATOM 0 HD2 TYR A 905 -8.994 -26.332 11.652 1.00 4.01 H new ATOM 0 HE1 TYR A 905 -5.642 -24.357 8.591 1.00 51.01 H new ATOM 0 HE2 TYR A 905 -9.285 -26.469 9.141 1.00 24.13 H new ATOM 0 HH TYR A 905 -8.464 -25.973 7.217 1.00 72.33 H new ATOM 1855 N SER A 906 -7.767 -25.027 15.787 1.00 3.51 N ATOM 1856 CA SER A 906 -7.617 -25.198 17.222 1.00 33.22 C ATOM 1857 C SER A 906 -6.862 -26.496 17.518 1.00 12.52 C ATOM 1858 O SER A 906 -5.873 -26.489 18.249 1.00 21.32 O ATOM 1859 CB SER A 906 -8.978 -25.205 17.921 1.00 75.24 C ATOM 1860 OG SER A 906 -9.823 -26.245 17.434 1.00 41.21 O ATOM 0 H SER A 906 -8.242 -25.795 15.313 1.00 3.51 H new ATOM 0 HA SER A 906 -7.044 -24.355 17.609 1.00 33.22 H new ATOM 0 HB2 SER A 906 -8.834 -25.328 18.994 1.00 75.24 H new ATOM 0 HB3 SER A 906 -9.466 -24.242 17.773 1.00 75.24 H new ATOM 0 HG SER A 906 -10.681 -26.217 17.906 1.00 41.21 H new ATOM 1866 N LYS A 907 -7.358 -27.577 16.935 1.00 24.21 N ATOM 1867 CA LYS A 907 -6.742 -28.879 17.127 1.00 30.32 C ATOM 1868 C LYS A 907 -6.328 -29.448 15.769 1.00 73.45 C ATOM 1869 O LYS A 907 -6.815 -29.002 14.731 1.00 64.35 O ATOM 1870 CB LYS A 907 -7.671 -29.799 17.922 1.00 30.11 C ATOM 1871 CG LYS A 907 -6.871 -30.834 18.715 1.00 64.52 C ATOM 1872 CD LYS A 907 -5.953 -30.155 19.733 1.00 25.31 C ATOM 1873 CE LYS A 907 -6.655 -28.971 20.400 1.00 21.24 C ATOM 1874 NZ LYS A 907 -7.932 -29.403 21.011 1.00 30.20 N ATOM 0 H LYS A 907 -8.179 -27.578 16.330 1.00 24.21 H new ATOM 0 HA LYS A 907 -5.835 -28.787 17.724 1.00 30.32 H new ATOM 0 HB2 LYS A 907 -8.280 -29.205 18.603 1.00 30.11 H new ATOM 0 HB3 LYS A 907 -8.355 -30.306 17.242 1.00 30.11 H new ATOM 0 HG2 LYS A 907 -7.554 -31.510 19.230 1.00 64.52 H new ATOM 0 HG3 LYS A 907 -6.277 -31.441 18.032 1.00 64.52 H new ATOM 0 HD2 LYS A 907 -5.649 -30.876 20.491 1.00 25.31 H new ATOM 0 HD3 LYS A 907 -5.045 -29.812 19.237 1.00 25.31 H new ATOM 0 HE2 LYS A 907 -6.007 -28.540 21.163 1.00 21.24 H new ATOM 0 HE3 LYS A 907 -6.843 -28.190 19.663 1.00 21.24 H new ATOM 0 HZ1 LYS A 907 -8.727 -29.035 20.450 1.00 30.20 H new ATOM 0 HZ2 LYS A 907 -7.974 -30.442 21.030 1.00 30.20 H new ATOM 0 HZ3 LYS A 907 -7.994 -29.036 21.982 1.00 30.20 H new ATOM 1887 N TRP A 908 -5.435 -30.425 15.819 1.00 23.33 N ATOM 1888 CA TRP A 908 -4.950 -31.060 14.605 1.00 30.04 C ATOM 1889 C TRP A 908 -6.082 -31.918 14.037 1.00 64.55 C ATOM 1890 O TRP A 908 -6.078 -32.252 12.853 1.00 65.04 O ATOM 1891 CB TRP A 908 -3.673 -31.858 14.876 1.00 2.41 C ATOM 1892 CG TRP A 908 -2.859 -31.344 16.066 1.00 72.41 C ATOM 1893 CD1 TRP A 908 -2.030 -30.292 16.106 1.00 32.32 C ATOM 1894 CD2 TRP A 908 -2.830 -31.907 17.395 1.00 73.24 C ATOM 1895 NE1 TRP A 908 -1.471 -30.136 17.358 1.00 34.44 N ATOM 1896 CE2 TRP A 908 -1.974 -31.150 18.167 1.00 44.42 C ATOM 1897 CE3 TRP A 908 -3.506 -33.020 17.926 1.00 11.44 C ATOM 1898 CZ2 TRP A 908 -1.713 -31.422 19.515 1.00 30.10 C ATOM 1899 CZ3 TRP A 908 -3.235 -33.279 19.275 1.00 2.33 C ATOM 1900 CH2 TRP A 908 -2.375 -32.526 20.066 1.00 1.32 C ATOM 0 H TRP A 908 -5.034 -30.793 16.682 1.00 23.33 H new ATOM 0 HA TRP A 908 -4.673 -30.312 13.862 1.00 30.04 H new ATOM 0 HB2 TRP A 908 -3.939 -32.900 15.054 1.00 2.41 H new ATOM 0 HB3 TRP A 908 -3.047 -31.836 13.984 1.00 2.41 H new ATOM 0 HD1 TRP A 908 -1.825 -29.647 15.264 1.00 32.32 H new ATOM 0 HE1 TRP A 908 -0.811 -29.411 17.639 1.00 34.44 H new ATOM 0 HE3 TRP A 908 -4.180 -33.627 17.340 1.00 11.44 H new ATOM 0 HZ2 TRP A 908 -1.038 -30.814 20.098 1.00 30.10 H new ATOM 0 HZ3 TRP A 908 -3.729 -34.123 19.733 1.00 2.33 H new ATOM 0 HH2 TRP A 908 -2.218 -32.791 21.101 1.00 1.32 H new ATOM 1911 N LYS A 909 -7.023 -32.252 14.907 1.00 55.52 N ATOM 1912 CA LYS A 909 -8.159 -33.065 14.506 1.00 50.31 C ATOM 1913 C LYS A 909 -8.755 -32.499 13.215 1.00 34.34 C ATOM 1914 O LYS A 909 -9.362 -33.231 12.435 1.00 71.31 O ATOM 1915 CB LYS A 909 -9.167 -33.179 15.651 1.00 13.41 C ATOM 1916 CG LYS A 909 -8.454 -33.289 17.000 1.00 33.14 C ATOM 1917 CD LYS A 909 -9.325 -34.024 18.022 1.00 65.33 C ATOM 1918 CE LYS A 909 -9.031 -35.526 18.012 1.00 54.13 C ATOM 1919 NZ LYS A 909 -9.406 -36.136 19.307 1.00 0.33 N ATOM 0 H LYS A 909 -7.022 -31.975 15.889 1.00 55.52 H new ATOM 0 HA LYS A 909 -7.841 -34.085 14.290 1.00 50.31 H new ATOM 0 HB2 LYS A 909 -9.822 -32.308 15.652 1.00 13.41 H new ATOM 0 HB3 LYS A 909 -9.800 -34.053 15.498 1.00 13.41 H new ATOM 0 HG2 LYS A 909 -7.509 -33.818 16.874 1.00 33.14 H new ATOM 0 HG3 LYS A 909 -8.214 -32.293 17.371 1.00 33.14 H new ATOM 0 HD2 LYS A 909 -9.143 -33.621 19.018 1.00 65.33 H new ATOM 0 HD3 LYS A 909 -10.378 -33.854 17.797 1.00 65.33 H new ATOM 0 HE2 LYS A 909 -9.584 -36.005 17.204 1.00 54.13 H new ATOM 0 HE3 LYS A 909 -7.972 -35.694 17.817 1.00 54.13 H new ATOM 0 HZ1 LYS A 909 -9.200 -37.155 19.283 1.00 0.33 H new ATOM 0 HZ2 LYS A 909 -8.860 -35.690 20.072 1.00 0.33 H new ATOM 0 HZ3 LYS A 909 -10.422 -35.992 19.477 1.00 0.33 H new ATOM 1932 N ASP A 910 -8.562 -31.202 13.031 1.00 51.42 N ATOM 1933 CA ASP A 910 -9.073 -30.530 11.848 1.00 13.42 C ATOM 1934 C ASP A 910 -8.010 -30.563 10.749 1.00 51.55 C ATOM 1935 O ASP A 910 -7.851 -29.596 10.005 1.00 40.22 O ATOM 1936 CB ASP A 910 -9.401 -29.065 12.145 1.00 21.04 C ATOM 1937 CG ASP A 910 -10.525 -28.469 11.296 1.00 41.51 C ATOM 1938 OD1 ASP A 910 -10.642 -28.760 10.096 1.00 11.33 O ATOM 1939 OD2 ASP A 910 -11.313 -27.662 11.923 1.00 45.34 O ATOM 0 H ASP A 910 -8.059 -30.598 13.681 1.00 51.42 H new ATOM 0 HA ASP A 910 -9.980 -31.046 11.533 1.00 13.42 H new ATOM 0 HB2 ASP A 910 -9.674 -28.975 13.196 1.00 21.04 H new ATOM 0 HB3 ASP A 910 -8.500 -28.470 11.998 1.00 21.04 H new ATOM 1945 N PHE A 911 -7.310 -31.685 10.680 1.00 22.12 N ATOM 1946 CA PHE A 911 -6.266 -31.857 9.684 1.00 52.22 C ATOM 1947 C PHE A 911 -6.866 -32.099 8.297 1.00 13.43 C ATOM 1948 O PHE A 911 -7.766 -32.922 8.142 1.00 73.44 O ATOM 1949 CB PHE A 911 -5.452 -33.085 10.096 1.00 74.15 C ATOM 1950 CG PHE A 911 -6.270 -34.377 10.170 1.00 44.40 C ATOM 1951 CD1 PHE A 911 -6.622 -35.025 9.028 1.00 61.13 C ATOM 1952 CD2 PHE A 911 -6.644 -34.876 11.378 1.00 4.15 C ATOM 1953 CE1 PHE A 911 -7.380 -36.224 9.097 1.00 52.32 C ATOM 1954 CE2 PHE A 911 -7.402 -36.074 11.448 1.00 61.44 C ATOM 1955 CZ PHE A 911 -7.754 -36.723 10.305 1.00 32.13 C ATOM 0 H PHE A 911 -7.445 -32.485 11.298 1.00 22.12 H new ATOM 0 HA PHE A 911 -5.650 -30.959 9.632 1.00 52.22 H new ATOM 0 HB2 PHE A 911 -4.637 -33.223 9.386 1.00 74.15 H new ATOM 0 HB3 PHE A 911 -4.998 -32.898 11.069 1.00 74.15 H new ATOM 0 HD1 PHE A 911 -6.325 -34.628 8.068 1.00 61.13 H new ATOM 0 HD2 PHE A 911 -6.364 -34.361 12.285 1.00 4.15 H new ATOM 0 HE1 PHE A 911 -7.659 -36.739 8.190 1.00 52.32 H new ATOM 0 HE2 PHE A 911 -7.699 -36.470 12.408 1.00 61.44 H new ATOM 0 HZ PHE A 911 -8.331 -37.635 10.357 1.00 32.13 H new ATOM 1965 N HIS A 912 -6.344 -31.365 7.325 1.00 24.43 N ATOM 1966 CA HIS A 912 -6.817 -31.490 5.957 1.00 5.20 C ATOM 1967 C HIS A 912 -5.635 -31.780 5.030 1.00 65.40 C ATOM 1968 O HIS A 912 -5.800 -31.862 3.814 1.00 71.41 O ATOM 1969 CB HIS A 912 -7.606 -30.247 5.540 1.00 63.21 C ATOM 1970 CG HIS A 912 -9.051 -30.262 5.978 1.00 3.35 C ATOM 1971 ND1 HIS A 912 -9.442 -30.002 7.280 1.00 24.25 N ATOM 1972 CD2 HIS A 912 -10.193 -30.506 5.275 1.00 53.23 C ATOM 1973 CE1 HIS A 912 -10.762 -30.090 7.346 1.00 0.01 C ATOM 1974 NE2 HIS A 912 -11.226 -30.403 6.102 1.00 1.31 N ATOM 0 H HIS A 912 -5.598 -30.682 7.458 1.00 24.43 H new ATOM 0 HA HIS A 912 -7.507 -32.330 5.882 1.00 5.20 H new ATOM 0 HB2 HIS A 912 -7.120 -29.364 5.956 1.00 63.21 H new ATOM 0 HB3 HIS A 912 -7.567 -30.151 4.455 1.00 63.21 H new ATOM 0 HD1 HIS A 912 -8.819 -29.780 8.057 1.00 24.25 H new ATOM 0 HD2 HIS A 912 -10.248 -30.743 4.223 1.00 53.23 H new ATOM 0 HE1 HIS A 912 -11.365 -29.940 8.229 1.00 0.01 H new ATOM 1982 N PHE A 913 -4.468 -31.928 5.640 1.00 22.21 N ATOM 1983 CA PHE A 913 -3.258 -32.208 4.885 1.00 54.12 C ATOM 1984 C PHE A 913 -3.157 -33.696 4.544 1.00 41.15 C ATOM 1985 O PHE A 913 -4.135 -34.432 4.662 1.00 13.24 O ATOM 1986 CB PHE A 913 -2.076 -31.819 5.774 1.00 2.11 C ATOM 1987 CG PHE A 913 -0.975 -31.047 5.043 1.00 12.04 C ATOM 1988 CD1 PHE A 913 -1.216 -29.789 4.585 1.00 33.32 C ATOM 1989 CD2 PHE A 913 0.244 -31.618 4.852 1.00 30.41 C ATOM 1990 CE1 PHE A 913 -0.195 -29.073 3.907 1.00 41.00 C ATOM 1991 CE2 PHE A 913 1.265 -30.902 4.174 1.00 43.02 C ATOM 1992 CZ PHE A 913 1.024 -29.644 3.716 1.00 63.44 C ATOM 0 H PHE A 913 -4.335 -31.859 6.649 1.00 22.21 H new ATOM 0 HA PHE A 913 -3.265 -31.648 3.950 1.00 54.12 H new ATOM 0 HB2 PHE A 913 -2.442 -31.213 6.603 1.00 2.11 H new ATOM 0 HB3 PHE A 913 -1.646 -32.723 6.206 1.00 2.11 H new ATOM 0 HD1 PHE A 913 -2.184 -29.335 4.737 1.00 33.32 H new ATOM 0 HD2 PHE A 913 0.436 -32.617 5.216 1.00 30.41 H new ATOM 0 HE1 PHE A 913 -0.387 -28.074 3.543 1.00 41.00 H new ATOM 0 HE2 PHE A 913 2.233 -31.356 4.022 1.00 43.02 H new ATOM 0 HZ PHE A 913 1.801 -29.099 3.201 1.00 63.44 H new ATOM 2002 N GLU A 914 -1.964 -34.095 4.126 1.00 13.52 N ATOM 2003 CA GLU A 914 -1.722 -35.481 3.767 1.00 72.51 C ATOM 2004 C GLU A 914 -0.416 -35.972 4.395 1.00 71.34 C ATOM 2005 O GLU A 914 0.512 -35.191 4.596 1.00 11.43 O ATOM 2006 CB GLU A 914 -1.701 -35.658 2.247 1.00 24.43 C ATOM 2007 CG GLU A 914 -0.448 -35.024 1.639 1.00 32.02 C ATOM 2008 CD GLU A 914 -0.693 -34.612 0.186 1.00 23.20 C ATOM 2009 OE1 GLU A 914 -1.123 -35.442 -0.629 1.00 43.44 O ATOM 2010 OE2 GLU A 914 -0.421 -33.381 -0.085 1.00 4.32 O ATOM 0 H GLU A 914 -1.155 -33.482 4.028 1.00 13.52 H new ATOM 0 HA GLU A 914 -2.540 -36.086 4.159 1.00 72.51 H new ATOM 0 HB2 GLU A 914 -1.732 -36.719 2.000 1.00 24.43 H new ATOM 0 HB3 GLU A 914 -2.591 -35.203 1.812 1.00 24.43 H new ATOM 0 HG2 GLU A 914 -0.157 -34.152 2.224 1.00 32.02 H new ATOM 0 HG3 GLU A 914 0.381 -35.730 1.686 1.00 32.02 H new ATOM 2018 N LYS A 915 -0.386 -37.264 4.686 1.00 63.40 N ATOM 2019 CA LYS A 915 0.791 -37.869 5.287 1.00 43.33 C ATOM 2020 C LYS A 915 1.961 -37.783 4.304 1.00 1.43 C ATOM 2021 O LYS A 915 1.861 -38.252 3.172 1.00 41.13 O ATOM 2022 CB LYS A 915 0.484 -39.293 5.753 1.00 15.12 C ATOM 2023 CG LYS A 915 -0.047 -40.145 4.599 1.00 60.44 C ATOM 2024 CD LYS A 915 0.318 -41.619 4.792 1.00 42.40 C ATOM 2025 CE LYS A 915 -0.760 -42.350 5.594 1.00 2.14 C ATOM 2026 NZ LYS A 915 -1.946 -42.612 4.750 1.00 54.04 N ATOM 0 H LYS A 915 -1.158 -37.909 4.517 1.00 63.40 H new ATOM 0 HA LYS A 915 1.085 -37.322 6.183 1.00 43.33 H new ATOM 0 HB2 LYS A 915 1.386 -39.748 6.161 1.00 15.12 H new ATOM 0 HB3 LYS A 915 -0.251 -39.266 6.558 1.00 15.12 H new ATOM 0 HG2 LYS A 915 -1.130 -40.040 4.533 1.00 60.44 H new ATOM 0 HG3 LYS A 915 0.366 -39.785 3.657 1.00 60.44 H new ATOM 0 HD2 LYS A 915 0.440 -42.097 3.820 1.00 42.40 H new ATOM 0 HD3 LYS A 915 1.275 -41.696 5.308 1.00 42.40 H new ATOM 0 HE2 LYS A 915 -0.363 -43.291 5.975 1.00 2.14 H new ATOM 0 HE3 LYS A 915 -1.047 -41.751 6.459 1.00 2.14 H new ATOM 0 HZ1 LYS A 915 -2.562 -43.304 5.222 1.00 54.04 H new ATOM 0 HZ2 LYS A 915 -2.470 -41.726 4.603 1.00 54.04 H new ATOM 0 HZ3 LYS A 915 -1.641 -42.991 3.831 1.00 54.04 H new ATOM 2039 N ILE A 916 3.043 -37.180 4.774 1.00 44.42 N ATOM 2040 CA ILE A 916 4.231 -37.026 3.951 1.00 40.01 C ATOM 2041 C ILE A 916 5.463 -37.437 4.759 1.00 2.15 C ATOM 2042 O ILE A 916 5.550 -37.152 5.953 1.00 43.12 O ATOM 2043 CB ILE A 916 4.312 -35.606 3.386 1.00 35.30 C ATOM 2044 CG1 ILE A 916 3.067 -35.273 2.561 1.00 72.10 C ATOM 2045 CG2 ILE A 916 5.600 -35.407 2.586 1.00 61.05 C ATOM 2046 CD1 ILE A 916 2.860 -33.760 2.467 1.00 21.02 C ATOM 0 H ILE A 916 3.122 -36.792 5.714 1.00 44.42 H new ATOM 0 HA ILE A 916 4.182 -37.686 3.085 1.00 40.01 H new ATOM 0 HB ILE A 916 4.341 -34.907 4.222 1.00 35.30 H new ATOM 0 HG12 ILE A 916 3.167 -35.693 1.560 1.00 72.10 H new ATOM 0 HG13 ILE A 916 2.191 -35.736 3.015 1.00 72.10 H new ATOM 0 HG21 ILE A 916 5.632 -34.390 2.196 1.00 61.05 H new ATOM 0 HG22 ILE A 916 6.460 -35.575 3.234 1.00 61.05 H new ATOM 0 HG23 ILE A 916 5.627 -36.115 1.757 1.00 61.05 H new ATOM 0 HD11 ILE A 916 1.969 -33.551 1.875 1.00 21.02 H new ATOM 0 HD12 ILE A 916 2.736 -33.347 3.468 1.00 21.02 H new ATOM 0 HD13 ILE A 916 3.727 -33.303 1.990 1.00 21.02 H new ATOM 2058 N PRO A 917 6.409 -38.118 4.059 1.00 4.21 N ATOM 2059 CA PRO A 917 7.633 -38.571 4.699 1.00 53.20 C ATOM 2060 C PRO A 917 8.595 -37.404 4.931 1.00 13.12 C ATOM 2061 O PRO A 917 8.716 -36.517 4.088 1.00 74.05 O ATOM 2062 CB PRO A 917 8.197 -39.629 3.765 1.00 51.22 C ATOM 2063 CG PRO A 917 7.524 -39.400 2.421 1.00 34.32 C ATOM 2064 CD PRO A 917 6.340 -38.473 2.645 1.00 61.13 C ATOM 0 HA PRO A 917 7.460 -38.987 5.692 1.00 53.20 H new ATOM 0 HB2 PRO A 917 9.280 -39.538 3.680 1.00 51.22 H new ATOM 0 HB3 PRO A 917 7.990 -40.631 4.140 1.00 51.22 H new ATOM 0 HG2 PRO A 917 8.226 -38.959 1.713 1.00 34.32 H new ATOM 0 HG3 PRO A 917 7.192 -40.346 1.994 1.00 34.32 H new ATOM 0 HD2 PRO A 917 6.404 -37.589 2.011 1.00 61.13 H new ATOM 0 HD3 PRO A 917 5.399 -38.968 2.407 1.00 61.13 H new ATOM 2072 N PHE A 918 9.255 -37.442 6.079 1.00 34.35 N ATOM 2073 CA PHE A 918 10.202 -36.399 6.433 1.00 22.23 C ATOM 2074 C PHE A 918 11.584 -36.692 5.846 1.00 43.43 C ATOM 2075 O PHE A 918 12.251 -37.638 6.260 1.00 24.22 O ATOM 2076 CB PHE A 918 10.303 -36.385 7.960 1.00 73.41 C ATOM 2077 CG PHE A 918 11.039 -35.169 8.524 1.00 3.30 C ATOM 2078 CD1 PHE A 918 12.398 -35.126 8.501 1.00 3.41 C ATOM 2079 CD2 PHE A 918 10.335 -34.130 9.048 1.00 33.23 C ATOM 2080 CE1 PHE A 918 13.082 -33.996 9.025 1.00 71.45 C ATOM 2081 CE2 PHE A 918 11.018 -33.001 9.572 1.00 63.02 C ATOM 2082 CZ PHE A 918 12.377 -32.958 9.549 1.00 44.12 C ATOM 0 H PHE A 918 9.152 -38.179 6.776 1.00 34.35 H new ATOM 0 HA PHE A 918 9.864 -35.441 6.039 1.00 22.23 H new ATOM 0 HB2 PHE A 918 9.298 -36.416 8.381 1.00 73.41 H new ATOM 0 HB3 PHE A 918 10.814 -37.290 8.288 1.00 73.41 H new ATOM 0 HD1 PHE A 918 12.957 -35.951 8.085 1.00 3.41 H new ATOM 0 HD2 PHE A 918 9.256 -34.164 9.066 1.00 33.23 H new ATOM 0 HE1 PHE A 918 14.161 -33.962 9.007 1.00 71.45 H new ATOM 0 HE2 PHE A 918 10.458 -32.177 9.989 1.00 63.02 H new ATOM 0 HZ PHE A 918 12.897 -32.099 9.947 1.00 44.12 H new ATOM 2092 N ASP A 919 11.973 -35.861 4.889 1.00 22.33 N ATOM 2093 CA ASP A 919 13.264 -36.019 4.240 1.00 12.15 C ATOM 2094 C ASP A 919 14.344 -35.354 5.096 1.00 42.24 C ATOM 2095 O ASP A 919 14.239 -34.174 5.428 1.00 22.30 O ATOM 2096 CB ASP A 919 13.273 -35.352 2.864 1.00 42.42 C ATOM 2097 CG ASP A 919 12.942 -36.279 1.693 1.00 34.42 C ATOM 2098 OD1 ASP A 919 11.777 -36.402 1.286 1.00 70.14 O ATOM 2099 OD2 ASP A 919 13.952 -36.901 1.187 1.00 23.00 O ATOM 0 H ASP A 919 11.417 -35.077 4.548 1.00 22.33 H new ATOM 0 HA ASP A 919 13.456 -37.086 4.124 1.00 12.15 H new ATOM 0 HB2 ASP A 919 12.557 -34.530 2.871 1.00 42.42 H new ATOM 0 HB3 ASP A 919 14.257 -34.916 2.695 1.00 42.42 H new ATOM 2105 N PRO A 920 15.385 -36.160 5.436 1.00 20.31 N ATOM 2106 CA PRO A 920 16.484 -35.662 6.246 1.00 32.41 C ATOM 2107 C PRO A 920 17.406 -34.761 5.424 1.00 45.52 C ATOM 2108 O PRO A 920 18.261 -34.071 5.978 1.00 51.53 O ATOM 2109 CB PRO A 920 17.182 -36.907 6.770 1.00 52.12 C ATOM 2110 CG PRO A 920 16.738 -38.045 5.866 1.00 71.42 C ATOM 2111 CD PRO A 920 15.543 -37.562 5.060 1.00 31.34 C ATOM 0 HA PRO A 920 16.148 -35.033 7.071 1.00 32.41 H new ATOM 0 HB2 PRO A 920 18.265 -36.788 6.744 1.00 52.12 H new ATOM 0 HB3 PRO A 920 16.907 -37.102 7.807 1.00 52.12 H new ATOM 0 HG2 PRO A 920 17.550 -38.344 5.203 1.00 71.42 H new ATOM 0 HG3 PRO A 920 16.470 -38.920 6.458 1.00 71.42 H new ATOM 0 HD2 PRO A 920 15.719 -37.668 3.989 1.00 31.34 H new ATOM 0 HD3 PRO A 920 14.648 -38.138 5.295 1.00 31.34 H new ATOM 2119 N ALA A 921 17.203 -34.795 4.115 1.00 34.31 N ATOM 2120 CA ALA A 921 18.005 -33.989 3.211 1.00 64.51 C ATOM 2121 C ALA A 921 17.600 -32.520 3.348 1.00 65.41 C ATOM 2122 O ALA A 921 18.401 -31.625 3.084 1.00 43.10 O ATOM 2123 CB ALA A 921 17.841 -34.509 1.781 1.00 13.22 C ATOM 0 H ALA A 921 16.494 -35.369 3.659 1.00 34.31 H new ATOM 0 HA ALA A 921 19.062 -34.064 3.466 1.00 64.51 H new ATOM 0 HB1 ALA A 921 18.443 -33.904 1.103 1.00 13.22 H new ATOM 0 HB2 ALA A 921 18.171 -35.547 1.731 1.00 13.22 H new ATOM 0 HB3 ALA A 921 16.793 -34.447 1.489 1.00 13.22 H new ATOM 2129 N GLU A 922 16.358 -32.318 3.760 1.00 32.34 N ATOM 2130 CA GLU A 922 15.837 -30.973 3.936 1.00 72.23 C ATOM 2131 C GLU A 922 16.273 -30.407 5.289 1.00 73.23 C ATOM 2132 O GLU A 922 16.804 -29.300 5.360 1.00 22.33 O ATOM 2133 CB GLU A 922 14.313 -30.953 3.798 1.00 22.12 C ATOM 2134 CG GLU A 922 13.858 -31.807 2.613 1.00 43.23 C ATOM 2135 CD GLU A 922 12.960 -31.003 1.671 1.00 52.31 C ATOM 2136 OE1 GLU A 922 11.792 -30.743 1.999 1.00 64.42 O ATOM 2137 OE2 GLU A 922 13.514 -30.643 0.563 1.00 5.22 O ATOM 0 H GLU A 922 15.696 -33.063 3.977 1.00 32.34 H new ATOM 0 HA GLU A 922 16.248 -30.339 3.150 1.00 72.23 H new ATOM 0 HB2 GLU A 922 13.856 -31.325 4.715 1.00 22.12 H new ATOM 0 HB3 GLU A 922 13.970 -29.927 3.664 1.00 22.12 H new ATOM 0 HG2 GLU A 922 14.728 -32.172 2.068 1.00 43.23 H new ATOM 0 HG3 GLU A 922 13.319 -32.682 2.976 1.00 43.23 H new ATOM 2145 N MET A 923 16.032 -31.193 6.328 1.00 14.41 N ATOM 2146 CA MET A 923 16.393 -30.784 7.675 1.00 53.41 C ATOM 2147 C MET A 923 17.735 -30.049 7.684 1.00 53.25 C ATOM 2148 O MET A 923 17.825 -28.919 8.160 1.00 15.54 O ATOM 2149 CB MET A 923 16.480 -32.016 8.577 1.00 75.31 C ATOM 2150 CG MET A 923 16.889 -31.627 9.999 1.00 34.20 C ATOM 2151 SD MET A 923 17.568 -33.043 10.848 1.00 75.11 S ATOM 2152 CE MET A 923 16.246 -34.217 10.598 1.00 23.04 C ATOM 0 H MET A 923 15.591 -32.111 6.264 1.00 14.41 H new ATOM 0 HA MET A 923 15.625 -30.105 8.046 1.00 53.41 H new ATOM 0 HB2 MET A 923 15.516 -32.524 8.598 1.00 75.31 H new ATOM 0 HB3 MET A 923 17.203 -32.721 8.167 1.00 75.31 H new ATOM 0 HG2 MET A 923 17.625 -30.824 9.968 1.00 34.20 H new ATOM 0 HG3 MET A 923 16.025 -31.246 10.543 1.00 34.20 H new ATOM 0 HE1 MET A 923 16.404 -35.084 11.239 1.00 23.04 H new ATOM 0 HE2 MET A 923 15.293 -33.750 10.847 1.00 23.04 H new ATOM 0 HE3 MET A 923 16.233 -34.534 9.555 1.00 23.04 H new ATOM 2162 N SER A 924 18.744 -30.721 7.150 1.00 4.24 N ATOM 2163 CA SER A 924 20.078 -30.146 7.091 1.00 55.23 C ATOM 2164 C SER A 924 20.207 -29.253 5.855 1.00 4.42 C ATOM 2165 O SER A 924 19.313 -29.221 5.011 1.00 4.10 O ATOM 2166 CB SER A 924 21.148 -31.239 7.071 1.00 42.55 C ATOM 2167 OG SER A 924 20.797 -32.315 6.205 1.00 55.51 O ATOM 0 H SER A 924 18.665 -31.658 6.754 1.00 4.24 H new ATOM 0 HA SER A 924 20.231 -29.542 7.986 1.00 55.23 H new ATOM 0 HB2 SER A 924 22.098 -30.811 6.750 1.00 42.55 H new ATOM 0 HB3 SER A 924 21.295 -31.620 8.081 1.00 42.55 H new ATOM 0 HG SER A 924 21.506 -32.991 6.219 1.00 55.51 H new ATOM 2173 N LYS A 925 21.328 -28.549 5.788 1.00 11.25 N ATOM 2174 CA LYS A 925 21.586 -27.658 4.670 1.00 3.54 C ATOM 2175 C LYS A 925 21.660 -28.474 3.379 1.00 74.51 C ATOM 2176 O LYS A 925 22.566 -29.288 3.205 1.00 35.13 O ATOM 2177 CB LYS A 925 22.834 -26.813 4.936 1.00 65.34 C ATOM 2178 CG LYS A 925 22.847 -25.562 4.056 1.00 41.35 C ATOM 2179 CD LYS A 925 23.969 -24.609 4.474 1.00 55.33 C ATOM 2180 CE LYS A 925 23.588 -23.835 5.737 1.00 14.33 C ATOM 2181 NZ LYS A 925 24.505 -22.692 5.941 1.00 5.35 N ATOM 0 H LYS A 925 22.067 -28.578 6.490 1.00 11.25 H new ATOM 0 HA LYS A 925 20.767 -26.948 4.552 1.00 3.54 H new ATOM 0 HB2 LYS A 925 22.864 -26.523 5.986 1.00 65.34 H new ATOM 0 HB3 LYS A 925 23.727 -27.407 4.743 1.00 65.34 H new ATOM 0 HG2 LYS A 925 22.978 -25.848 3.013 1.00 41.35 H new ATOM 0 HG3 LYS A 925 21.886 -25.052 4.128 1.00 41.35 H new ATOM 0 HD2 LYS A 925 24.884 -25.174 4.652 1.00 55.33 H new ATOM 0 HD3 LYS A 925 24.178 -23.910 3.664 1.00 55.33 H new ATOM 0 HE2 LYS A 925 22.562 -23.476 5.655 1.00 14.33 H new ATOM 0 HE3 LYS A 925 23.625 -24.498 6.602 1.00 14.33 H new ATOM 0 HZ1 LYS A 925 24.232 -22.177 6.803 1.00 5.35 H new ATOM 0 HZ2 LYS A 925 25.479 -23.042 6.041 1.00 5.35 H new ATOM 0 HZ3 LYS A 925 24.449 -22.052 5.123 1.00 5.35 H new