USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=31 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 905 TYR OH : rot 120:sc= -0.257 USER MOD Set 1.2: A 912 HIS : no HD1:sc= -0.257 K(o=-0.51,f=2.1) USER MOD Set 2.1: A 814 LYS NZ :NH3+ 180:sc= -6.91! (180deg=-4.14!) USER MOD Set 2.2: A 902 GLN : amide:sc= -3.97! K(o=-11!,f=-3.8) USER MOD Set 3.1: A 830 HIS : no HE2:sc= -26.3! C(o=-29!,f=-32!) USER MOD Set 3.2: A 832 THR OG1 : rot -46:sc= -2.51! USER MOD Set 4.1: A 810 CYS SG : rot -157:sc= 0.86 USER MOD Set 4.2: A 871 HIS : no HE2:sc= -8.61! C(o=-7.7!,f=-23!) USER MOD Single : A 805 ASN : amide:sc= -8.55! C(o=-8.5!,f=-3.9!) USER MOD Single : A 806 LYS NZ :NH3+ -129:sc= 0 (180deg=-1.15) USER MOD Single : A 807 LYS NZ :NH3+ -161:sc= -0.459 (180deg=-0.774) USER MOD Single : A 812 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 813 CYS SG : rot -44:sc= -0.146 USER MOD Single : A 818 CYS SG : rot -170:sc= -0.0103 USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot 180:sc= 0 USER MOD Single : A 829 CYS SG : rot 180:sc= 0 USER MOD Single : A 831 TYR OH : rot -120:sc= -1.22 USER MOD Single : A 839 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0678) USER MOD Single : A 841 CYS SG : rot 70:sc= 0.859 USER MOD Single : A 844 SER OG : rot 180:sc= 0 USER MOD Single : A 858 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0485) USER MOD Single : A 861 LYS NZ :NH3+ -159:sc= -0.0202 (180deg=-0.235) USER MOD Single : A 864 CYS SG : rot 95:sc= -0.668 USER MOD Single : A 867 GLN : amide:sc= -0.798 K(o=-0.8,f=-3.8!) USER MOD Single : A 868 ASN : amide:sc= -2.35 K(o=-2.3,f=-7.4!) USER MOD Single : A 869 CYS SG : rot 180:sc= 0 USER MOD Single : A 870 SER OG : rot 180:sc= 0 USER MOD Single : A 876 HIS : no HD1:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 878 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 879 TYR OH : rot 180:sc= 0 USER MOD Single : A 880 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 881 THR OG1 : rot 180:sc= -0.516 USER MOD Single : A 888 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 891 SER OG : rot 121:sc= -1.33 USER MOD Single : A 899 THR OG1 : rot 180:sc= -2.17! USER MOD Single : A 903 THR OG1 : rot 180:sc= -1.54! USER MOD Single : A 906 SER OG : rot 180:sc= 0 USER MOD Single : A 907 LYS NZ :NH3+ 130:sc= -1.1 (180deg=-1.6!) USER MOD Single : A 909 LYS NZ :NH3+ 150:sc= -0.193 (180deg=-0.975) USER MOD Single : A 915 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 MET CE :methyl -137:sc= -6.13! (180deg=-11.9!) USER MOD Single : A 924 SER OG : rot 35:sc= 0.744 USER MOD Single : A 925 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 -2.412 -26.455 -1.510 1.00 44.34 N ATOM 209 CA ASN A 805 -1.649 -26.068 -0.335 1.00 51.04 C ATOM 210 C ASN A 805 -2.500 -25.144 0.538 1.00 33.44 C ATOM 211 O ASN A 805 -3.312 -24.374 0.027 1.00 22.41 O ATOM 212 CB ASN A 805 -0.379 -25.310 -0.728 1.00 15.22 C ATOM 213 CG ASN A 805 0.153 -24.486 0.447 1.00 75.41 C ATOM 214 OD1 ASN A 805 0.381 -23.292 0.348 1.00 24.02 O ATOM 215 ND2 ASN A 805 0.336 -25.189 1.561 1.00 31.10 N ATOM 0 HA ASN A 805 -1.375 -26.975 0.204 1.00 51.04 H new ATOM 0 HB2 ASN A 805 0.384 -26.016 -1.056 1.00 15.22 H new ATOM 0 HB3 ASN A 805 -0.590 -24.653 -1.572 1.00 15.22 H new ATOM 0 HD21 ASN A 805 0.688 -24.730 2.402 1.00 31.10 H new ATOM 0 HD22 ASN A 805 0.125 -26.187 1.575 1.00 31.10 H new ATOM 222 N LYS A 806 -2.286 -25.252 1.841 1.00 2.04 N ATOM 223 CA LYS A 806 -3.023 -24.436 2.791 1.00 32.11 C ATOM 224 C LYS A 806 -2.036 -23.718 3.714 1.00 35.10 C ATOM 225 O LYS A 806 -0.968 -24.246 4.017 1.00 22.23 O ATOM 226 CB LYS A 806 -4.057 -25.283 3.536 1.00 71.13 C ATOM 227 CG LYS A 806 -4.459 -24.622 4.856 1.00 72.12 C ATOM 228 CD LYS A 806 -5.879 -25.025 5.261 1.00 43.25 C ATOM 229 CE LYS A 806 -6.045 -26.545 5.236 1.00 72.51 C ATOM 230 NZ LYS A 806 -7.248 -26.948 5.999 1.00 1.40 N ATOM 0 H LYS A 806 -1.613 -25.892 2.261 1.00 2.04 H new ATOM 0 HA LYS A 806 -3.592 -23.665 2.270 1.00 32.11 H new ATOM 0 HB2 LYS A 806 -4.939 -25.420 2.910 1.00 71.13 H new ATOM 0 HB3 LYS A 806 -3.648 -26.274 3.731 1.00 71.13 H new ATOM 0 HG2 LYS A 806 -3.758 -24.910 5.639 1.00 72.12 H new ATOM 0 HG3 LYS A 806 -4.399 -23.538 4.757 1.00 72.12 H new ATOM 0 HD2 LYS A 806 -6.097 -24.648 6.260 1.00 43.25 H new ATOM 0 HD3 LYS A 806 -6.599 -24.566 4.583 1.00 43.25 H new ATOM 0 HE2 LYS A 806 -6.128 -26.891 4.206 1.00 72.51 H new ATOM 0 HE3 LYS A 806 -5.161 -27.020 5.661 1.00 72.51 H new ATOM 0 HZ1 LYS A 806 -6.994 -27.691 6.681 1.00 1.40 H new ATOM 0 HZ2 LYS A 806 -7.628 -26.125 6.509 1.00 1.40 H new ATOM 0 HZ3 LYS A 806 -7.969 -27.312 5.344 1.00 1.40 H new ATOM 243 N LYS A 807 -2.430 -22.525 4.135 1.00 71.02 N ATOM 244 CA LYS A 807 -1.594 -21.729 5.017 1.00 24.21 C ATOM 245 C LYS A 807 -2.044 -21.937 6.464 1.00 22.45 C ATOM 246 O LYS A 807 -3.177 -22.345 6.713 1.00 33.03 O ATOM 247 CB LYS A 807 -1.594 -20.264 4.578 1.00 41.43 C ATOM 248 CG LYS A 807 -0.929 -19.375 5.631 1.00 24.30 C ATOM 249 CD LYS A 807 -0.987 -17.902 5.222 1.00 64.23 C ATOM 250 CE LYS A 807 -2.424 -17.380 5.254 1.00 34.42 C ATOM 251 NZ LYS A 807 -2.440 -15.918 5.482 1.00 40.03 N ATOM 0 H LYS A 807 -3.317 -22.090 3.881 1.00 71.02 H new ATOM 0 HA LYS A 807 -0.556 -22.056 4.955 1.00 24.21 H new ATOM 0 HB2 LYS A 807 -1.067 -20.165 3.629 1.00 41.43 H new ATOM 0 HB3 LYS A 807 -2.618 -19.931 4.410 1.00 41.43 H new ATOM 0 HG2 LYS A 807 -1.426 -19.509 6.592 1.00 24.30 H new ATOM 0 HG3 LYS A 807 0.109 -19.678 5.765 1.00 24.30 H new ATOM 0 HD2 LYS A 807 -0.366 -17.310 5.894 1.00 64.23 H new ATOM 0 HD3 LYS A 807 -0.575 -17.783 4.220 1.00 64.23 H new ATOM 0 HE2 LYS A 807 -2.923 -17.613 4.313 1.00 34.42 H new ATOM 0 HE3 LYS A 807 -2.982 -17.883 6.043 1.00 34.42 H new ATOM 0 HZ1 LYS A 807 -3.381 -15.629 5.818 1.00 40.03 H new ATOM 0 HZ2 LYS A 807 -1.726 -15.670 6.197 1.00 40.03 H new ATOM 0 HZ3 LYS A 807 -2.224 -15.425 4.592 1.00 40.03 H new ATOM 264 N LEU A 808 -1.132 -21.648 7.381 1.00 13.04 N ATOM 265 CA LEU A 808 -1.421 -21.798 8.798 1.00 73.35 C ATOM 266 C LEU A 808 -1.047 -20.508 9.530 1.00 64.32 C ATOM 267 O LEU A 808 -0.055 -19.863 9.191 1.00 34.40 O ATOM 268 CB LEU A 808 -0.732 -23.045 9.356 1.00 43.14 C ATOM 269 CG LEU A 808 -1.278 -24.388 8.869 1.00 71.55 C ATOM 270 CD1 LEU A 808 -0.546 -24.853 7.608 1.00 32.41 C ATOM 271 CD2 LEU A 808 -1.226 -25.437 9.981 1.00 32.32 C ATOM 0 H LEU A 808 -0.193 -21.311 7.171 1.00 13.04 H new ATOM 0 HA LEU A 808 -2.488 -21.955 8.955 1.00 73.35 H new ATOM 0 HB2 LEU A 808 0.327 -22.993 9.105 1.00 43.14 H new ATOM 0 HB3 LEU A 808 -0.803 -23.019 10.443 1.00 43.14 H new ATOM 0 HG LEU A 808 -2.326 -24.254 8.602 1.00 71.55 H new ATOM 0 HD11 LEU A 808 -0.954 -25.810 7.283 1.00 32.41 H new ATOM 0 HD12 LEU A 808 -0.679 -24.115 6.817 1.00 32.41 H new ATOM 0 HD13 LEU A 808 0.516 -24.966 7.825 1.00 32.41 H new ATOM 0 HD21 LEU A 808 -1.620 -26.382 9.608 1.00 32.32 H new ATOM 0 HD22 LEU A 808 -0.194 -25.576 10.302 1.00 32.32 H new ATOM 0 HD23 LEU A 808 -1.827 -25.102 10.826 1.00 32.32 H new ATOM 283 N LEU A 809 -1.859 -20.170 10.520 1.00 31.53 N ATOM 284 CA LEU A 809 -1.625 -18.969 11.303 1.00 34.04 C ATOM 285 C LEU A 809 -1.455 -19.350 12.775 1.00 14.04 C ATOM 286 O LEU A 809 -1.760 -20.475 13.168 1.00 21.13 O ATOM 287 CB LEU A 809 -2.735 -17.945 11.057 1.00 10.24 C ATOM 288 CG LEU A 809 -2.493 -16.955 9.916 1.00 1.33 C ATOM 289 CD1 LEU A 809 -2.668 -17.632 8.556 1.00 73.40 C ATOM 290 CD2 LEU A 809 -3.387 -15.721 10.062 1.00 64.33 C ATOM 0 H LEU A 809 -2.680 -20.707 10.798 1.00 31.53 H new ATOM 0 HA LEU A 809 -0.700 -18.484 10.990 1.00 34.04 H new ATOM 0 HB2 LEU A 809 -3.661 -18.484 10.854 1.00 10.24 H new ATOM 0 HB3 LEU A 809 -2.890 -17.379 11.976 1.00 10.24 H new ATOM 0 HG LEU A 809 -1.460 -16.613 9.974 1.00 1.33 H new ATOM 0 HD11 LEU A 809 -2.490 -16.906 7.763 1.00 73.40 H new ATOM 0 HD12 LEU A 809 -1.956 -18.452 8.464 1.00 73.40 H new ATOM 0 HD13 LEU A 809 -3.683 -18.021 8.471 1.00 73.40 H new ATOM 0 HD21 LEU A 809 -3.195 -15.033 9.238 1.00 64.33 H new ATOM 0 HD22 LEU A 809 -4.433 -16.026 10.044 1.00 64.33 H new ATOM 0 HD23 LEU A 809 -3.170 -15.224 11.008 1.00 64.33 H new ATOM 302 N CYS A 810 -0.970 -18.391 13.550 1.00 44.25 N ATOM 303 CA CYS A 810 -0.755 -18.612 14.970 1.00 54.43 C ATOM 304 C CYS A 810 -1.883 -17.921 15.739 1.00 54.14 C ATOM 305 O CYS A 810 -1.979 -16.695 15.739 1.00 51.41 O ATOM 306 CB CYS A 810 0.623 -18.122 15.417 1.00 44.33 C ATOM 307 SG CYS A 810 1.226 -19.139 16.813 1.00 5.02 S ATOM 0 H CYS A 810 -0.720 -17.458 13.221 1.00 44.25 H new ATOM 0 HA CYS A 810 -0.773 -19.681 15.181 1.00 54.43 H new ATOM 0 HB2 CYS A 810 1.325 -18.178 14.585 1.00 44.33 H new ATOM 0 HB3 CYS A 810 0.566 -17.075 15.716 1.00 44.33 H new ATOM 0 HG CYS A 810 2.111 -18.468 17.488 1.00 5.02 H new ATOM 313 N ARG A 811 -2.709 -18.738 16.375 1.00 33.23 N ATOM 314 CA ARG A 811 -3.827 -18.221 17.147 1.00 60.24 C ATOM 315 C ARG A 811 -3.381 -17.027 17.993 1.00 62.21 C ATOM 316 O ARG A 811 -4.190 -16.165 18.332 1.00 60.11 O ATOM 317 CB ARG A 811 -4.408 -19.299 18.064 1.00 55.21 C ATOM 318 CG ARG A 811 -5.365 -18.688 19.090 1.00 50.22 C ATOM 319 CD ARG A 811 -6.395 -19.717 19.561 1.00 65.13 C ATOM 320 NE ARG A 811 -6.884 -19.362 20.911 1.00 13.33 N ATOM 321 CZ ARG A 811 -7.900 -19.993 21.538 1.00 3.35 C ATOM 322 NH1 ARG A 811 -8.543 -21.018 20.941 1.00 64.33 N ATOM 323 NH2 ARG A 811 -8.255 -19.592 22.745 1.00 44.40 N ATOM 0 H ARG A 811 -2.627 -19.755 16.372 1.00 33.23 H new ATOM 0 HA ARG A 811 -4.597 -17.904 16.444 1.00 60.24 H new ATOM 0 HB2 ARG A 811 -4.935 -20.043 17.468 1.00 55.21 H new ATOM 0 HB3 ARG A 811 -3.600 -19.818 18.579 1.00 55.21 H new ATOM 0 HG2 ARG A 811 -4.799 -18.317 19.945 1.00 50.22 H new ATOM 0 HG3 ARG A 811 -5.876 -17.831 18.651 1.00 50.22 H new ATOM 0 HD2 ARG A 811 -7.230 -19.755 18.861 1.00 65.13 H new ATOM 0 HD3 ARG A 811 -5.947 -20.711 19.577 1.00 65.13 H new ATOM 0 HE ARG A 811 -6.425 -18.593 21.399 1.00 13.33 H new ATOM 0 HH11 ARG A 811 -8.263 -21.322 20.009 1.00 64.33 H new ATOM 0 HH12 ARG A 811 -9.309 -21.489 21.422 1.00 64.33 H new ATOM 0 HH21 ARG A 811 -7.764 -18.817 23.190 1.00 44.40 H new ATOM 0 HH22 ARG A 811 -9.020 -20.058 23.233 1.00 44.40 H new ATOM 336 N LYS A 812 -2.094 -17.015 18.310 1.00 74.12 N ATOM 337 CA LYS A 812 -1.531 -15.941 19.110 1.00 21.11 C ATOM 338 C LYS A 812 -2.117 -14.605 18.649 1.00 73.44 C ATOM 339 O LYS A 812 -2.992 -14.046 19.308 1.00 21.35 O ATOM 340 CB LYS A 812 -0.002 -15.988 19.070 1.00 71.32 C ATOM 341 CG LYS A 812 0.548 -16.894 20.174 1.00 72.05 C ATOM 342 CD LYS A 812 0.136 -16.385 21.556 1.00 30.14 C ATOM 343 CE LYS A 812 0.192 -14.857 21.617 1.00 34.32 C ATOM 344 NZ LYS A 812 0.240 -14.396 23.023 1.00 65.13 N ATOM 0 H LYS A 812 -1.426 -17.732 18.027 1.00 74.12 H new ATOM 0 HA LYS A 812 -1.804 -16.064 20.158 1.00 21.11 H new ATOM 0 HB2 LYS A 812 0.329 -16.352 18.097 1.00 71.32 H new ATOM 0 HB3 LYS A 812 0.400 -14.981 19.187 1.00 71.32 H new ATOM 0 HG2 LYS A 812 0.180 -17.910 20.032 1.00 72.05 H new ATOM 0 HG3 LYS A 812 1.635 -16.936 20.107 1.00 72.05 H new ATOM 0 HD2 LYS A 812 -0.874 -16.725 21.786 1.00 30.14 H new ATOM 0 HD3 LYS A 812 0.795 -16.807 22.314 1.00 30.14 H new ATOM 0 HE2 LYS A 812 1.070 -14.498 21.080 1.00 34.32 H new ATOM 0 HE3 LYS A 812 -0.681 -14.435 21.119 1.00 34.32 H new ATOM 0 HZ1 LYS A 812 0.278 -13.357 23.047 1.00 65.13 H new ATOM 0 HZ2 LYS A 812 -0.610 -14.723 23.525 1.00 65.13 H new ATOM 0 HZ3 LYS A 812 1.086 -14.784 23.487 1.00 65.13 H new ATOM 357 N CYS A 813 -1.612 -14.133 17.519 1.00 51.52 N ATOM 358 CA CYS A 813 -2.075 -12.873 16.961 1.00 1.03 C ATOM 359 C CYS A 813 -2.606 -13.138 15.551 1.00 32.13 C ATOM 360 O CYS A 813 -2.711 -12.219 14.741 1.00 53.13 O ATOM 361 CB CYS A 813 -0.971 -11.813 16.966 1.00 74.25 C ATOM 362 SG CYS A 813 -1.696 -10.154 16.697 1.00 20.33 S ATOM 0 H CYS A 813 -0.887 -14.600 16.974 1.00 51.52 H new ATOM 0 HA CYS A 813 -2.877 -12.471 17.580 1.00 1.03 H new ATOM 0 HB2 CYS A 813 -0.437 -11.836 17.916 1.00 74.25 H new ATOM 0 HB3 CYS A 813 -0.242 -12.031 16.186 1.00 74.25 H new ATOM 0 HG CYS A 813 -2.568 -10.212 15.734 1.00 20.33 H new ATOM 368 N LYS A 814 -2.927 -14.399 15.302 1.00 73.02 N ATOM 369 CA LYS A 814 -3.445 -14.797 14.004 1.00 52.33 C ATOM 370 C LYS A 814 -2.493 -14.311 12.909 1.00 10.00 C ATOM 371 O LYS A 814 -2.852 -13.451 12.106 1.00 5.33 O ATOM 372 CB LYS A 814 -4.884 -14.308 13.828 1.00 14.34 C ATOM 373 CG LYS A 814 -5.609 -14.243 15.174 1.00 12.23 C ATOM 374 CD LYS A 814 -5.576 -15.599 15.881 1.00 71.51 C ATOM 375 CE LYS A 814 -6.558 -16.579 15.234 1.00 42.41 C ATOM 376 NZ LYS A 814 -5.875 -17.392 14.204 1.00 62.45 N ATOM 0 H LYS A 814 -2.838 -15.159 15.977 1.00 73.02 H new ATOM 0 HA LYS A 814 -3.490 -15.883 13.929 1.00 52.33 H new ATOM 0 HB2 LYS A 814 -4.883 -13.322 13.364 1.00 14.34 H new ATOM 0 HB3 LYS A 814 -5.419 -14.977 13.154 1.00 14.34 H new ATOM 0 HG2 LYS A 814 -5.142 -13.488 15.806 1.00 12.23 H new ATOM 0 HG3 LYS A 814 -6.643 -13.935 15.020 1.00 12.23 H new ATOM 0 HD2 LYS A 814 -4.567 -16.010 15.841 1.00 71.51 H new ATOM 0 HD3 LYS A 814 -5.826 -15.470 16.934 1.00 71.51 H new ATOM 0 HE2 LYS A 814 -6.986 -17.231 15.996 1.00 42.41 H new ATOM 0 HE3 LYS A 814 -7.385 -16.030 14.783 1.00 42.41 H new ATOM 0 HZ1 LYS A 814 -6.555 -18.051 13.775 1.00 62.45 H new ATOM 0 HZ2 LYS A 814 -5.488 -16.767 13.469 1.00 62.45 H new ATOM 0 HZ3 LYS A 814 -5.101 -17.930 14.643 1.00 62.45 H new ATOM 389 N ALA A 815 -1.298 -14.883 12.912 1.00 72.52 N ATOM 390 CA ALA A 815 -0.292 -14.520 11.929 1.00 42.31 C ATOM 391 C ALA A 815 0.327 -15.791 11.344 1.00 32.02 C ATOM 392 O ALA A 815 0.451 -16.800 12.036 1.00 33.32 O ATOM 393 CB ALA A 815 0.752 -13.609 12.579 1.00 32.44 C ATOM 0 H ALA A 815 -1.004 -15.596 13.580 1.00 72.52 H new ATOM 0 HA ALA A 815 -0.743 -13.965 11.106 1.00 42.31 H new ATOM 0 HB1 ALA A 815 1.507 -13.337 11.841 1.00 32.44 H new ATOM 0 HB2 ALA A 815 0.266 -12.707 12.951 1.00 32.44 H new ATOM 0 HB3 ALA A 815 1.227 -14.134 13.408 1.00 32.44 H new ATOM 399 N LEU A 816 0.699 -15.700 10.076 1.00 72.52 N ATOM 400 CA LEU A 816 1.302 -16.831 9.390 1.00 15.01 C ATOM 401 C LEU A 816 2.273 -17.537 10.337 1.00 23.44 C ATOM 402 O LEU A 816 3.038 -16.886 11.048 1.00 53.15 O ATOM 403 CB LEU A 816 1.942 -16.381 8.076 1.00 50.25 C ATOM 404 CG LEU A 816 2.892 -17.382 7.415 1.00 75.24 C ATOM 405 CD1 LEU A 816 4.256 -17.383 8.107 1.00 33.21 C ATOM 406 CD2 LEU A 816 2.270 -18.780 7.370 1.00 3.31 C ATOM 0 H LEU A 816 0.595 -14.861 9.505 1.00 72.52 H new ATOM 0 HA LEU A 816 0.540 -17.559 9.113 1.00 15.01 H new ATOM 0 HB2 LEU A 816 1.146 -16.145 7.370 1.00 50.25 H new ATOM 0 HB3 LEU A 816 2.490 -15.457 8.260 1.00 50.25 H new ATOM 0 HG LEU A 816 3.055 -17.069 6.384 1.00 75.24 H new ATOM 0 HD11 LEU A 816 4.912 -18.103 7.618 1.00 33.21 H new ATOM 0 HD12 LEU A 816 4.697 -16.388 8.043 1.00 33.21 H new ATOM 0 HD13 LEU A 816 4.132 -17.658 9.154 1.00 33.21 H new ATOM 0 HD21 LEU A 816 2.965 -19.472 6.896 1.00 3.31 H new ATOM 0 HD22 LEU A 816 2.058 -19.117 8.385 1.00 3.31 H new ATOM 0 HD23 LEU A 816 1.343 -18.748 6.798 1.00 3.31 H new ATOM 418 N ALA A 817 2.212 -18.861 10.318 1.00 42.24 N ATOM 419 CA ALA A 817 3.077 -19.663 11.166 1.00 43.31 C ATOM 420 C ALA A 817 3.813 -20.694 10.307 1.00 12.34 C ATOM 421 O ALA A 817 5.022 -20.871 10.444 1.00 44.23 O ATOM 422 CB ALA A 817 2.246 -20.313 12.274 1.00 40.04 C ATOM 0 H ALA A 817 1.576 -19.398 9.728 1.00 42.24 H new ATOM 0 HA ALA A 817 3.829 -19.038 11.647 1.00 43.31 H new ATOM 0 HB1 ALA A 817 2.895 -20.915 12.910 1.00 40.04 H new ATOM 0 HB2 ALA A 817 1.768 -19.538 12.873 1.00 40.04 H new ATOM 0 HB3 ALA A 817 1.482 -20.950 11.829 1.00 40.04 H new ATOM 428 N CYS A 818 3.052 -21.347 9.442 1.00 54.01 N ATOM 429 CA CYS A 818 3.616 -22.356 8.561 1.00 11.43 C ATOM 430 C CYS A 818 2.577 -22.693 7.490 1.00 64.13 C ATOM 431 O CYS A 818 1.503 -22.096 7.452 1.00 53.01 O ATOM 432 CB CYS A 818 4.061 -23.598 9.336 1.00 41.31 C ATOM 433 SG CYS A 818 2.859 -23.971 10.665 1.00 42.44 S ATOM 0 H CYS A 818 2.049 -21.197 9.332 1.00 54.01 H new ATOM 0 HA CYS A 818 4.515 -21.965 8.084 1.00 11.43 H new ATOM 0 HB2 CYS A 818 4.143 -24.449 8.660 1.00 41.31 H new ATOM 0 HB3 CYS A 818 5.050 -23.435 9.764 1.00 41.31 H new ATOM 0 HG CYS A 818 3.345 -24.891 11.444 1.00 42.44 H new ATOM 439 N TYR A 819 2.935 -23.649 6.645 1.00 72.02 N ATOM 440 CA TYR A 819 2.047 -24.073 5.575 1.00 22.04 C ATOM 441 C TYR A 819 1.953 -25.599 5.514 1.00 41.15 C ATOM 442 O TYR A 819 2.941 -26.295 5.742 1.00 30.23 O ATOM 443 CB TYR A 819 2.675 -23.560 4.278 1.00 12.30 C ATOM 444 CG TYR A 819 2.688 -22.035 4.154 1.00 4.22 C ATOM 445 CD1 TYR A 819 1.578 -21.372 3.671 1.00 4.22 C ATOM 446 CD2 TYR A 819 3.810 -21.322 4.525 1.00 24.24 C ATOM 447 CE1 TYR A 819 1.591 -19.937 3.555 1.00 41.44 C ATOM 448 CE2 TYR A 819 3.823 -19.887 4.409 1.00 61.01 C ATOM 449 CZ TYR A 819 2.713 -19.265 3.929 1.00 32.03 C ATOM 450 OH TYR A 819 2.725 -17.910 3.819 1.00 12.52 O ATOM 0 H TYR A 819 3.827 -24.142 6.679 1.00 72.02 H new ATOM 0 HA TYR A 819 1.041 -23.685 5.734 1.00 22.04 H new ATOM 0 HB2 TYR A 819 3.699 -23.928 4.211 1.00 12.30 H new ATOM 0 HB3 TYR A 819 2.130 -23.979 3.432 1.00 12.30 H new ATOM 0 HD1 TYR A 819 0.700 -21.929 3.380 1.00 4.22 H new ATOM 0 HD2 TYR A 819 4.679 -21.841 4.903 1.00 24.24 H new ATOM 0 HE1 TYR A 819 0.729 -19.406 3.179 1.00 41.44 H new ATOM 0 HE2 TYR A 819 4.694 -19.318 4.697 1.00 61.01 H new ATOM 0 HH TYR A 819 3.590 -17.565 4.123 1.00 12.52 H new ATOM 460 N THR A 820 0.756 -26.074 5.203 1.00 12.10 N ATOM 461 CA THR A 820 0.520 -27.505 5.108 1.00 12.51 C ATOM 462 C THR A 820 1.403 -28.120 4.020 1.00 14.45 C ATOM 463 O THR A 820 1.722 -29.306 4.072 1.00 34.53 O ATOM 464 CB THR A 820 -0.976 -27.722 4.872 1.00 70.30 C ATOM 465 OG1 THR A 820 -1.259 -28.946 5.544 1.00 30.51 O ATOM 466 CG2 THR A 820 -1.300 -28.018 3.406 1.00 35.23 C ATOM 0 H THR A 820 -0.061 -25.493 5.014 1.00 12.10 H new ATOM 0 HA THR A 820 0.795 -28.014 6.032 1.00 12.51 H new ATOM 0 HB THR A 820 -1.527 -26.838 5.194 1.00 70.30 H new ATOM 0 HG1 THR A 820 -2.210 -29.162 5.443 1.00 30.51 H new ATOM 0 HG21 THR A 820 -2.374 -28.164 3.293 1.00 35.23 H new ATOM 0 HG22 THR A 820 -0.980 -27.180 2.786 1.00 35.23 H new ATOM 0 HG23 THR A 820 -0.776 -28.921 3.093 1.00 35.23 H new ATOM 474 N ALA A 821 1.772 -27.284 3.061 1.00 64.42 N ATOM 475 CA ALA A 821 2.612 -27.731 1.962 1.00 21.23 C ATOM 476 C ALA A 821 3.950 -28.224 2.517 1.00 43.33 C ATOM 477 O ALA A 821 4.626 -29.037 1.887 1.00 15.25 O ATOM 478 CB ALA A 821 2.782 -26.593 0.954 1.00 61.11 C ATOM 0 H ALA A 821 1.505 -26.300 3.022 1.00 64.42 H new ATOM 0 HA ALA A 821 2.146 -28.565 1.436 1.00 21.23 H new ATOM 0 HB1 ALA A 821 3.412 -26.928 0.130 1.00 61.11 H new ATOM 0 HB2 ALA A 821 1.806 -26.300 0.568 1.00 61.11 H new ATOM 0 HB3 ALA A 821 3.250 -25.739 1.444 1.00 61.11 H new ATOM 484 N ASP A 822 4.294 -27.710 3.689 1.00 72.41 N ATOM 485 CA ASP A 822 5.539 -28.088 4.335 1.00 2.22 C ATOM 486 C ASP A 822 5.231 -28.747 5.681 1.00 0.43 C ATOM 487 O ASP A 822 5.963 -28.557 6.651 1.00 23.12 O ATOM 488 CB ASP A 822 6.417 -26.862 4.598 1.00 35.44 C ATOM 489 CG ASP A 822 6.791 -26.056 3.353 1.00 12.55 C ATOM 490 OD1 ASP A 822 6.385 -26.389 2.230 1.00 33.14 O ATOM 491 OD2 ASP A 822 7.543 -25.031 3.574 1.00 53.32 O ATOM 0 H ASP A 822 3.732 -27.035 4.208 1.00 72.41 H new ATOM 0 HA ASP A 822 6.067 -28.775 3.674 1.00 2.22 H new ATOM 0 HB2 ASP A 822 5.898 -26.205 5.296 1.00 35.44 H new ATOM 0 HB3 ASP A 822 7.333 -27.189 5.090 1.00 35.44 H new ATOM 497 N VAL A 823 4.146 -29.507 5.697 1.00 1.12 N ATOM 498 CA VAL A 823 3.732 -30.195 6.908 1.00 1.12 C ATOM 499 C VAL A 823 3.923 -31.702 6.724 1.00 2.34 C ATOM 500 O VAL A 823 3.392 -32.288 5.782 1.00 2.04 O ATOM 501 CB VAL A 823 2.293 -29.813 7.261 1.00 71.43 C ATOM 502 CG1 VAL A 823 1.632 -30.897 8.115 1.00 71.24 C ATOM 503 CG2 VAL A 823 2.242 -28.455 7.963 1.00 41.12 C ATOM 0 H VAL A 823 3.541 -29.662 4.891 1.00 1.12 H new ATOM 0 HA VAL A 823 4.351 -29.890 7.752 1.00 1.12 H new ATOM 0 HB VAL A 823 1.731 -29.730 6.331 1.00 71.43 H new ATOM 0 HG11 VAL A 823 0.610 -30.601 8.352 1.00 71.24 H new ATOM 0 HG12 VAL A 823 1.619 -31.837 7.563 1.00 71.24 H new ATOM 0 HG13 VAL A 823 2.196 -31.026 9.039 1.00 71.24 H new ATOM 0 HG21 VAL A 823 1.208 -28.208 8.203 1.00 41.12 H new ATOM 0 HG22 VAL A 823 2.827 -28.498 8.882 1.00 41.12 H new ATOM 0 HG23 VAL A 823 2.655 -27.690 7.306 1.00 41.12 H new ATOM 513 N ARG A 824 4.683 -32.285 7.639 1.00 20.53 N ATOM 514 CA ARG A 824 4.951 -33.713 7.590 1.00 52.21 C ATOM 515 C ARG A 824 4.816 -34.327 8.985 1.00 54.22 C ATOM 516 O ARG A 824 5.327 -33.779 9.960 1.00 30.12 O ATOM 517 CB ARG A 824 6.356 -33.991 7.052 1.00 74.34 C ATOM 518 CG ARG A 824 6.577 -33.291 5.709 1.00 22.14 C ATOM 519 CD ARG A 824 6.140 -34.184 4.546 1.00 21.24 C ATOM 520 NE ARG A 824 6.625 -33.622 3.266 1.00 4.13 N ATOM 521 CZ ARG A 824 7.835 -33.892 2.731 1.00 2.24 C ATOM 522 NH1 ARG A 824 8.694 -34.720 3.363 1.00 42.11 N ATOM 523 NH2 ARG A 824 8.166 -33.334 1.582 1.00 55.33 N ATOM 0 H ARG A 824 5.122 -31.795 8.419 1.00 20.53 H new ATOM 0 HA ARG A 824 4.221 -34.165 6.919 1.00 52.21 H new ATOM 0 HB2 ARG A 824 7.099 -33.648 7.772 1.00 74.34 H new ATOM 0 HB3 ARG A 824 6.498 -35.065 6.934 1.00 74.34 H new ATOM 0 HG2 ARG A 824 6.016 -32.357 5.685 1.00 22.14 H new ATOM 0 HG3 ARG A 824 7.630 -33.033 5.598 1.00 22.14 H new ATOM 0 HD2 ARG A 824 6.533 -35.191 4.683 1.00 21.24 H new ATOM 0 HD3 ARG A 824 5.053 -34.266 4.528 1.00 21.24 H new ATOM 0 HE ARG A 824 6.007 -32.991 2.756 1.00 4.13 H new ATOM 0 HH11 ARG A 824 8.431 -35.147 4.251 1.00 42.11 H new ATOM 0 HH12 ARG A 824 9.606 -34.919 2.952 1.00 42.11 H new ATOM 0 HH21 ARG A 824 7.512 -32.709 1.111 1.00 55.33 H new ATOM 0 HH22 ARG A 824 9.076 -33.528 1.165 1.00 55.33 H new ATOM 536 N VAL A 825 4.124 -35.456 9.035 1.00 42.10 N ATOM 537 CA VAL A 825 3.915 -36.150 10.294 1.00 23.22 C ATOM 538 C VAL A 825 4.746 -37.435 10.307 1.00 4.33 C ATOM 539 O VAL A 825 4.826 -38.137 9.301 1.00 43.14 O ATOM 540 CB VAL A 825 2.422 -36.402 10.511 1.00 31.24 C ATOM 541 CG1 VAL A 825 1.745 -35.181 11.136 1.00 50.40 C ATOM 542 CG2 VAL A 825 1.737 -36.799 9.202 1.00 31.32 C ATOM 0 H VAL A 825 3.701 -35.907 8.224 1.00 42.10 H new ATOM 0 HA VAL A 825 4.252 -35.536 11.129 1.00 23.22 H new ATOM 0 HB VAL A 825 2.321 -37.234 11.208 1.00 31.24 H new ATOM 0 HG11 VAL A 825 0.684 -35.387 11.280 1.00 50.40 H new ATOM 0 HG12 VAL A 825 2.206 -34.963 12.099 1.00 50.40 H new ATOM 0 HG13 VAL A 825 1.862 -34.322 10.475 1.00 50.40 H new ATOM 0 HG21 VAL A 825 0.676 -36.972 9.384 1.00 31.32 H new ATOM 0 HG22 VAL A 825 1.853 -35.997 8.473 1.00 31.32 H new ATOM 0 HG23 VAL A 825 2.192 -37.711 8.815 1.00 31.32 H new ATOM 552 N ILE A 826 5.344 -37.703 11.459 1.00 63.12 N ATOM 553 CA ILE A 826 6.166 -38.891 11.616 1.00 4.23 C ATOM 554 C ILE A 826 5.272 -40.083 11.961 1.00 74.14 C ATOM 555 O ILE A 826 5.119 -40.432 13.130 1.00 22.12 O ATOM 556 CB ILE A 826 7.278 -38.641 12.637 1.00 23.23 C ATOM 557 CG1 ILE A 826 8.358 -37.724 12.059 1.00 13.22 C ATOM 558 CG2 ILE A 826 7.861 -39.961 13.147 1.00 33.02 C ATOM 559 CD1 ILE A 826 8.805 -36.685 13.090 1.00 35.43 C ATOM 0 H ILE A 826 5.276 -37.118 12.292 1.00 63.12 H new ATOM 0 HA ILE A 826 6.671 -39.131 10.680 1.00 4.23 H new ATOM 0 HB ILE A 826 6.844 -38.127 13.495 1.00 23.23 H new ATOM 0 HG12 ILE A 826 9.214 -38.319 11.743 1.00 13.22 H new ATOM 0 HG13 ILE A 826 7.975 -37.220 11.172 1.00 13.22 H new ATOM 0 HG21 ILE A 826 8.649 -39.755 13.871 1.00 33.02 H new ATOM 0 HG22 ILE A 826 7.074 -40.546 13.623 1.00 33.02 H new ATOM 0 HG23 ILE A 826 8.275 -40.523 12.310 1.00 33.02 H new ATOM 0 HD11 ILE A 826 9.573 -36.046 12.654 1.00 35.43 H new ATOM 0 HD12 ILE A 826 7.951 -36.075 13.386 1.00 35.43 H new ATOM 0 HD13 ILE A 826 9.210 -37.192 13.966 1.00 35.43 H new ATOM 571 N GLU A 827 4.703 -40.675 10.921 1.00 63.44 N ATOM 572 CA GLU A 827 3.828 -41.821 11.098 1.00 34.32 C ATOM 573 C GLU A 827 2.516 -41.390 11.758 1.00 24.13 C ATOM 574 O GLU A 827 1.971 -42.111 12.593 1.00 42.31 O ATOM 575 CB GLU A 827 4.517 -42.917 11.913 1.00 23.12 C ATOM 576 CG GLU A 827 5.895 -43.246 11.335 1.00 40.13 C ATOM 577 CD GLU A 827 5.845 -43.321 9.807 1.00 14.23 C ATOM 578 OE1 GLU A 827 6.383 -42.436 9.125 1.00 31.32 O ATOM 579 OE2 GLU A 827 5.219 -44.344 9.332 1.00 64.20 O ATOM 0 H GLU A 827 4.831 -40.382 9.952 1.00 63.44 H new ATOM 0 HA GLU A 827 3.600 -42.234 10.115 1.00 34.32 H new ATOM 0 HB2 GLU A 827 4.621 -42.594 12.949 1.00 23.12 H new ATOM 0 HB3 GLU A 827 3.898 -43.814 11.919 1.00 23.12 H new ATOM 0 HG2 GLU A 827 6.613 -42.486 11.642 1.00 40.13 H new ATOM 0 HG3 GLU A 827 6.245 -44.196 11.738 1.00 40.13 H new ATOM 587 N GLU A 828 2.048 -40.217 11.359 1.00 1.45 N ATOM 588 CA GLU A 828 0.811 -39.681 11.902 1.00 41.01 C ATOM 589 C GLU A 828 0.804 -39.801 13.427 1.00 23.32 C ATOM 590 O GLU A 828 -0.236 -40.064 14.028 1.00 73.31 O ATOM 591 CB GLU A 828 -0.404 -40.382 11.291 1.00 11.42 C ATOM 592 CG GLU A 828 -0.865 -39.670 10.018 1.00 41.33 C ATOM 593 CD GLU A 828 -2.326 -39.997 9.705 1.00 74.12 C ATOM 594 OE1 GLU A 828 -3.198 -39.124 9.830 1.00 1.14 O ATOM 595 OE2 GLU A 828 -2.543 -41.208 9.317 1.00 30.35 O ATOM 0 H GLU A 828 2.503 -39.622 10.666 1.00 1.45 H new ATOM 0 HA GLU A 828 0.750 -38.625 11.641 1.00 41.01 H new ATOM 0 HB2 GLU A 828 -0.154 -41.418 11.062 1.00 11.42 H new ATOM 0 HB3 GLU A 828 -1.218 -40.403 12.015 1.00 11.42 H new ATOM 0 HG2 GLU A 828 -0.747 -38.593 10.137 1.00 41.33 H new ATOM 0 HG3 GLU A 828 -0.234 -39.969 9.181 1.00 41.33 H new ATOM 603 N CYS A 829 1.978 -39.603 14.010 1.00 74.22 N ATOM 604 CA CYS A 829 2.120 -39.686 15.453 1.00 31.25 C ATOM 605 C CYS A 829 2.485 -38.297 15.981 1.00 74.21 C ATOM 606 O CYS A 829 2.006 -37.885 17.036 1.00 13.50 O ATOM 607 CB CYS A 829 3.151 -40.740 15.860 1.00 25.34 C ATOM 608 SG CYS A 829 3.036 -41.068 17.657 1.00 3.42 S ATOM 0 H CYS A 829 2.839 -39.385 13.508 1.00 74.22 H new ATOM 0 HA CYS A 829 1.177 -40.005 15.896 1.00 31.25 H new ATOM 0 HB2 CYS A 829 2.981 -41.661 15.302 1.00 25.34 H new ATOM 0 HB3 CYS A 829 4.154 -40.395 15.608 1.00 25.34 H new ATOM 0 HG CYS A 829 3.915 -41.966 17.991 1.00 3.42 H new ATOM 614 N HIS A 830 3.329 -37.614 15.222 1.00 23.24 N ATOM 615 CA HIS A 830 3.764 -36.280 15.600 1.00 32.13 C ATOM 616 C HIS A 830 3.757 -35.371 14.370 1.00 42.40 C ATOM 617 O HIS A 830 4.193 -35.774 13.293 1.00 44.21 O ATOM 618 CB HIS A 830 5.126 -36.329 16.294 1.00 4.24 C ATOM 619 CG HIS A 830 5.970 -35.095 16.078 1.00 21.14 C ATOM 620 ND1 HIS A 830 7.328 -35.152 15.815 1.00 14.14 N ATOM 621 CD2 HIS A 830 5.635 -33.773 16.088 1.00 34.11 C ATOM 622 CE1 HIS A 830 7.779 -33.914 15.676 1.00 72.00 C ATOM 623 NE2 HIS A 830 6.728 -33.061 15.846 1.00 41.11 N ATOM 0 H HIS A 830 3.723 -37.959 14.347 1.00 23.24 H new ATOM 0 HA HIS A 830 3.068 -35.858 16.325 1.00 32.13 H new ATOM 0 HB2 HIS A 830 4.972 -36.469 17.364 1.00 4.24 H new ATOM 0 HB3 HIS A 830 5.675 -37.199 15.934 1.00 4.24 H new ATOM 0 HD1 HIS A 830 7.886 -36.002 15.741 1.00 14.14 H new ATOM 0 HD2 HIS A 830 4.647 -33.373 16.263 1.00 34.11 H new ATOM 0 HE1 HIS A 830 8.799 -33.630 15.465 1.00 72.00 H new ATOM 631 N TYR A 831 3.258 -34.160 14.571 1.00 35.24 N ATOM 632 CA TYR A 831 3.188 -33.190 13.492 1.00 43.10 C ATOM 633 C TYR A 831 4.437 -32.306 13.468 1.00 21.12 C ATOM 634 O TYR A 831 4.893 -31.841 14.512 1.00 71.32 O ATOM 635 CB TYR A 831 1.966 -32.318 13.787 1.00 44.33 C ATOM 636 CG TYR A 831 0.639 -32.935 13.341 1.00 3.11 C ATOM 637 CD1 TYR A 831 0.282 -32.914 12.008 1.00 33.31 C ATOM 638 CD2 TYR A 831 -0.200 -33.512 14.272 1.00 74.22 C ATOM 639 CE1 TYR A 831 -0.967 -33.495 11.589 1.00 74.14 C ATOM 640 CE2 TYR A 831 -1.449 -34.093 13.852 1.00 34.13 C ATOM 641 CZ TYR A 831 -1.771 -34.056 12.531 1.00 13.14 C ATOM 642 OH TYR A 831 -2.951 -34.605 12.135 1.00 1.52 O ATOM 0 H TYR A 831 2.898 -33.829 15.466 1.00 35.24 H new ATOM 0 HA TYR A 831 3.119 -33.693 12.527 1.00 43.10 H new ATOM 0 HB2 TYR A 831 1.922 -32.123 14.858 1.00 44.33 H new ATOM 0 HB3 TYR A 831 2.092 -31.355 13.292 1.00 44.33 H new ATOM 0 HD1 TYR A 831 0.939 -32.462 11.280 1.00 33.31 H new ATOM 0 HD2 TYR A 831 0.080 -33.528 15.315 1.00 74.22 H new ATOM 0 HE1 TYR A 831 -1.259 -33.485 10.549 1.00 74.14 H new ATOM 0 HE2 TYR A 831 -2.115 -34.548 14.570 1.00 34.13 H new ATOM 0 HH TYR A 831 -3.692 -34.149 12.586 1.00 1.52 H new ATOM 652 N THR A 832 4.955 -32.101 12.266 1.00 11.20 N ATOM 653 CA THR A 832 6.142 -31.281 12.093 1.00 60.14 C ATOM 654 C THR A 832 6.055 -30.486 10.788 1.00 0.14 C ATOM 655 O THR A 832 5.268 -30.820 9.904 1.00 32.45 O ATOM 656 CB THR A 832 7.365 -32.198 12.165 1.00 75.24 C ATOM 657 OG1 THR A 832 7.205 -32.892 13.399 1.00 64.52 O ATOM 658 CG2 THR A 832 8.670 -31.421 12.340 1.00 4.53 C ATOM 0 H THR A 832 4.575 -32.488 11.403 1.00 11.20 H new ATOM 0 HA THR A 832 6.228 -30.537 12.885 1.00 60.14 H new ATOM 0 HB THR A 832 7.421 -32.800 11.258 1.00 75.24 H new ATOM 0 HG1 THR A 832 6.961 -32.256 14.103 1.00 64.52 H new ATOM 0 HG21 THR A 832 9.506 -32.119 12.385 1.00 4.53 H new ATOM 0 HG22 THR A 832 8.807 -30.745 11.496 1.00 4.53 H new ATOM 0 HG23 THR A 832 8.629 -30.844 13.264 1.00 4.53 H new ATOM 666 N VAL A 833 6.875 -29.448 10.710 1.00 71.13 N ATOM 667 CA VAL A 833 6.901 -28.602 9.528 1.00 34.54 C ATOM 668 C VAL A 833 8.353 -28.329 9.134 1.00 63.13 C ATOM 669 O VAL A 833 9.200 -28.091 9.994 1.00 54.32 O ATOM 670 CB VAL A 833 6.099 -27.324 9.782 1.00 23.05 C ATOM 671 CG1 VAL A 833 6.165 -26.387 8.575 1.00 2.31 C ATOM 672 CG2 VAL A 833 4.649 -27.649 10.146 1.00 21.00 C ATOM 0 H VAL A 833 7.526 -29.173 11.446 1.00 71.13 H new ATOM 0 HA VAL A 833 6.426 -29.106 8.686 1.00 34.54 H new ATOM 0 HB VAL A 833 6.549 -26.809 10.631 1.00 23.05 H new ATOM 0 HG11 VAL A 833 5.587 -25.486 8.782 1.00 2.31 H new ATOM 0 HG12 VAL A 833 7.203 -26.116 8.381 1.00 2.31 H new ATOM 0 HG13 VAL A 833 5.752 -26.890 7.701 1.00 2.31 H new ATOM 0 HG21 VAL A 833 4.102 -26.723 10.321 1.00 21.00 H new ATOM 0 HG22 VAL A 833 4.182 -28.197 9.327 1.00 21.00 H new ATOM 0 HG23 VAL A 833 4.629 -28.259 11.049 1.00 21.00 H new ATOM 682 N LEU A 834 8.598 -28.373 7.832 1.00 15.42 N ATOM 683 CA LEU A 834 9.933 -28.133 7.313 1.00 43.40 C ATOM 684 C LEU A 834 9.947 -26.810 6.545 1.00 51.53 C ATOM 685 O LEU A 834 8.897 -26.214 6.309 1.00 50.32 O ATOM 686 CB LEU A 834 10.410 -29.329 6.486 1.00 12.35 C ATOM 687 CG LEU A 834 10.224 -30.705 7.129 1.00 54.21 C ATOM 688 CD1 LEU A 834 8.886 -31.324 6.720 1.00 33.12 C ATOM 689 CD2 LEU A 834 11.403 -31.624 6.807 1.00 62.42 C ATOM 0 H LEU A 834 7.894 -28.571 7.121 1.00 15.42 H new ATOM 0 HA LEU A 834 10.647 -28.035 8.131 1.00 43.40 H new ATOM 0 HB2 LEU A 834 9.881 -29.321 5.533 1.00 12.35 H new ATOM 0 HB3 LEU A 834 11.469 -29.193 6.264 1.00 12.35 H new ATOM 0 HG LEU A 834 10.202 -30.577 8.211 1.00 54.21 H new ATOM 0 HD11 LEU A 834 8.778 -32.301 7.190 1.00 33.12 H new ATOM 0 HD12 LEU A 834 8.071 -30.675 7.041 1.00 33.12 H new ATOM 0 HD13 LEU A 834 8.854 -31.437 5.636 1.00 33.12 H new ATOM 0 HD21 LEU A 834 11.246 -32.595 7.276 1.00 62.42 H new ATOM 0 HD22 LEU A 834 11.481 -31.751 5.727 1.00 62.42 H new ATOM 0 HD23 LEU A 834 12.324 -31.182 7.188 1.00 62.42 H new ATOM 701 N GLY A 835 11.148 -26.389 6.176 1.00 52.25 N ATOM 702 CA GLY A 835 11.312 -25.147 5.439 1.00 70.23 C ATOM 703 C GLY A 835 12.019 -24.092 6.292 1.00 33.34 C ATOM 704 O GLY A 835 11.477 -23.638 7.299 1.00 32.40 O ATOM 0 H GLY A 835 12.017 -26.886 6.374 1.00 52.25 H new ATOM 0 HA2 GLY A 835 11.888 -25.332 4.532 1.00 70.23 H new ATOM 0 HA3 GLY A 835 10.337 -24.774 5.127 1.00 70.23 H new ATOM 708 N ASP A 836 13.218 -23.733 5.859 1.00 50.11 N ATOM 709 CA ASP A 836 14.004 -22.740 6.571 1.00 44.11 C ATOM 710 C ASP A 836 13.161 -21.480 6.777 1.00 45.24 C ATOM 711 O ASP A 836 13.361 -20.746 7.744 1.00 73.42 O ATOM 712 CB ASP A 836 15.251 -22.350 5.774 1.00 11.01 C ATOM 713 CG ASP A 836 16.447 -21.909 6.620 1.00 64.42 C ATOM 714 OD1 ASP A 836 16.823 -20.728 6.629 1.00 54.42 O ATOM 715 OD2 ASP A 836 17.010 -22.850 7.300 1.00 64.24 O ATOM 0 H ASP A 836 13.665 -24.112 5.024 1.00 50.11 H new ATOM 0 HA ASP A 836 14.306 -23.170 7.526 1.00 44.11 H new ATOM 0 HB2 ASP A 836 15.552 -23.199 5.161 1.00 11.01 H new ATOM 0 HB3 ASP A 836 14.990 -21.541 5.092 1.00 11.01 H new ATOM 721 N ALA A 837 12.238 -21.267 5.851 1.00 15.12 N ATOM 722 CA ALA A 837 11.363 -20.108 5.919 1.00 64.11 C ATOM 723 C ALA A 837 10.738 -20.027 7.313 1.00 72.42 C ATOM 724 O ALA A 837 10.628 -18.945 7.886 1.00 4.22 O ATOM 725 CB ALA A 837 10.311 -20.197 4.812 1.00 42.23 C ATOM 0 H ALA A 837 12.077 -21.877 5.050 1.00 15.12 H new ATOM 0 HA ALA A 837 11.928 -19.190 5.758 1.00 64.11 H new ATOM 0 HB1 ALA A 837 9.655 -19.328 4.863 1.00 42.23 H new ATOM 0 HB2 ALA A 837 10.806 -20.222 3.841 1.00 42.23 H new ATOM 0 HB3 ALA A 837 9.722 -21.105 4.942 1.00 42.23 H new ATOM 731 N PHE A 838 10.343 -21.187 7.818 1.00 65.25 N ATOM 732 CA PHE A 838 9.732 -21.261 9.133 1.00 34.54 C ATOM 733 C PHE A 838 10.795 -21.267 10.233 1.00 23.12 C ATOM 734 O PHE A 838 10.507 -20.935 11.382 1.00 43.31 O ATOM 735 CB PHE A 838 8.950 -22.575 9.190 1.00 70.44 C ATOM 736 CG PHE A 838 8.711 -23.097 10.608 1.00 15.21 C ATOM 737 CD1 PHE A 838 9.735 -23.648 11.312 1.00 65.00 C ATOM 738 CD2 PHE A 838 7.473 -23.009 11.165 1.00 71.10 C ATOM 739 CE1 PHE A 838 9.513 -24.132 12.628 1.00 3.13 C ATOM 740 CE2 PHE A 838 7.251 -23.493 12.481 1.00 33.03 C ATOM 741 CZ PHE A 838 8.276 -24.044 13.185 1.00 34.32 C ATOM 0 H PHE A 838 10.435 -22.083 7.339 1.00 65.25 H new ATOM 0 HA PHE A 838 9.088 -20.396 9.292 1.00 34.54 H new ATOM 0 HB2 PHE A 838 7.987 -22.434 8.699 1.00 70.44 H new ATOM 0 HB3 PHE A 838 9.490 -23.332 8.622 1.00 70.44 H new ATOM 0 HD1 PHE A 838 10.718 -23.718 10.870 1.00 65.00 H new ATOM 0 HD2 PHE A 838 6.659 -22.571 10.606 1.00 71.10 H new ATOM 0 HE1 PHE A 838 10.327 -24.570 13.187 1.00 3.13 H new ATOM 0 HE2 PHE A 838 6.268 -23.424 12.923 1.00 33.03 H new ATOM 0 HZ PHE A 838 8.107 -24.412 14.186 1.00 34.32 H new ATOM 751 N LYS A 839 12.003 -21.648 9.843 1.00 74.24 N ATOM 752 CA LYS A 839 13.111 -21.701 10.781 1.00 73.50 C ATOM 753 C LYS A 839 13.410 -20.290 11.290 1.00 24.22 C ATOM 754 O LYS A 839 13.660 -20.095 12.479 1.00 71.22 O ATOM 755 CB LYS A 839 14.318 -22.395 10.146 1.00 35.41 C ATOM 756 CG LYS A 839 14.070 -23.898 9.997 1.00 23.02 C ATOM 757 CD LYS A 839 15.388 -24.656 9.828 1.00 63.33 C ATOM 758 CE LYS A 839 15.181 -25.945 9.029 1.00 13.22 C ATOM 759 NZ LYS A 839 14.278 -26.865 9.756 1.00 72.12 N ATOM 0 H LYS A 839 12.238 -21.923 8.889 1.00 74.24 H new ATOM 0 HA LYS A 839 12.847 -22.304 11.650 1.00 73.50 H new ATOM 0 HB2 LYS A 839 14.521 -21.958 9.168 1.00 35.41 H new ATOM 0 HB3 LYS A 839 15.203 -22.228 10.760 1.00 35.41 H new ATOM 0 HG2 LYS A 839 13.541 -24.272 10.874 1.00 23.02 H new ATOM 0 HG3 LYS A 839 13.428 -24.081 9.135 1.00 23.02 H new ATOM 0 HD2 LYS A 839 16.114 -24.021 9.320 1.00 63.33 H new ATOM 0 HD3 LYS A 839 15.803 -24.894 10.807 1.00 63.33 H new ATOM 0 HE2 LYS A 839 14.761 -25.710 8.051 1.00 13.22 H new ATOM 0 HE3 LYS A 839 16.141 -26.430 8.855 1.00 13.22 H new ATOM 0 HZ1 LYS A 839 14.228 -27.773 9.252 1.00 72.12 H new ATOM 0 HZ2 LYS A 839 14.643 -27.022 10.717 1.00 72.12 H new ATOM 0 HZ3 LYS A 839 13.327 -26.447 9.811 1.00 72.12 H new ATOM 772 N GLU A 840 13.376 -19.342 10.365 1.00 31.23 N ATOM 773 CA GLU A 840 13.641 -17.955 10.706 1.00 52.43 C ATOM 774 C GLU A 840 12.375 -17.291 11.252 1.00 72.04 C ATOM 775 O GLU A 840 12.420 -16.159 11.732 1.00 65.44 O ATOM 776 CB GLU A 840 14.185 -17.188 9.498 1.00 34.14 C ATOM 777 CG GLU A 840 13.301 -17.405 8.268 1.00 2.31 C ATOM 778 CD GLU A 840 13.446 -16.247 7.278 1.00 10.25 C ATOM 779 OE1 GLU A 840 14.463 -15.538 7.298 1.00 64.20 O ATOM 780 OE2 GLU A 840 12.454 -16.096 6.467 1.00 4.33 O ATOM 0 H GLU A 840 13.169 -19.507 9.380 1.00 31.23 H new ATOM 0 HA GLU A 840 14.404 -17.932 11.484 1.00 52.43 H new ATOM 0 HB2 GLU A 840 14.236 -16.124 9.731 1.00 34.14 H new ATOM 0 HB3 GLU A 840 15.202 -17.516 9.282 1.00 34.14 H new ATOM 0 HG2 GLU A 840 13.573 -18.341 7.781 1.00 2.31 H new ATOM 0 HG3 GLU A 840 12.259 -17.497 8.576 1.00 2.31 H new ATOM 788 N CYS A 841 11.275 -18.023 11.160 1.00 74.42 N ATOM 789 CA CYS A 841 9.998 -17.520 11.639 1.00 63.05 C ATOM 790 C CYS A 841 9.957 -17.684 13.159 1.00 21.11 C ATOM 791 O CYS A 841 9.218 -16.978 13.843 1.00 33.23 O ATOM 792 CB CYS A 841 8.822 -18.221 10.957 1.00 71.53 C ATOM 793 SG CYS A 841 8.607 -17.575 9.258 1.00 24.40 S ATOM 0 H CYS A 841 11.241 -18.961 10.761 1.00 74.42 H new ATOM 0 HA CYS A 841 9.902 -16.464 11.386 1.00 63.05 H new ATOM 0 HB2 CYS A 841 8.997 -19.296 10.926 1.00 71.53 H new ATOM 0 HB3 CYS A 841 7.910 -18.063 11.533 1.00 71.53 H new ATOM 0 HG CYS A 841 9.599 -17.968 8.516 1.00 24.40 H new ATOM 799 N PHE A 842 10.761 -18.620 13.643 1.00 15.44 N ATOM 800 CA PHE A 842 10.825 -18.885 15.070 1.00 21.35 C ATOM 801 C PHE A 842 12.235 -18.640 15.611 1.00 65.03 C ATOM 802 O PHE A 842 13.087 -18.095 14.909 1.00 35.05 O ATOM 803 CB PHE A 842 10.465 -20.359 15.268 1.00 65.23 C ATOM 804 CG PHE A 842 11.675 -21.296 15.296 1.00 33.32 C ATOM 805 CD1 PHE A 842 12.266 -21.679 14.133 1.00 44.52 C ATOM 806 CD2 PHE A 842 12.158 -21.747 16.485 1.00 73.21 C ATOM 807 CE1 PHE A 842 13.388 -22.548 14.159 1.00 25.23 C ATOM 808 CE2 PHE A 842 13.280 -22.617 16.511 1.00 11.03 C ATOM 809 CZ PHE A 842 13.872 -22.999 15.348 1.00 74.11 C ATOM 0 H PHE A 842 11.373 -19.204 13.073 1.00 15.44 H new ATOM 0 HA PHE A 842 10.141 -18.224 15.602 1.00 21.35 H new ATOM 0 HB2 PHE A 842 9.914 -20.466 16.202 1.00 65.23 H new ATOM 0 HB3 PHE A 842 9.796 -20.670 14.466 1.00 65.23 H new ATOM 0 HD1 PHE A 842 11.882 -21.322 13.189 1.00 44.52 H new ATOM 0 HD2 PHE A 842 11.688 -21.443 17.409 1.00 73.21 H new ATOM 0 HE1 PHE A 842 13.858 -22.851 13.235 1.00 25.23 H new ATOM 0 HE2 PHE A 842 13.663 -22.975 17.455 1.00 11.03 H new ATOM 0 HZ PHE A 842 14.726 -23.660 15.368 1.00 74.11 H new ATOM 819 N VAL A 843 12.439 -19.054 16.853 1.00 63.35 N ATOM 820 CA VAL A 843 13.732 -18.886 17.495 1.00 71.42 C ATOM 821 C VAL A 843 13.951 -20.023 18.495 1.00 12.04 C ATOM 822 O VAL A 843 12.992 -20.566 19.043 1.00 5.32 O ATOM 823 CB VAL A 843 13.821 -17.500 18.136 1.00 65.01 C ATOM 824 CG1 VAL A 843 13.350 -16.416 17.165 1.00 11.41 C ATOM 825 CG2 VAL A 843 13.029 -17.448 19.443 1.00 35.33 C ATOM 0 H VAL A 843 11.731 -19.505 17.432 1.00 63.35 H new ATOM 0 HA VAL A 843 14.534 -18.941 16.759 1.00 71.42 H new ATOM 0 HB VAL A 843 14.867 -17.307 18.372 1.00 65.01 H new ATOM 0 HG11 VAL A 843 13.423 -15.440 17.645 1.00 11.41 H new ATOM 0 HG12 VAL A 843 13.976 -16.429 16.273 1.00 11.41 H new ATOM 0 HG13 VAL A 843 12.314 -16.605 16.884 1.00 11.41 H new ATOM 0 HG21 VAL A 843 13.109 -16.452 19.878 1.00 35.33 H new ATOM 0 HG22 VAL A 843 11.981 -17.673 19.243 1.00 35.33 H new ATOM 0 HG23 VAL A 843 13.431 -18.182 20.141 1.00 35.33 H new ATOM 835 N SER A 844 15.218 -20.350 18.703 1.00 12.54 N ATOM 836 CA SER A 844 15.575 -21.412 19.628 1.00 12.34 C ATOM 837 C SER A 844 16.155 -20.815 20.912 1.00 42.30 C ATOM 838 O SER A 844 16.992 -19.915 20.859 1.00 10.42 O ATOM 839 CB SER A 844 16.574 -22.381 18.995 1.00 65.14 C ATOM 840 OG SER A 844 17.923 -22.027 19.291 1.00 73.02 O ATOM 0 H SER A 844 16.010 -19.898 18.247 1.00 12.54 H new ATOM 0 HA SER A 844 14.672 -21.972 19.871 1.00 12.34 H new ATOM 0 HB2 SER A 844 16.377 -23.391 19.355 1.00 65.14 H new ATOM 0 HB3 SER A 844 16.431 -22.394 17.914 1.00 65.14 H new ATOM 0 HG SER A 844 18.530 -22.671 18.870 1.00 73.02 H new ATOM 846 N ARG A 845 15.688 -21.340 22.035 1.00 51.11 N ATOM 847 CA ARG A 845 16.150 -20.870 23.330 1.00 61.10 C ATOM 848 C ARG A 845 17.070 -21.909 23.974 1.00 34.44 C ATOM 849 O ARG A 845 16.929 -23.106 23.727 1.00 23.10 O ATOM 850 CB ARG A 845 14.973 -20.590 24.266 1.00 20.24 C ATOM 851 CG ARG A 845 13.890 -19.776 23.557 1.00 54.51 C ATOM 852 CD ARG A 845 14.498 -18.585 22.813 1.00 12.44 C ATOM 853 NE ARG A 845 15.072 -17.623 23.781 1.00 33.23 N ATOM 854 CZ ARG A 845 15.640 -16.449 23.435 1.00 44.11 C ATOM 855 NH1 ARG A 845 15.716 -16.080 22.138 1.00 22.34 N ATOM 856 NH2 ARG A 845 16.121 -15.666 24.383 1.00 25.50 N ATOM 0 H ARG A 845 14.994 -22.087 22.075 1.00 51.11 H new ATOM 0 HA ARG A 845 16.700 -19.943 23.170 1.00 61.10 H new ATOM 0 HB2 ARG A 845 14.553 -21.532 24.619 1.00 20.24 H new ATOM 0 HB3 ARG A 845 15.323 -20.048 25.145 1.00 20.24 H new ATOM 0 HG2 ARG A 845 13.353 -20.413 22.854 1.00 54.51 H new ATOM 0 HG3 ARG A 845 13.161 -19.421 24.286 1.00 54.51 H new ATOM 0 HD2 ARG A 845 15.272 -18.930 22.128 1.00 12.44 H new ATOM 0 HD3 ARG A 845 13.734 -18.094 22.209 1.00 12.44 H new ATOM 0 HE ARG A 845 15.036 -17.863 24.772 1.00 33.23 H new ATOM 0 HH11 ARG A 845 15.342 -16.691 21.411 1.00 22.34 H new ATOM 0 HH12 ARG A 845 16.147 -15.191 21.885 1.00 22.34 H new ATOM 0 HH21 ARG A 845 16.060 -15.952 25.360 1.00 25.50 H new ATOM 0 HH22 ARG A 845 16.554 -14.775 24.138 1.00 25.50 H new ATOM 869 N PRO A 846 18.015 -21.401 24.810 1.00 73.30 N ATOM 870 CA PRO A 846 18.957 -22.272 25.492 1.00 61.13 C ATOM 871 C PRO A 846 18.282 -23.012 26.649 1.00 42.33 C ATOM 872 O PRO A 846 17.056 -23.095 26.706 1.00 3.31 O ATOM 873 CB PRO A 846 20.081 -21.356 25.947 1.00 12.34 C ATOM 874 CG PRO A 846 19.509 -19.947 25.915 1.00 23.51 C ATOM 875 CD PRO A 846 18.211 -19.990 25.127 1.00 55.43 C ATOM 0 HA PRO A 846 19.342 -23.062 24.847 1.00 61.13 H new ATOM 0 HB2 PRO A 846 20.417 -21.618 26.950 1.00 12.34 H new ATOM 0 HB3 PRO A 846 20.946 -21.442 25.289 1.00 12.34 H new ATOM 0 HG2 PRO A 846 19.329 -19.585 26.927 1.00 23.51 H new ATOM 0 HG3 PRO A 846 20.215 -19.259 25.451 1.00 23.51 H new ATOM 0 HD2 PRO A 846 17.380 -19.597 25.712 1.00 55.43 H new ATOM 0 HD3 PRO A 846 18.277 -19.387 24.222 1.00 55.43 H new ATOM 1029 N PHE A 856 7.913 -37.374 24.654 1.00 55.21 N ATOM 1030 CA PHE A 856 9.074 -36.847 23.957 1.00 55.11 C ATOM 1031 C PHE A 856 9.987 -36.080 24.915 1.00 21.13 C ATOM 1032 O PHE A 856 9.639 -35.870 26.076 1.00 32.42 O ATOM 1033 CB PHE A 856 8.554 -35.885 22.887 1.00 42.32 C ATOM 1034 CG PHE A 856 8.213 -36.559 21.556 1.00 20.14 C ATOM 1035 CD1 PHE A 856 8.069 -37.910 21.496 1.00 30.01 C ATOM 1036 CD2 PHE A 856 8.054 -35.807 20.434 1.00 32.42 C ATOM 1037 CE1 PHE A 856 7.752 -38.536 20.261 1.00 2.14 C ATOM 1038 CE2 PHE A 856 7.737 -36.433 19.200 1.00 61.24 C ATOM 1039 CZ PHE A 856 7.593 -37.784 19.139 1.00 30.22 C ATOM 0 HA PHE A 856 9.651 -37.664 23.524 1.00 55.11 H new ATOM 0 HB2 PHE A 856 7.664 -35.383 23.266 1.00 42.32 H new ATOM 0 HB3 PHE A 856 9.304 -35.114 22.710 1.00 42.32 H new ATOM 0 HD1 PHE A 856 8.196 -38.507 22.387 1.00 30.01 H new ATOM 0 HD2 PHE A 856 8.169 -34.734 20.482 1.00 32.42 H new ATOM 0 HE1 PHE A 856 7.637 -39.609 20.213 1.00 2.14 H new ATOM 0 HE2 PHE A 856 7.610 -35.836 18.309 1.00 61.24 H new ATOM 0 HZ PHE A 856 7.352 -38.260 18.200 1.00 30.22 H new ATOM 1049 N GLU A 857 11.138 -35.683 24.394 1.00 43.52 N ATOM 1050 CA GLU A 857 12.104 -34.944 25.189 1.00 45.54 C ATOM 1051 C GLU A 857 12.457 -33.622 24.502 1.00 33.23 C ATOM 1052 O GLU A 857 12.920 -33.615 23.363 1.00 52.42 O ATOM 1053 CB GLU A 857 13.360 -35.780 25.444 1.00 74.55 C ATOM 1054 CG GLU A 857 12.995 -37.170 25.971 1.00 55.33 C ATOM 1055 CD GLU A 857 13.413 -37.328 27.434 1.00 70.32 C ATOM 1056 OE1 GLU A 857 14.237 -38.199 27.752 1.00 14.12 O ATOM 1057 OE2 GLU A 857 12.851 -36.506 28.254 1.00 71.22 O ATOM 0 H GLU A 857 11.424 -35.859 23.431 1.00 43.52 H new ATOM 0 HA GLU A 857 11.653 -34.721 26.156 1.00 45.54 H new ATOM 0 HB2 GLU A 857 13.931 -35.876 24.521 1.00 74.55 H new ATOM 0 HB3 GLU A 857 14.000 -35.271 26.164 1.00 74.55 H new ATOM 0 HG2 GLU A 857 11.921 -37.328 25.877 1.00 55.33 H new ATOM 0 HG3 GLU A 857 13.484 -37.933 25.365 1.00 55.33 H new ATOM 1065 N LYS A 858 12.224 -32.536 25.225 1.00 73.41 N ATOM 1066 CA LYS A 858 12.511 -31.212 24.700 1.00 75.22 C ATOM 1067 C LYS A 858 13.868 -30.743 25.226 1.00 3.22 C ATOM 1068 O LYS A 858 13.964 -30.238 26.344 1.00 50.34 O ATOM 1069 CB LYS A 858 11.363 -30.251 25.015 1.00 51.31 C ATOM 1070 CG LYS A 858 10.021 -30.985 25.032 1.00 70.51 C ATOM 1071 CD LYS A 858 8.891 -30.053 25.473 1.00 71.11 C ATOM 1072 CE LYS A 858 8.971 -29.766 26.973 1.00 2.35 C ATOM 1073 NZ LYS A 858 7.887 -28.846 27.384 1.00 40.43 N ATOM 0 H LYS A 858 11.840 -32.546 26.170 1.00 73.41 H new ATOM 0 HA LYS A 858 12.583 -31.240 23.613 1.00 75.22 H new ATOM 0 HB2 LYS A 858 11.535 -29.778 25.982 1.00 51.31 H new ATOM 0 HB3 LYS A 858 11.336 -29.455 24.271 1.00 51.31 H new ATOM 0 HG2 LYS A 858 9.805 -31.379 24.039 1.00 70.51 H new ATOM 0 HG3 LYS A 858 10.078 -31.838 25.708 1.00 70.51 H new ATOM 0 HD2 LYS A 858 8.948 -29.117 24.917 1.00 71.11 H new ATOM 0 HD3 LYS A 858 7.928 -30.506 25.237 1.00 71.11 H new ATOM 0 HE2 LYS A 858 8.896 -30.699 27.532 1.00 2.35 H new ATOM 0 HE3 LYS A 858 9.939 -29.327 27.214 1.00 2.35 H new ATOM 0 HZ1 LYS A 858 7.872 -28.768 28.421 1.00 40.43 H new ATOM 0 HZ2 LYS A 858 8.053 -27.907 26.969 1.00 40.43 H new ATOM 0 HZ3 LYS A 858 6.973 -29.215 27.051 1.00 40.43 H new ATOM 1086 N ARG A 859 14.884 -30.926 24.396 1.00 24.10 N ATOM 1087 CA ARG A 859 16.233 -30.528 24.764 1.00 54.33 C ATOM 1088 C ARG A 859 16.426 -29.029 24.526 1.00 4.33 C ATOM 1089 O ARG A 859 17.531 -28.510 24.681 1.00 12.21 O ATOM 1090 CB ARG A 859 17.276 -31.304 23.957 1.00 14.22 C ATOM 1091 CG ARG A 859 18.638 -31.275 24.652 1.00 24.31 C ATOM 1092 CD ARG A 859 19.459 -32.518 24.301 1.00 30.12 C ATOM 1093 NE ARG A 859 20.613 -32.638 25.220 1.00 61.53 N ATOM 1094 CZ ARG A 859 21.486 -33.668 25.208 1.00 71.35 C ATOM 1095 NH1 ARG A 859 21.343 -34.678 24.322 1.00 15.54 N ATOM 1096 NH2 ARG A 859 22.482 -33.674 26.074 1.00 14.32 N ATOM 0 H ARG A 859 14.801 -31.345 23.470 1.00 24.10 H new ATOM 0 HA ARG A 859 16.369 -30.753 25.822 1.00 54.33 H new ATOM 0 HB2 ARG A 859 16.950 -32.336 23.831 1.00 14.22 H new ATOM 0 HB3 ARG A 859 17.363 -30.874 22.959 1.00 14.22 H new ATOM 0 HG2 ARG A 859 19.183 -30.379 24.355 1.00 24.31 H new ATOM 0 HG3 ARG A 859 18.498 -31.220 25.732 1.00 24.31 H new ATOM 0 HD2 ARG A 859 18.834 -33.408 24.370 1.00 30.12 H new ATOM 0 HD3 ARG A 859 19.809 -32.454 23.271 1.00 30.12 H new ATOM 0 HE ARG A 859 20.758 -31.896 25.905 1.00 61.53 H new ATOM 0 HH11 ARG A 859 20.571 -34.666 23.655 1.00 15.54 H new ATOM 0 HH12 ARG A 859 22.007 -35.452 24.320 1.00 15.54 H new ATOM 0 HH21 ARG A 859 22.584 -32.908 26.740 1.00 14.32 H new ATOM 0 HH22 ARG A 859 23.150 -34.445 26.078 1.00 14.32 H new ATOM 1109 N ALA A 860 15.336 -28.375 24.154 1.00 33.03 N ATOM 1110 CA ALA A 860 15.372 -26.946 23.894 1.00 12.10 C ATOM 1111 C ALA A 860 13.954 -26.449 23.605 1.00 41.50 C ATOM 1112 O ALA A 860 13.077 -27.234 23.250 1.00 61.43 O ATOM 1113 CB ALA A 860 16.336 -26.661 22.741 1.00 61.12 C ATOM 0 H ALA A 860 14.422 -28.809 24.026 1.00 33.03 H new ATOM 0 HA ALA A 860 15.739 -26.406 24.767 1.00 12.10 H new ATOM 0 HB1 ALA A 860 16.363 -25.589 22.546 1.00 61.12 H new ATOM 0 HB2 ALA A 860 17.335 -27.007 23.008 1.00 61.12 H new ATOM 0 HB3 ALA A 860 15.998 -27.184 21.846 1.00 61.12 H new ATOM 1119 N LYS A 861 13.774 -25.146 23.768 1.00 35.21 N ATOM 1120 CA LYS A 861 12.477 -24.535 23.529 1.00 2.41 C ATOM 1121 C LYS A 861 12.515 -23.770 22.204 1.00 4.25 C ATOM 1122 O LYS A 861 13.590 -23.503 21.669 1.00 51.34 O ATOM 1123 CB LYS A 861 12.062 -23.674 24.724 1.00 22.22 C ATOM 1124 CG LYS A 861 11.775 -24.542 25.951 1.00 30.12 C ATOM 1125 CD LYS A 861 13.073 -24.944 26.654 1.00 20.51 C ATOM 1126 CE LYS A 861 12.820 -25.270 28.128 1.00 44.33 C ATOM 1127 NZ LYS A 861 12.552 -24.032 28.893 1.00 1.40 N ATOM 0 H LYS A 861 14.504 -24.497 24.062 1.00 35.21 H new ATOM 0 HA LYS A 861 11.707 -25.301 23.434 1.00 2.41 H new ATOM 0 HB2 LYS A 861 12.853 -22.961 24.955 1.00 22.22 H new ATOM 0 HB3 LYS A 861 11.175 -23.094 24.469 1.00 22.22 H new ATOM 0 HG2 LYS A 861 11.135 -23.997 26.645 1.00 30.12 H new ATOM 0 HG3 LYS A 861 11.229 -25.436 25.649 1.00 30.12 H new ATOM 0 HD2 LYS A 861 13.507 -25.811 26.156 1.00 20.51 H new ATOM 0 HD3 LYS A 861 13.799 -24.134 26.576 1.00 20.51 H new ATOM 0 HE2 LYS A 861 11.973 -25.950 28.216 1.00 44.33 H new ATOM 0 HE3 LYS A 861 13.685 -25.783 28.547 1.00 44.33 H new ATOM 0 HZ1 LYS A 861 12.733 -24.202 29.903 1.00 1.40 H new ATOM 0 HZ2 LYS A 861 13.175 -23.272 28.553 1.00 1.40 H new ATOM 0 HZ3 LYS A 861 11.559 -23.751 28.762 1.00 1.40 H new ATOM 1140 N ILE A 862 11.330 -23.439 21.715 1.00 73.14 N ATOM 1141 CA ILE A 862 11.214 -22.710 20.463 1.00 70.32 C ATOM 1142 C ILE A 862 10.054 -21.718 20.561 1.00 52.30 C ATOM 1143 O ILE A 862 9.003 -22.038 21.114 1.00 21.34 O ATOM 1144 CB ILE A 862 11.095 -23.681 19.287 1.00 73.45 C ATOM 1145 CG1 ILE A 862 9.639 -24.099 19.066 1.00 44.14 C ATOM 1146 CG2 ILE A 862 12.015 -24.889 19.477 1.00 51.21 C ATOM 1147 CD1 ILE A 862 8.956 -23.186 18.046 1.00 52.30 C ATOM 0 H ILE A 862 10.441 -23.662 22.163 1.00 73.14 H new ATOM 0 HA ILE A 862 12.116 -22.128 20.276 1.00 70.32 H new ATOM 0 HB ILE A 862 11.423 -23.165 18.384 1.00 73.45 H new ATOM 0 HG12 ILE A 862 9.602 -25.131 18.718 1.00 44.14 H new ATOM 0 HG13 ILE A 862 9.099 -24.062 20.012 1.00 44.14 H new ATOM 0 HG21 ILE A 862 11.911 -25.563 18.627 1.00 51.21 H new ATOM 0 HG22 ILE A 862 13.049 -24.551 19.548 1.00 51.21 H new ATOM 0 HG23 ILE A 862 11.742 -25.414 20.392 1.00 51.21 H new ATOM 0 HD11 ILE A 862 7.923 -23.504 17.907 1.00 52.30 H new ATOM 0 HD12 ILE A 862 8.973 -22.158 18.409 1.00 52.30 H new ATOM 0 HD13 ILE A 862 9.485 -23.244 17.094 1.00 52.30 H new ATOM 1159 N PHE A 863 10.283 -20.532 20.015 1.00 22.52 N ATOM 1160 CA PHE A 863 9.270 -19.491 20.034 1.00 2.03 C ATOM 1161 C PHE A 863 9.255 -18.716 18.715 1.00 60.41 C ATOM 1162 O PHE A 863 10.066 -18.978 17.828 1.00 61.30 O ATOM 1163 CB PHE A 863 9.635 -18.533 21.170 1.00 31.11 C ATOM 1164 CG PHE A 863 9.877 -19.224 22.513 1.00 23.34 C ATOM 1165 CD1 PHE A 863 10.952 -20.043 22.673 1.00 75.23 C ATOM 1166 CD2 PHE A 863 9.019 -19.020 23.548 1.00 13.01 C ATOM 1167 CE1 PHE A 863 11.176 -20.685 23.919 1.00 5.23 C ATOM 1168 CE2 PHE A 863 9.244 -19.662 24.795 1.00 53.42 C ATOM 1169 CZ PHE A 863 10.318 -20.481 24.954 1.00 11.50 C ATOM 0 H PHE A 863 11.156 -20.269 19.557 1.00 22.52 H new ATOM 0 HA PHE A 863 8.284 -19.934 20.175 1.00 2.03 H new ATOM 0 HB2 PHE A 863 10.532 -17.980 20.891 1.00 31.11 H new ATOM 0 HB3 PHE A 863 8.834 -17.803 21.288 1.00 31.11 H new ATOM 0 HD1 PHE A 863 11.635 -20.205 21.852 1.00 75.23 H new ATOM 0 HD2 PHE A 863 8.166 -18.370 23.422 1.00 13.01 H new ATOM 0 HE1 PHE A 863 12.029 -21.336 24.045 1.00 5.23 H new ATOM 0 HE2 PHE A 863 8.562 -19.500 25.617 1.00 53.42 H new ATOM 0 HZ PHE A 863 10.489 -20.969 25.902 1.00 11.50 H new ATOM 1179 N CYS A 864 8.324 -17.778 18.627 1.00 74.30 N ATOM 1180 CA CYS A 864 8.192 -16.964 17.431 1.00 42.03 C ATOM 1181 C CYS A 864 9.326 -15.936 17.422 1.00 33.42 C ATOM 1182 O CYS A 864 9.728 -15.442 18.474 1.00 22.23 O ATOM 1183 CB CYS A 864 6.817 -16.298 17.348 1.00 3.22 C ATOM 1184 SG CYS A 864 6.435 -15.864 15.612 1.00 44.01 S ATOM 0 H CYS A 864 7.653 -17.563 19.365 1.00 74.30 H new ATOM 0 HA CYS A 864 8.270 -17.597 16.547 1.00 42.03 H new ATOM 0 HB2 CYS A 864 6.054 -16.971 17.740 1.00 3.22 H new ATOM 0 HB3 CYS A 864 6.800 -15.401 17.968 1.00 3.22 H new ATOM 0 HG CYS A 864 5.729 -16.813 15.073 1.00 44.01 H new ATOM 1190 N ALA A 865 9.809 -15.645 16.223 1.00 34.23 N ATOM 1191 CA ALA A 865 10.888 -14.685 16.064 1.00 32.40 C ATOM 1192 C ALA A 865 10.303 -13.273 16.004 1.00 4.30 C ATOM 1193 O ALA A 865 11.032 -12.290 16.130 1.00 41.33 O ATOM 1194 CB ALA A 865 11.701 -15.034 14.816 1.00 52.44 C ATOM 0 H ALA A 865 9.473 -16.057 15.353 1.00 34.23 H new ATOM 0 HA ALA A 865 11.566 -14.724 16.916 1.00 32.40 H new ATOM 0 HB1 ALA A 865 12.511 -14.314 14.696 1.00 52.44 H new ATOM 0 HB2 ALA A 865 12.118 -16.035 14.922 1.00 52.44 H new ATOM 0 HB3 ALA A 865 11.054 -15.002 13.939 1.00 52.44 H new ATOM 1200 N ARG A 866 8.994 -13.216 15.812 1.00 73.31 N ATOM 1201 CA ARG A 866 8.303 -11.940 15.734 1.00 60.24 C ATOM 1202 C ARG A 866 8.604 -11.097 16.974 1.00 10.22 C ATOM 1203 O ARG A 866 9.190 -11.590 17.937 1.00 40.51 O ATOM 1204 CB ARG A 866 6.791 -12.139 15.615 1.00 14.11 C ATOM 1205 CG ARG A 866 6.440 -12.944 14.362 1.00 51.52 C ATOM 1206 CD ARG A 866 6.369 -12.038 13.131 1.00 41.22 C ATOM 1207 NE ARG A 866 7.730 -11.604 12.743 1.00 52.03 N ATOM 1208 CZ ARG A 866 7.997 -10.470 12.061 1.00 40.12 C ATOM 1209 NH1 ARG A 866 6.997 -9.644 11.685 1.00 30.44 N ATOM 1210 NH2 ARG A 866 9.251 -10.180 11.767 1.00 72.33 N ATOM 0 H ARG A 866 8.393 -14.033 15.708 1.00 73.31 H new ATOM 0 HA ARG A 866 8.661 -11.423 14.844 1.00 60.24 H new ATOM 0 HB2 ARG A 866 6.418 -12.655 16.499 1.00 14.11 H new ATOM 0 HB3 ARG A 866 6.295 -11.169 15.579 1.00 14.11 H new ATOM 0 HG2 ARG A 866 7.188 -13.721 14.203 1.00 51.52 H new ATOM 0 HG3 ARG A 866 5.483 -13.446 14.504 1.00 51.52 H new ATOM 0 HD2 ARG A 866 5.898 -12.570 12.304 1.00 41.22 H new ATOM 0 HD3 ARG A 866 5.748 -11.168 13.345 1.00 41.22 H new ATOM 0 HE ARG A 866 8.515 -12.199 13.007 1.00 52.03 H new ATOM 0 HH11 ARG A 866 6.031 -9.875 11.916 1.00 30.44 H new ATOM 0 HH12 ARG A 866 7.208 -8.789 11.170 1.00 30.44 H new ATOM 0 HH21 ARG A 866 10.001 -10.809 12.055 1.00 72.33 H new ATOM 0 HH22 ARG A 866 9.470 -9.327 11.252 1.00 72.33 H new ATOM 1223 N GLN A 867 8.189 -9.840 16.911 1.00 23.10 N ATOM 1224 CA GLN A 867 8.407 -8.924 18.017 1.00 1.43 C ATOM 1225 C GLN A 867 8.029 -9.591 19.341 1.00 4.45 C ATOM 1226 O GLN A 867 8.849 -9.673 20.255 1.00 12.21 O ATOM 1227 CB GLN A 867 7.625 -7.624 17.815 1.00 30.32 C ATOM 1228 CG GLN A 867 8.284 -6.465 18.565 1.00 43.01 C ATOM 1229 CD GLN A 867 7.862 -6.452 20.035 1.00 33.04 C ATOM 1230 OE1 GLN A 867 6.944 -7.141 20.450 1.00 1.34 O ATOM 1231 NE2 GLN A 867 8.580 -5.632 20.798 1.00 61.34 N ATOM 0 H GLN A 867 7.703 -9.435 16.111 1.00 23.10 H new ATOM 0 HA GLN A 867 9.467 -8.671 18.050 1.00 1.43 H new ATOM 0 HB2 GLN A 867 7.571 -7.390 16.752 1.00 30.32 H new ATOM 0 HB3 GLN A 867 6.601 -7.753 18.166 1.00 30.32 H new ATOM 0 HG2 GLN A 867 9.368 -6.552 18.495 1.00 43.01 H new ATOM 0 HG3 GLN A 867 8.009 -5.520 18.096 1.00 43.01 H new ATOM 0 HE21 GLN A 867 9.335 -5.083 20.387 1.00 61.34 H new ATOM 0 HE22 GLN A 867 8.375 -5.552 21.794 1.00 61.34 H new ATOM 1240 N ASN A 868 6.788 -10.050 19.403 1.00 2.21 N ATOM 1241 CA ASN A 868 6.292 -10.707 20.600 1.00 11.02 C ATOM 1242 C ASN A 868 7.382 -11.620 21.165 1.00 70.34 C ATOM 1243 O ASN A 868 8.011 -12.373 20.423 1.00 62.40 O ATOM 1244 CB ASN A 868 5.068 -11.570 20.288 1.00 55.53 C ATOM 1245 CG ASN A 868 5.139 -12.128 18.865 1.00 20.00 C ATOM 1246 OD1 ASN A 868 5.754 -13.148 18.601 1.00 32.31 O ATOM 1247 ND2 ASN A 868 4.478 -11.405 17.966 1.00 12.40 N ATOM 0 H ASN A 868 6.111 -9.980 18.643 1.00 2.21 H new ATOM 0 HA ASN A 868 6.015 -9.935 21.318 1.00 11.02 H new ATOM 0 HB2 ASN A 868 5.006 -12.391 21.002 1.00 55.53 H new ATOM 0 HB3 ASN A 868 4.161 -10.977 20.405 1.00 55.53 H new ATOM 0 HD21 ASN A 868 4.465 -11.695 16.988 1.00 12.40 H new ATOM 0 HD22 ASN A 868 3.983 -10.561 18.254 1.00 12.40 H new ATOM 1254 N CYS A 869 7.572 -11.523 22.472 1.00 30.52 N ATOM 1255 CA CYS A 869 8.575 -12.332 23.145 1.00 42.55 C ATOM 1256 C CYS A 869 7.863 -13.474 23.872 1.00 3.54 C ATOM 1257 O CYS A 869 8.430 -14.551 24.048 1.00 72.11 O ATOM 1258 CB CYS A 869 9.431 -11.494 24.097 1.00 42.25 C ATOM 1259 SG CYS A 869 11.009 -12.354 24.440 1.00 5.01 S ATOM 0 H CYS A 869 7.049 -10.897 23.084 1.00 30.52 H new ATOM 0 HA CYS A 869 9.265 -12.746 22.410 1.00 42.55 H new ATOM 0 HB2 CYS A 869 9.628 -10.516 23.657 1.00 42.25 H new ATOM 0 HB3 CYS A 869 8.891 -11.321 25.028 1.00 42.25 H new ATOM 0 HG CYS A 869 11.729 -11.633 25.247 1.00 5.01 H new ATOM 1265 N SER A 870 6.632 -13.199 24.276 1.00 12.43 N ATOM 1266 CA SER A 870 5.837 -14.190 24.981 1.00 14.42 C ATOM 1267 C SER A 870 5.006 -15.000 23.984 1.00 63.12 C ATOM 1268 O SER A 870 3.883 -15.399 24.286 1.00 73.24 O ATOM 1269 CB SER A 870 4.925 -13.529 26.017 1.00 1.22 C ATOM 1270 OG SER A 870 4.147 -12.478 25.451 1.00 72.14 O ATOM 0 H SER A 870 6.165 -12.304 24.129 1.00 12.43 H new ATOM 0 HA SER A 870 6.516 -14.860 25.508 1.00 14.42 H new ATOM 0 HB2 SER A 870 4.262 -14.279 26.447 1.00 1.22 H new ATOM 0 HB3 SER A 870 5.530 -13.133 26.833 1.00 1.22 H new ATOM 0 HG SER A 870 3.577 -12.083 26.144 1.00 72.14 H new ATOM 1276 N HIS A 871 5.592 -15.219 22.816 1.00 72.14 N ATOM 1277 CA HIS A 871 4.920 -15.975 21.772 1.00 42.31 C ATOM 1278 C HIS A 871 5.672 -17.283 21.521 1.00 21.52 C ATOM 1279 O HIS A 871 6.706 -17.292 20.855 1.00 40.10 O ATOM 1280 CB HIS A 871 4.762 -15.130 20.506 1.00 32.11 C ATOM 1281 CG HIS A 871 4.038 -15.835 19.384 1.00 64.43 C ATOM 1282 ND1 HIS A 871 3.485 -15.162 18.309 1.00 60.14 N ATOM 1283 CD2 HIS A 871 3.785 -17.160 19.180 1.00 32.15 C ATOM 1284 CE1 HIS A 871 2.925 -16.051 17.502 1.00 63.35 C ATOM 1285 NE2 HIS A 871 3.112 -17.289 18.044 1.00 54.11 N ATOM 0 H HIS A 871 6.524 -14.886 22.569 1.00 72.14 H new ATOM 0 HA HIS A 871 3.912 -16.232 22.096 1.00 42.31 H new ATOM 0 HB2 HIS A 871 4.222 -14.217 20.756 1.00 32.11 H new ATOM 0 HB3 HIS A 871 5.750 -14.830 20.156 1.00 32.11 H new ATOM 0 HD1 HIS A 871 3.505 -14.153 18.163 1.00 60.14 H new ATOM 0 HD2 HIS A 871 4.082 -17.967 19.833 1.00 32.15 H new ATOM 0 HE1 HIS A 871 2.411 -15.834 16.577 1.00 63.35 H new ATOM 1293 N ASP A 872 5.123 -18.358 22.068 1.00 2.05 N ATOM 1294 CA ASP A 872 5.729 -19.670 21.913 1.00 51.54 C ATOM 1295 C ASP A 872 4.934 -20.475 20.883 1.00 51.43 C ATOM 1296 O ASP A 872 3.707 -20.532 20.947 1.00 52.50 O ATOM 1297 CB ASP A 872 5.713 -20.444 23.232 1.00 1.31 C ATOM 1298 CG ASP A 872 4.321 -20.808 23.752 1.00 71.15 C ATOM 1299 OD1 ASP A 872 3.802 -21.900 23.477 1.00 64.43 O ATOM 1300 OD2 ASP A 872 3.756 -19.904 24.477 1.00 11.34 O ATOM 0 H ASP A 872 4.265 -18.347 22.619 1.00 2.05 H new ATOM 0 HA ASP A 872 6.761 -19.529 21.591 1.00 51.54 H new ATOM 0 HB2 ASP A 872 6.288 -21.361 23.104 1.00 1.31 H new ATOM 0 HB3 ASP A 872 6.224 -19.850 23.990 1.00 1.31 H new ATOM 1306 N TRP A 873 5.666 -21.077 19.957 1.00 54.32 N ATOM 1307 CA TRP A 873 5.044 -21.876 18.915 1.00 41.05 C ATOM 1308 C TRP A 873 4.957 -23.319 19.414 1.00 32.44 C ATOM 1309 O TRP A 873 3.875 -23.904 19.449 1.00 11.43 O ATOM 1310 CB TRP A 873 5.807 -21.745 17.595 1.00 23.40 C ATOM 1311 CG TRP A 873 5.509 -20.456 16.828 1.00 15.42 C ATOM 1312 CD1 TRP A 873 5.030 -19.301 17.311 1.00 54.10 C ATOM 1313 CD2 TRP A 873 5.690 -20.235 15.414 1.00 54.25 C ATOM 1314 NE1 TRP A 873 4.889 -18.356 16.315 1.00 2.11 N ATOM 1315 CE2 TRP A 873 5.303 -18.942 15.125 1.00 44.14 C ATOM 1316 CE3 TRP A 873 6.164 -21.099 14.411 1.00 21.02 C ATOM 1317 CZ2 TRP A 873 5.352 -18.397 13.836 1.00 72.22 C ATOM 1318 CZ3 TRP A 873 6.206 -20.540 13.128 1.00 4.45 C ATOM 1319 CH2 TRP A 873 5.821 -19.240 12.821 1.00 1.12 C ATOM 0 H TRP A 873 6.684 -21.027 19.907 1.00 54.32 H new ATOM 0 HA TRP A 873 4.036 -21.519 18.705 1.00 41.05 H new ATOM 0 HB2 TRP A 873 6.877 -21.795 17.799 1.00 23.40 H new ATOM 0 HB3 TRP A 873 5.564 -22.597 16.961 1.00 23.40 H new ATOM 0 HD1 TRP A 873 4.785 -19.131 18.349 1.00 54.10 H new ATOM 0 HE1 TRP A 873 4.544 -17.403 16.431 1.00 2.11 H new ATOM 0 HE3 TRP A 873 6.472 -22.114 14.614 1.00 21.02 H new ATOM 0 HZ2 TRP A 873 5.045 -17.381 13.636 1.00 72.22 H new ATOM 0 HZ3 TRP A 873 6.562 -21.162 12.320 1.00 4.45 H new ATOM 0 HH2 TRP A 873 5.883 -18.882 11.804 1.00 1.12 H new ATOM 1330 N GLY A 874 6.110 -23.853 19.789 1.00 62.13 N ATOM 1331 CA GLY A 874 6.178 -25.217 20.285 1.00 33.11 C ATOM 1332 C GLY A 874 7.439 -25.434 21.124 1.00 40.34 C ATOM 1333 O GLY A 874 7.783 -24.600 21.961 1.00 70.54 O ATOM 0 H GLY A 874 7.005 -23.365 19.759 1.00 62.13 H new ATOM 0 HA2 GLY A 874 5.295 -25.433 20.887 1.00 33.11 H new ATOM 0 HA3 GLY A 874 6.171 -25.913 19.446 1.00 33.11 H new ATOM 1337 N ILE A 875 8.094 -26.557 20.870 1.00 60.01 N ATOM 1338 CA ILE A 875 9.310 -26.894 21.591 1.00 52.30 C ATOM 1339 C ILE A 875 10.283 -27.596 20.642 1.00 51.44 C ATOM 1340 O ILE A 875 9.935 -27.894 19.500 1.00 23.42 O ATOM 1341 CB ILE A 875 8.981 -27.706 22.846 1.00 42.55 C ATOM 1342 CG1 ILE A 875 7.738 -28.570 22.629 1.00 35.11 C ATOM 1343 CG2 ILE A 875 8.841 -26.795 24.067 1.00 53.42 C ATOM 1344 CD1 ILE A 875 7.969 -29.595 21.517 1.00 22.32 C ATOM 0 H ILE A 875 7.806 -27.245 20.175 1.00 60.01 H new ATOM 0 HA ILE A 875 9.806 -25.990 21.945 1.00 52.30 H new ATOM 0 HB ILE A 875 9.812 -28.383 23.043 1.00 42.55 H new ATOM 0 HG12 ILE A 875 7.482 -29.085 23.555 1.00 35.11 H new ATOM 0 HG13 ILE A 875 6.890 -27.935 22.373 1.00 35.11 H new ATOM 0 HG21 ILE A 875 8.607 -27.397 24.945 1.00 53.42 H new ATOM 0 HG22 ILE A 875 9.777 -26.261 24.232 1.00 53.42 H new ATOM 0 HG23 ILE A 875 8.039 -26.077 23.895 1.00 53.42 H new ATOM 0 HD11 ILE A 875 7.070 -30.196 21.384 1.00 22.32 H new ATOM 0 HD12 ILE A 875 8.200 -29.076 20.587 1.00 22.32 H new ATOM 0 HD13 ILE A 875 8.802 -30.244 21.788 1.00 22.32 H new ATOM 1356 N HIS A 876 11.483 -27.838 21.149 1.00 74.45 N ATOM 1357 CA HIS A 876 12.508 -28.500 20.360 1.00 45.41 C ATOM 1358 C HIS A 876 12.827 -29.865 20.973 1.00 53.21 C ATOM 1359 O HIS A 876 13.369 -29.944 22.074 1.00 2.30 O ATOM 1360 CB HIS A 876 13.745 -27.609 20.221 1.00 71.20 C ATOM 1361 CG HIS A 876 14.425 -27.709 18.876 1.00 3.44 C ATOM 1362 ND1 HIS A 876 14.211 -26.796 17.858 1.00 12.14 N ATOM 1363 CD2 HIS A 876 15.318 -28.621 18.394 1.00 13.44 C ATOM 1364 CE1 HIS A 876 14.945 -27.153 16.815 1.00 3.21 C ATOM 1365 NE2 HIS A 876 15.630 -28.284 17.149 1.00 22.21 N ATOM 0 H HIS A 876 11.768 -27.588 22.096 1.00 74.45 H new ATOM 0 HA HIS A 876 12.139 -28.672 19.349 1.00 45.41 H new ATOM 0 HB2 HIS A 876 13.455 -26.573 20.394 1.00 71.20 H new ATOM 0 HB3 HIS A 876 14.461 -27.874 20.999 1.00 71.20 H new ATOM 0 HD2 HIS A 876 15.705 -29.472 18.934 1.00 13.44 H new ATOM 0 HE1 HIS A 876 14.993 -26.639 15.866 1.00 3.21 H new ATOM 0 HE2 HIS A 876 16.276 -28.788 16.542 1.00 22.21 H new ATOM 1373 N VAL A 877 12.476 -30.906 20.233 1.00 74.21 N ATOM 1374 CA VAL A 877 12.717 -32.264 20.690 1.00 71.32 C ATOM 1375 C VAL A 877 13.623 -32.981 19.687 1.00 23.43 C ATOM 1376 O VAL A 877 14.089 -32.377 18.723 1.00 50.42 O ATOM 1377 CB VAL A 877 11.386 -32.985 20.915 1.00 61.05 C ATOM 1378 CG1 VAL A 877 10.336 -32.031 21.487 1.00 30.24 C ATOM 1379 CG2 VAL A 877 10.889 -33.635 19.622 1.00 64.04 C ATOM 0 H VAL A 877 12.027 -30.837 19.320 1.00 74.21 H new ATOM 0 HA VAL A 877 13.234 -32.258 21.650 1.00 71.32 H new ATOM 0 HB VAL A 877 11.553 -33.777 21.645 1.00 61.05 H new ATOM 0 HG11 VAL A 877 9.400 -32.568 21.637 1.00 30.24 H new ATOM 0 HG12 VAL A 877 10.685 -31.636 22.441 1.00 30.24 H new ATOM 0 HG13 VAL A 877 10.174 -31.208 20.791 1.00 30.24 H new ATOM 0 HG21 VAL A 877 9.942 -34.141 19.810 1.00 64.04 H new ATOM 0 HG22 VAL A 877 10.746 -32.868 18.861 1.00 64.04 H new ATOM 0 HG23 VAL A 877 11.624 -34.360 19.273 1.00 64.04 H new ATOM 1389 N LYS A 878 13.846 -34.261 19.950 1.00 45.23 N ATOM 1390 CA LYS A 878 14.689 -35.067 19.082 1.00 11.25 C ATOM 1391 C LYS A 878 14.130 -36.490 19.015 1.00 4.41 C ATOM 1392 O LYS A 878 13.605 -37.001 20.002 1.00 34.34 O ATOM 1393 CB LYS A 878 16.148 -35.000 19.539 1.00 14.33 C ATOM 1394 CG LYS A 878 17.007 -36.013 18.781 1.00 72.41 C ATOM 1395 CD LYS A 878 18.496 -35.715 18.963 1.00 3.05 C ATOM 1396 CE LYS A 878 19.325 -37.000 18.900 1.00 14.23 C ATOM 1397 NZ LYS A 878 19.735 -37.284 17.507 1.00 1.10 N ATOM 0 H LYS A 878 13.458 -34.759 20.751 1.00 45.23 H new ATOM 0 HA LYS A 878 14.679 -34.672 18.066 1.00 11.25 H new ATOM 0 HB2 LYS A 878 16.537 -33.995 19.378 1.00 14.33 H new ATOM 0 HB3 LYS A 878 16.207 -35.197 20.609 1.00 14.33 H new ATOM 0 HG2 LYS A 878 16.788 -37.020 19.137 1.00 72.41 H new ATOM 0 HG3 LYS A 878 16.755 -35.988 17.721 1.00 72.41 H new ATOM 0 HD2 LYS A 878 18.830 -35.025 18.188 1.00 3.05 H new ATOM 0 HD3 LYS A 878 18.657 -35.221 19.921 1.00 3.05 H new ATOM 0 HE2 LYS A 878 20.207 -36.902 19.532 1.00 14.23 H new ATOM 0 HE3 LYS A 878 18.743 -37.835 19.292 1.00 14.23 H new ATOM 0 HZ1 LYS A 878 20.297 -38.159 17.482 1.00 1.10 H new ATOM 0 HZ2 LYS A 878 18.889 -37.398 16.913 1.00 1.10 H new ATOM 0 HZ3 LYS A 878 20.308 -36.495 17.146 1.00 1.10 H new ATOM 1410 N TYR A 879 14.264 -37.088 17.841 1.00 74.42 N ATOM 1411 CA TYR A 879 13.779 -38.442 17.632 1.00 72.13 C ATOM 1412 C TYR A 879 14.693 -39.210 16.674 1.00 34.15 C ATOM 1413 O TYR A 879 15.491 -38.609 15.957 1.00 73.54 O ATOM 1414 CB TYR A 879 12.395 -38.301 16.994 1.00 43.21 C ATOM 1415 CG TYR A 879 11.596 -39.604 16.947 1.00 34.23 C ATOM 1416 CD1 TYR A 879 11.757 -40.549 17.941 1.00 53.35 C ATOM 1417 CD2 TYR A 879 10.713 -39.836 15.912 1.00 52.43 C ATOM 1418 CE1 TYR A 879 11.004 -41.775 17.897 1.00 70.54 C ATOM 1419 CE2 TYR A 879 9.960 -41.062 15.868 1.00 61.42 C ATOM 1420 CZ TYR A 879 10.143 -41.972 16.862 1.00 11.24 C ATOM 1421 OH TYR A 879 9.432 -43.130 16.821 1.00 71.42 O ATOM 0 H TYR A 879 14.701 -36.660 17.025 1.00 74.42 H new ATOM 0 HA TYR A 879 13.751 -38.989 18.574 1.00 72.13 H new ATOM 0 HB2 TYR A 879 11.824 -37.557 17.549 1.00 43.21 H new ATOM 0 HB3 TYR A 879 12.511 -37.921 15.979 1.00 43.21 H new ATOM 0 HD1 TYR A 879 12.448 -40.368 18.751 1.00 53.35 H new ATOM 0 HD2 TYR A 879 10.587 -39.097 15.134 1.00 52.43 H new ATOM 0 HE1 TYR A 879 11.120 -42.522 18.668 1.00 70.54 H new ATOM 0 HE2 TYR A 879 9.265 -41.255 15.064 1.00 61.42 H new ATOM 0 HH TYR A 879 8.857 -43.133 16.027 1.00 71.42 H new ATOM 1431 N LYS A 880 14.545 -40.527 16.695 1.00 41.41 N ATOM 1432 CA LYS A 880 15.347 -41.383 15.838 1.00 42.13 C ATOM 1433 C LYS A 880 15.539 -40.703 14.481 1.00 53.05 C ATOM 1434 O LYS A 880 16.654 -40.326 14.123 1.00 73.22 O ATOM 1435 CB LYS A 880 14.728 -42.779 15.744 1.00 13.22 C ATOM 1436 CG LYS A 880 14.880 -43.536 17.065 1.00 11.32 C ATOM 1437 CD LYS A 880 16.330 -43.971 17.284 1.00 44.32 C ATOM 1438 CE LYS A 880 16.475 -44.763 18.585 1.00 71.13 C ATOM 1439 NZ LYS A 880 17.839 -45.325 18.700 1.00 21.31 N ATOM 0 H LYS A 880 13.882 -41.021 17.292 1.00 41.41 H new ATOM 0 HA LYS A 880 16.339 -41.528 16.266 1.00 42.13 H new ATOM 0 HB2 LYS A 880 13.672 -42.696 15.488 1.00 13.22 H new ATOM 0 HB3 LYS A 880 15.207 -43.340 14.942 1.00 13.22 H new ATOM 0 HG2 LYS A 880 14.558 -42.902 17.891 1.00 11.32 H new ATOM 0 HG3 LYS A 880 14.230 -44.411 17.064 1.00 11.32 H new ATOM 0 HD2 LYS A 880 16.661 -44.581 16.444 1.00 44.32 H new ATOM 0 HD3 LYS A 880 16.976 -43.094 17.314 1.00 44.32 H new ATOM 0 HE2 LYS A 880 16.269 -44.115 19.437 1.00 71.13 H new ATOM 0 HE3 LYS A 880 15.740 -45.568 18.612 1.00 71.13 H new ATOM 0 HZ1 LYS A 880 17.920 -45.859 19.588 1.00 21.31 H new ATOM 0 HZ2 LYS A 880 18.022 -45.959 17.896 1.00 21.31 H new ATOM 0 HZ3 LYS A 880 18.535 -44.552 18.696 1.00 21.31 H new ATOM 1452 N THR A 881 14.434 -40.567 13.762 1.00 42.43 N ATOM 1453 CA THR A 881 14.466 -39.939 12.452 1.00 45.42 C ATOM 1454 C THR A 881 15.446 -38.764 12.448 1.00 43.33 C ATOM 1455 O THR A 881 16.569 -38.889 11.962 1.00 43.14 O ATOM 1456 CB THR A 881 13.036 -39.538 12.084 1.00 63.41 C ATOM 1457 OG1 THR A 881 13.195 -38.345 11.321 1.00 31.23 O ATOM 1458 CG2 THR A 881 12.220 -39.097 13.301 1.00 64.23 C ATOM 0 H THR A 881 13.511 -40.881 14.062 1.00 42.43 H new ATOM 0 HA THR A 881 14.831 -40.629 11.692 1.00 45.42 H new ATOM 0 HB THR A 881 12.538 -40.377 11.598 1.00 63.41 H new ATOM 0 HG1 THR A 881 12.315 -38.017 11.040 1.00 31.23 H new ATOM 0 HG21 THR A 881 11.214 -38.823 12.984 1.00 64.23 H new ATOM 0 HG22 THR A 881 12.165 -39.916 14.018 1.00 64.23 H new ATOM 0 HG23 THR A 881 12.700 -38.237 13.769 1.00 64.23 H new ATOM 1466 N PHE A 882 14.986 -37.649 12.995 1.00 14.41 N ATOM 1467 CA PHE A 882 15.807 -36.452 13.061 1.00 64.03 C ATOM 1468 C PHE A 882 15.425 -35.590 14.265 1.00 2.34 C ATOM 1469 O PHE A 882 14.455 -35.885 14.962 1.00 25.11 O ATOM 1470 CB PHE A 882 15.547 -35.660 11.778 1.00 11.41 C ATOM 1471 CG PHE A 882 16.300 -36.189 10.556 1.00 74.22 C ATOM 1472 CD1 PHE A 882 17.656 -36.280 10.579 1.00 23.25 C ATOM 1473 CD2 PHE A 882 15.612 -36.569 9.446 1.00 72.04 C ATOM 1474 CE1 PHE A 882 18.355 -36.772 9.445 1.00 11.21 C ATOM 1475 CE2 PHE A 882 16.310 -37.061 8.311 1.00 4.43 C ATOM 1476 CZ PHE A 882 17.667 -37.152 8.335 1.00 41.41 C ATOM 0 H PHE A 882 14.054 -37.549 13.397 1.00 14.41 H new ATOM 0 HA PHE A 882 16.857 -36.727 13.164 1.00 64.03 H new ATOM 0 HB2 PHE A 882 14.478 -35.672 11.566 1.00 11.41 H new ATOM 0 HB3 PHE A 882 15.828 -34.620 11.942 1.00 11.41 H new ATOM 0 HD1 PHE A 882 18.202 -35.978 11.460 1.00 23.25 H new ATOM 0 HD2 PHE A 882 14.535 -36.497 9.428 1.00 72.04 H new ATOM 0 HE1 PHE A 882 19.432 -36.844 9.464 1.00 11.21 H new ATOM 0 HE2 PHE A 882 15.764 -37.363 7.430 1.00 4.43 H new ATOM 0 HZ PHE A 882 18.198 -37.526 7.472 1.00 41.41 H new ATOM 1486 N GLU A 883 16.207 -34.541 14.474 1.00 42.32 N ATOM 1487 CA GLU A 883 15.963 -33.633 15.582 1.00 31.52 C ATOM 1488 C GLU A 883 15.197 -32.400 15.100 1.00 71.04 C ATOM 1489 O GLU A 883 15.788 -31.476 14.543 1.00 24.13 O ATOM 1490 CB GLU A 883 17.274 -33.233 16.263 1.00 75.45 C ATOM 1491 CG GLU A 883 18.332 -32.845 15.228 1.00 30.12 C ATOM 1492 CD GLU A 883 19.415 -31.965 15.856 1.00 54.44 C ATOM 1493 OE1 GLU A 883 19.104 -31.095 16.684 1.00 71.34 O ATOM 1494 OE2 GLU A 883 20.616 -32.210 15.456 1.00 42.55 O ATOM 0 H GLU A 883 17.011 -34.299 13.894 1.00 42.32 H new ATOM 0 HA GLU A 883 15.351 -34.150 16.321 1.00 31.52 H new ATOM 0 HB2 GLU A 883 17.097 -32.396 16.939 1.00 75.45 H new ATOM 0 HB3 GLU A 883 17.640 -34.061 16.870 1.00 75.45 H new ATOM 0 HG2 GLU A 883 18.785 -33.744 14.811 1.00 30.12 H new ATOM 0 HG3 GLU A 883 17.860 -32.313 14.402 1.00 30.12 H new ATOM 1502 N ILE A 884 13.892 -32.425 15.330 1.00 25.31 N ATOM 1503 CA ILE A 884 13.040 -31.321 14.926 1.00 55.43 C ATOM 1504 C ILE A 884 12.038 -31.020 16.042 1.00 33.24 C ATOM 1505 O ILE A 884 11.799 -31.859 16.910 1.00 65.22 O ATOM 1506 CB ILE A 884 12.385 -31.616 13.575 1.00 55.00 C ATOM 1507 CG1 ILE A 884 12.143 -33.117 13.399 1.00 12.43 C ATOM 1508 CG2 ILE A 884 13.208 -31.030 12.426 1.00 0.34 C ATOM 1509 CD1 ILE A 884 11.106 -33.626 14.402 1.00 12.04 C ATOM 0 H ILE A 884 13.405 -33.193 15.791 1.00 25.31 H new ATOM 0 HA ILE A 884 13.632 -30.418 14.777 1.00 55.43 H new ATOM 0 HB ILE A 884 11.411 -31.128 13.555 1.00 55.00 H new ATOM 0 HG12 ILE A 884 11.801 -33.317 12.384 1.00 12.43 H new ATOM 0 HG13 ILE A 884 13.080 -33.658 13.533 1.00 12.43 H new ATOM 0 HG21 ILE A 884 12.720 -31.254 11.478 1.00 0.34 H new ATOM 0 HG22 ILE A 884 13.285 -29.950 12.548 1.00 0.34 H new ATOM 0 HG23 ILE A 884 14.206 -31.468 12.433 1.00 0.34 H new ATOM 0 HD11 ILE A 884 10.952 -34.695 14.256 1.00 12.04 H new ATOM 0 HD12 ILE A 884 11.462 -33.446 15.416 1.00 12.04 H new ATOM 0 HD13 ILE A 884 10.164 -33.100 14.250 1.00 12.04 H new ATOM 1521 N PRO A 885 11.463 -29.789 15.983 1.00 30.02 N ATOM 1522 CA PRO A 885 10.492 -29.367 16.979 1.00 64.52 C ATOM 1523 C PRO A 885 9.141 -30.047 16.750 1.00 60.54 C ATOM 1524 O PRO A 885 8.901 -30.617 15.686 1.00 23.42 O ATOM 1525 CB PRO A 885 10.426 -27.855 16.848 1.00 50.34 C ATOM 1526 CG PRO A 885 11.007 -27.529 15.481 1.00 13.22 C ATOM 1527 CD PRO A 885 11.721 -28.769 14.970 1.00 30.55 C ATOM 0 HA PRO A 885 10.776 -29.653 17.992 1.00 64.52 H new ATOM 0 HB2 PRO A 885 9.399 -27.500 16.930 1.00 50.34 H new ATOM 0 HB3 PRO A 885 10.995 -27.369 17.640 1.00 50.34 H new ATOM 0 HG2 PRO A 885 10.217 -27.232 14.791 1.00 13.22 H new ATOM 0 HG3 PRO A 885 11.700 -26.691 15.551 1.00 13.22 H new ATOM 0 HD2 PRO A 885 11.339 -29.073 13.996 1.00 30.55 H new ATOM 0 HD3 PRO A 885 12.790 -28.590 14.851 1.00 30.55 H new ATOM 1535 N VAL A 886 8.293 -29.965 17.764 1.00 3.24 N ATOM 1536 CA VAL A 886 6.972 -30.565 17.687 1.00 43.11 C ATOM 1537 C VAL A 886 5.916 -29.504 18.000 1.00 54.43 C ATOM 1538 O VAL A 886 6.160 -28.593 18.790 1.00 71.20 O ATOM 1539 CB VAL A 886 6.894 -31.779 18.615 1.00 14.31 C ATOM 1540 CG1 VAL A 886 5.490 -32.388 18.603 1.00 64.34 C ATOM 1541 CG2 VAL A 886 7.948 -32.823 18.243 1.00 5.52 C ATOM 0 H VAL A 886 8.495 -29.492 18.645 1.00 3.24 H new ATOM 0 HA VAL A 886 6.776 -30.930 16.679 1.00 43.11 H new ATOM 0 HB VAL A 886 7.104 -31.439 19.629 1.00 14.31 H new ATOM 0 HG11 VAL A 886 5.461 -33.249 19.271 1.00 64.34 H new ATOM 0 HG12 VAL A 886 4.768 -31.644 18.939 1.00 64.34 H new ATOM 0 HG13 VAL A 886 5.240 -32.705 17.591 1.00 64.34 H new ATOM 0 HG21 VAL A 886 7.870 -33.675 18.918 1.00 5.52 H new ATOM 0 HG22 VAL A 886 7.784 -33.156 17.218 1.00 5.52 H new ATOM 0 HG23 VAL A 886 8.942 -32.383 18.327 1.00 5.52 H new ATOM 1551 N ILE A 887 4.763 -29.656 17.363 1.00 5.15 N ATOM 1552 CA ILE A 887 3.669 -28.722 17.564 1.00 54.11 C ATOM 1553 C ILE A 887 2.371 -29.503 17.782 1.00 41.11 C ATOM 1554 O ILE A 887 2.290 -30.684 17.447 1.00 15.22 O ATOM 1555 CB ILE A 887 3.598 -27.723 16.407 1.00 1.24 C ATOM 1556 CG1 ILE A 887 4.995 -27.232 16.021 1.00 72.12 C ATOM 1557 CG2 ILE A 887 2.655 -26.565 16.740 1.00 4.51 C ATOM 1558 CD1 ILE A 887 4.964 -26.489 14.683 1.00 25.54 C ATOM 0 H ILE A 887 4.564 -30.412 16.708 1.00 5.15 H new ATOM 0 HA ILE A 887 3.837 -28.125 18.460 1.00 54.11 H new ATOM 0 HB ILE A 887 3.185 -28.235 15.538 1.00 1.24 H new ATOM 0 HG12 ILE A 887 5.381 -26.573 16.799 1.00 72.12 H new ATOM 0 HG13 ILE A 887 5.677 -28.080 15.955 1.00 72.12 H new ATOM 0 HG21 ILE A 887 2.623 -25.869 15.901 1.00 4.51 H new ATOM 0 HG22 ILE A 887 1.654 -26.953 16.928 1.00 4.51 H new ATOM 0 HG23 ILE A 887 3.016 -26.046 17.628 1.00 4.51 H new ATOM 0 HD11 ILE A 887 5.969 -26.150 14.431 1.00 25.54 H new ATOM 0 HD12 ILE A 887 4.601 -27.159 13.903 1.00 25.54 H new ATOM 0 HD13 ILE A 887 4.300 -25.628 14.760 1.00 25.54 H new ATOM 1570 N LYS A 888 1.389 -28.812 18.341 1.00 11.05 N ATOM 1571 CA LYS A 888 0.099 -29.426 18.608 1.00 23.00 C ATOM 1572 C LYS A 888 -0.879 -29.053 17.492 1.00 2.01 C ATOM 1573 O LYS A 888 -0.565 -28.226 16.637 1.00 25.41 O ATOM 1574 CB LYS A 888 -0.393 -29.052 20.008 1.00 70.43 C ATOM 1575 CG LYS A 888 0.623 -29.465 21.075 1.00 43.55 C ATOM 1576 CD LYS A 888 0.055 -29.262 22.481 1.00 72.45 C ATOM 1577 CE LYS A 888 1.167 -28.938 23.480 1.00 13.01 C ATOM 1578 NZ LYS A 888 1.745 -30.183 24.034 1.00 43.42 N ATOM 0 H LYS A 888 1.460 -27.833 18.617 1.00 11.05 H new ATOM 0 HA LYS A 888 0.186 -30.513 18.606 1.00 23.00 H new ATOM 0 HB2 LYS A 888 -0.565 -27.977 20.062 1.00 70.43 H new ATOM 0 HB3 LYS A 888 -1.349 -29.538 20.203 1.00 70.43 H new ATOM 0 HG2 LYS A 888 0.896 -30.511 20.937 1.00 43.55 H new ATOM 0 HG3 LYS A 888 1.535 -28.880 20.959 1.00 43.55 H new ATOM 0 HD2 LYS A 888 -0.675 -28.453 22.469 1.00 72.45 H new ATOM 0 HD3 LYS A 888 -0.472 -30.162 22.798 1.00 72.45 H new ATOM 0 HE2 LYS A 888 1.946 -28.355 22.989 1.00 13.01 H new ATOM 0 HE3 LYS A 888 0.770 -28.323 24.288 1.00 13.01 H new ATOM 0 HZ1 LYS A 888 2.498 -29.945 24.710 1.00 43.42 H new ATOM 0 HZ2 LYS A 888 1.002 -30.725 24.520 1.00 43.42 H new ATOM 0 HZ3 LYS A 888 2.141 -30.755 23.262 1.00 43.42 H new ATOM 1591 N ILE A 889 -2.045 -29.680 17.537 1.00 62.43 N ATOM 1592 CA ILE A 889 -3.071 -29.425 16.540 1.00 2.30 C ATOM 1593 C ILE A 889 -3.719 -28.067 16.819 1.00 72.24 C ATOM 1594 O ILE A 889 -3.929 -27.276 15.901 1.00 51.51 O ATOM 1595 CB ILE A 889 -4.068 -30.584 16.488 1.00 13.34 C ATOM 1596 CG1 ILE A 889 -5.050 -30.411 15.327 1.00 24.22 C ATOM 1597 CG2 ILE A 889 -4.789 -30.747 17.828 1.00 23.13 C ATOM 1598 CD1 ILE A 889 -4.523 -31.087 14.059 1.00 10.34 C ATOM 0 H ILE A 889 -2.302 -30.364 18.248 1.00 62.43 H new ATOM 0 HA ILE A 889 -2.631 -29.370 15.544 1.00 2.30 H new ATOM 0 HB ILE A 889 -3.513 -31.504 16.306 1.00 13.34 H new ATOM 0 HG12 ILE A 889 -6.016 -30.838 15.596 1.00 24.22 H new ATOM 0 HG13 ILE A 889 -5.212 -29.350 15.138 1.00 24.22 H new ATOM 0 HG21 ILE A 889 -5.492 -31.578 17.764 1.00 23.13 H new ATOM 0 HG22 ILE A 889 -4.059 -30.949 18.612 1.00 23.13 H new ATOM 0 HG23 ILE A 889 -5.330 -29.831 18.064 1.00 23.13 H new ATOM 0 HD11 ILE A 889 -5.239 -30.950 13.249 1.00 10.34 H new ATOM 0 HD12 ILE A 889 -3.568 -30.641 13.779 1.00 10.34 H new ATOM 0 HD13 ILE A 889 -4.385 -32.152 14.245 1.00 10.34 H new ATOM 1610 N GLU A 890 -4.019 -27.840 18.089 1.00 5.20 N ATOM 1611 CA GLU A 890 -4.639 -26.592 18.500 1.00 42.30 C ATOM 1612 C GLU A 890 -3.570 -25.531 18.769 1.00 44.13 C ATOM 1613 O GLU A 890 -3.873 -24.454 19.279 1.00 13.15 O ATOM 1614 CB GLU A 890 -5.526 -26.799 19.729 1.00 74.12 C ATOM 1615 CG GLU A 890 -4.682 -27.057 20.978 1.00 3.52 C ATOM 1616 CD GLU A 890 -4.234 -25.741 21.618 1.00 13.32 C ATOM 1617 OE1 GLU A 890 -5.027 -25.089 22.315 1.00 62.22 O ATOM 1618 OE2 GLU A 890 -3.015 -25.401 21.371 1.00 25.32 O ATOM 0 H GLU A 890 -3.844 -28.499 18.847 1.00 5.20 H new ATOM 0 HA GLU A 890 -5.275 -26.241 17.688 1.00 42.30 H new ATOM 0 HB2 GLU A 890 -6.150 -25.919 19.883 1.00 74.12 H new ATOM 0 HB3 GLU A 890 -6.198 -27.641 19.559 1.00 74.12 H new ATOM 0 HG2 GLU A 890 -5.259 -27.638 21.698 1.00 3.52 H new ATOM 0 HG3 GLU A 890 -3.809 -27.653 20.714 1.00 3.52 H new ATOM 1626 N SER A 891 -2.340 -25.872 18.413 1.00 60.43 N ATOM 1627 CA SER A 891 -1.224 -24.963 18.609 1.00 11.31 C ATOM 1628 C SER A 891 -1.325 -23.792 17.630 1.00 51.53 C ATOM 1629 O SER A 891 -1.006 -22.656 17.979 1.00 65.21 O ATOM 1630 CB SER A 891 0.113 -25.686 18.436 1.00 40.33 C ATOM 1631 OG SER A 891 1.199 -24.774 18.295 1.00 11.41 O ATOM 0 H SER A 891 -2.092 -26.766 17.990 1.00 60.43 H new ATOM 0 HA SER A 891 -1.270 -24.581 19.629 1.00 11.31 H new ATOM 0 HB2 SER A 891 0.290 -26.331 19.297 1.00 40.33 H new ATOM 0 HB3 SER A 891 0.065 -26.331 17.559 1.00 40.33 H new ATOM 0 HG SER A 891 1.852 -24.930 19.008 1.00 11.41 H new ATOM 1637 N PHE A 892 -1.771 -24.108 16.423 1.00 42.22 N ATOM 1638 CA PHE A 892 -1.918 -23.096 15.390 1.00 30.04 C ATOM 1639 C PHE A 892 -3.192 -23.326 14.575 1.00 14.54 C ATOM 1640 O PHE A 892 -3.760 -24.417 14.598 1.00 41.41 O ATOM 1641 CB PHE A 892 -0.706 -23.221 14.465 1.00 22.34 C ATOM 1642 CG PHE A 892 -0.346 -24.664 14.103 1.00 53.44 C ATOM 1643 CD1 PHE A 892 -1.238 -25.438 13.428 1.00 13.34 C ATOM 1644 CD2 PHE A 892 0.865 -25.171 14.454 1.00 23.44 C ATOM 1645 CE1 PHE A 892 -0.905 -26.776 13.092 1.00 64.33 C ATOM 1646 CE2 PHE A 892 1.199 -26.510 14.118 1.00 50.12 C ATOM 1647 CZ PHE A 892 0.307 -27.284 13.443 1.00 21.15 C ATOM 0 H PHE A 892 -2.035 -25.051 16.137 1.00 42.22 H new ATOM 0 HA PHE A 892 -1.983 -22.107 15.844 1.00 30.04 H new ATOM 0 HB2 PHE A 892 -0.903 -22.665 13.548 1.00 22.34 H new ATOM 0 HB3 PHE A 892 0.154 -22.752 14.944 1.00 22.34 H new ATOM 0 HD1 PHE A 892 -2.200 -25.034 13.148 1.00 13.34 H new ATOM 0 HD2 PHE A 892 1.574 -24.556 14.989 1.00 23.44 H new ATOM 0 HE1 PHE A 892 -1.614 -27.391 12.558 1.00 64.33 H new ATOM 0 HE2 PHE A 892 2.161 -26.913 14.398 1.00 50.12 H new ATOM 0 HZ PHE A 892 0.561 -28.302 13.186 1.00 21.15 H new ATOM 1657 N VAL A 893 -3.605 -22.279 13.875 1.00 71.42 N ATOM 1658 CA VAL A 893 -4.802 -22.353 13.054 1.00 21.22 C ATOM 1659 C VAL A 893 -4.408 -22.690 11.615 1.00 40.45 C ATOM 1660 O VAL A 893 -3.233 -22.620 11.256 1.00 14.02 O ATOM 1661 CB VAL A 893 -5.596 -21.050 13.168 1.00 64.11 C ATOM 1662 CG1 VAL A 893 -5.551 -20.504 14.596 1.00 3.32 C ATOM 1663 CG2 VAL A 893 -5.088 -20.010 12.167 1.00 74.23 C ATOM 0 H VAL A 893 -3.132 -21.375 13.860 1.00 71.42 H new ATOM 0 HA VAL A 893 -5.458 -23.149 13.406 1.00 21.22 H new ATOM 0 HB VAL A 893 -6.636 -21.269 12.926 1.00 64.11 H new ATOM 0 HG11 VAL A 893 -6.123 -19.578 14.650 1.00 3.32 H new ATOM 0 HG12 VAL A 893 -5.981 -21.236 15.279 1.00 3.32 H new ATOM 0 HG13 VAL A 893 -4.517 -20.308 14.878 1.00 3.32 H new ATOM 0 HG21 VAL A 893 -5.669 -19.093 12.268 1.00 74.23 H new ATOM 0 HG22 VAL A 893 -4.037 -19.798 12.365 1.00 74.23 H new ATOM 0 HG23 VAL A 893 -5.195 -20.397 11.154 1.00 74.23 H new ATOM 1673 N VAL A 894 -5.413 -23.047 10.828 1.00 25.11 N ATOM 1674 CA VAL A 894 -5.186 -23.394 9.436 1.00 62.55 C ATOM 1675 C VAL A 894 -6.065 -22.514 8.545 1.00 34.52 C ATOM 1676 O VAL A 894 -7.290 -22.625 8.573 1.00 31.01 O ATOM 1677 CB VAL A 894 -5.428 -24.890 9.223 1.00 24.33 C ATOM 1678 CG1 VAL A 894 -6.902 -25.171 8.927 1.00 12.33 C ATOM 1679 CG2 VAL A 894 -4.531 -25.438 8.111 1.00 71.10 C ATOM 0 H VAL A 894 -6.386 -23.103 11.128 1.00 25.11 H new ATOM 0 HA VAL A 894 -4.149 -23.203 9.160 1.00 62.55 H new ATOM 0 HB VAL A 894 -5.168 -25.406 10.147 1.00 24.33 H new ATOM 0 HG11 VAL A 894 -7.046 -26.241 8.780 1.00 12.33 H new ATOM 0 HG12 VAL A 894 -7.512 -24.835 9.765 1.00 12.33 H new ATOM 0 HG13 VAL A 894 -7.200 -24.637 8.024 1.00 12.33 H new ATOM 0 HG21 VAL A 894 -4.723 -26.503 7.980 1.00 71.10 H new ATOM 0 HG22 VAL A 894 -4.745 -24.914 7.180 1.00 71.10 H new ATOM 0 HG23 VAL A 894 -3.485 -25.288 8.380 1.00 71.10 H new ATOM 1689 N GLU A 895 -5.406 -21.660 7.776 1.00 33.31 N ATOM 1690 CA GLU A 895 -6.113 -20.762 6.879 1.00 10.21 C ATOM 1691 C GLU A 895 -5.748 -21.068 5.425 1.00 3.42 C ATOM 1692 O GLU A 895 -4.576 -21.022 5.053 1.00 32.41 O ATOM 1693 CB GLU A 895 -5.818 -19.300 7.223 1.00 73.43 C ATOM 1694 CG GLU A 895 -6.894 -18.375 6.651 1.00 14.01 C ATOM 1695 CD GLU A 895 -6.336 -16.972 6.402 1.00 22.53 C ATOM 1696 OE1 GLU A 895 -5.438 -16.803 5.564 1.00 2.53 O ATOM 1697 OE2 GLU A 895 -6.869 -16.039 7.115 1.00 3.15 O ATOM 0 H GLU A 895 -4.390 -21.571 7.756 1.00 33.31 H new ATOM 0 HA GLU A 895 -7.184 -20.922 7.005 1.00 10.21 H new ATOM 0 HB2 GLU A 895 -5.768 -19.180 8.305 1.00 73.43 H new ATOM 0 HB3 GLU A 895 -4.843 -19.019 6.826 1.00 73.43 H new ATOM 0 HG2 GLU A 895 -7.276 -18.789 5.718 1.00 14.01 H new ATOM 0 HG3 GLU A 895 -7.735 -18.318 7.342 1.00 14.01 H new ATOM 1705 N ASP A 896 -6.772 -21.372 4.643 1.00 75.25 N ATOM 1706 CA ASP A 896 -6.574 -21.685 3.238 1.00 60.44 C ATOM 1707 C ASP A 896 -6.195 -20.409 2.484 1.00 73.15 C ATOM 1708 O ASP A 896 -6.725 -19.336 2.768 1.00 44.23 O ATOM 1709 CB ASP A 896 -7.854 -22.242 2.611 1.00 21.43 C ATOM 1710 CG ASP A 896 -7.808 -23.731 2.262 1.00 62.24 C ATOM 1711 OD1 ASP A 896 -6.907 -24.191 1.545 1.00 65.30 O ATOM 1712 OD2 ASP A 896 -8.762 -24.439 2.765 1.00 63.14 O ATOM 0 H ASP A 896 -7.742 -21.408 4.955 1.00 75.25 H new ATOM 0 HA ASP A 896 -5.784 -22.432 3.168 1.00 60.44 H new ATOM 0 HB2 ASP A 896 -8.682 -22.071 3.299 1.00 21.43 H new ATOM 0 HB3 ASP A 896 -8.072 -21.678 1.704 1.00 21.43 H new ATOM 1718 N ILE A 897 -5.282 -20.568 1.537 1.00 21.00 N ATOM 1719 CA ILE A 897 -4.826 -19.442 0.740 1.00 13.20 C ATOM 1720 C ILE A 897 -5.734 -19.287 -0.482 1.00 42.00 C ATOM 1721 O ILE A 897 -5.616 -18.316 -1.228 1.00 71.21 O ATOM 1722 CB ILE A 897 -3.345 -19.597 0.390 1.00 20.42 C ATOM 1723 CG1 ILE A 897 -2.600 -20.361 1.487 1.00 61.22 C ATOM 1724 CG2 ILE A 897 -2.704 -18.238 0.102 1.00 71.45 C ATOM 1725 CD1 ILE A 897 -2.266 -21.784 1.034 1.00 34.22 C ATOM 0 H ILE A 897 -4.846 -21.460 1.304 1.00 21.00 H new ATOM 0 HA ILE A 897 -4.899 -18.517 1.312 1.00 13.20 H new ATOM 0 HB ILE A 897 -3.270 -20.188 -0.523 1.00 20.42 H new ATOM 0 HG12 ILE A 897 -1.682 -19.832 1.744 1.00 61.22 H new ATOM 0 HG13 ILE A 897 -3.211 -20.397 2.389 1.00 61.22 H new ATOM 0 HG21 ILE A 897 -1.651 -18.377 -0.144 1.00 71.45 H new ATOM 0 HG22 ILE A 897 -3.214 -17.766 -0.738 1.00 71.45 H new ATOM 0 HG23 ILE A 897 -2.790 -17.601 0.983 1.00 71.45 H new ATOM 0 HD11 ILE A 897 -1.737 -22.305 1.832 1.00 34.22 H new ATOM 0 HD12 ILE A 897 -3.188 -22.317 0.801 1.00 34.22 H new ATOM 0 HD13 ILE A 897 -1.635 -21.745 0.146 1.00 34.22 H new ATOM 1737 N ALA A 898 -6.619 -20.259 -0.649 1.00 2.31 N ATOM 1738 CA ALA A 898 -7.546 -20.243 -1.768 1.00 1.34 C ATOM 1739 C ALA A 898 -8.866 -19.610 -1.321 1.00 62.45 C ATOM 1740 O ALA A 898 -9.727 -19.315 -2.148 1.00 53.42 O ATOM 1741 CB ALA A 898 -7.731 -21.666 -2.298 1.00 10.21 C ATOM 0 H ALA A 898 -6.714 -21.063 -0.028 1.00 2.31 H new ATOM 0 HA ALA A 898 -7.151 -19.640 -2.586 1.00 1.34 H new ATOM 0 HB1 ALA A 898 -8.426 -21.654 -3.137 1.00 10.21 H new ATOM 0 HB2 ALA A 898 -6.770 -22.059 -2.629 1.00 10.21 H new ATOM 0 HB3 ALA A 898 -8.129 -22.300 -1.506 1.00 10.21 H new ATOM 1747 N THR A 899 -8.983 -19.422 -0.015 1.00 51.13 N ATOM 1748 CA THR A 899 -10.183 -18.830 0.551 1.00 75.23 C ATOM 1749 C THR A 899 -9.817 -17.810 1.631 1.00 70.43 C ATOM 1750 O THR A 899 -10.339 -16.697 1.641 1.00 50.34 O ATOM 1751 CB THR A 899 -11.073 -19.964 1.063 1.00 74.42 C ATOM 1752 OG1 THR A 899 -10.579 -20.229 2.373 1.00 70.12 O ATOM 1753 CG2 THR A 899 -10.845 -21.275 0.307 1.00 52.24 C ATOM 0 H THR A 899 -8.266 -19.669 0.668 1.00 51.13 H new ATOM 0 HA THR A 899 -10.742 -18.273 -0.201 1.00 75.23 H new ATOM 0 HB THR A 899 -12.119 -19.671 0.975 1.00 74.42 H new ATOM 0 HG1 THR A 899 -11.101 -20.952 2.780 1.00 70.12 H new ATOM 0 HG21 THR A 899 -11.501 -22.046 0.710 1.00 52.24 H new ATOM 0 HG22 THR A 899 -11.064 -21.128 -0.751 1.00 52.24 H new ATOM 0 HG23 THR A 899 -9.807 -21.586 0.422 1.00 52.24 H new ATOM 1761 N GLY A 900 -8.922 -18.228 2.514 1.00 10.40 N ATOM 1762 CA GLY A 900 -8.480 -17.364 3.596 1.00 64.50 C ATOM 1763 C GLY A 900 -9.262 -17.649 4.880 1.00 62.43 C ATOM 1764 O GLY A 900 -9.214 -16.866 5.827 1.00 24.40 O ATOM 0 H GLY A 900 -8.491 -19.152 2.503 1.00 10.40 H new ATOM 0 HA2 GLY A 900 -7.415 -17.514 3.774 1.00 64.50 H new ATOM 0 HA3 GLY A 900 -8.612 -16.321 3.310 1.00 64.50 H new ATOM 1768 N VAL A 901 -9.964 -18.773 4.870 1.00 55.35 N ATOM 1769 CA VAL A 901 -10.756 -19.171 6.021 1.00 0.32 C ATOM 1770 C VAL A 901 -9.859 -19.900 7.023 1.00 32.43 C ATOM 1771 O VAL A 901 -9.347 -20.980 6.732 1.00 32.20 O ATOM 1772 CB VAL A 901 -11.953 -20.010 5.569 1.00 40.51 C ATOM 1773 CG1 VAL A 901 -12.926 -20.245 6.726 1.00 40.01 C ATOM 1774 CG2 VAL A 901 -12.662 -19.357 4.380 1.00 22.13 C ATOM 0 H VAL A 901 -10.001 -19.420 4.083 1.00 55.35 H new ATOM 0 HA VAL A 901 -11.163 -18.295 6.526 1.00 0.32 H new ATOM 0 HB VAL A 901 -11.579 -20.981 5.244 1.00 40.51 H new ATOM 0 HG11 VAL A 901 -13.768 -20.844 6.378 1.00 40.01 H new ATOM 0 HG12 VAL A 901 -12.414 -20.772 7.531 1.00 40.01 H new ATOM 0 HG13 VAL A 901 -13.291 -19.286 7.095 1.00 40.01 H new ATOM 0 HG21 VAL A 901 -13.509 -19.973 4.078 1.00 22.13 H new ATOM 0 HG22 VAL A 901 -13.017 -18.367 4.667 1.00 22.13 H new ATOM 0 HG23 VAL A 901 -11.965 -19.265 3.547 1.00 22.13 H new ATOM 1784 N GLN A 902 -9.696 -19.281 8.183 1.00 34.43 N ATOM 1785 CA GLN A 902 -8.870 -19.858 9.230 1.00 34.52 C ATOM 1786 C GLN A 902 -9.733 -20.667 10.202 1.00 44.31 C ATOM 1787 O GLN A 902 -10.881 -20.310 10.462 1.00 22.52 O ATOM 1788 CB GLN A 902 -8.083 -18.774 9.968 1.00 50.31 C ATOM 1789 CG GLN A 902 -9.002 -17.631 10.406 1.00 22.40 C ATOM 1790 CD GLN A 902 -8.494 -16.983 11.696 1.00 71.34 C ATOM 1791 OE1 GLN A 902 -9.255 -16.574 12.557 1.00 54.34 O ATOM 1792 NE2 GLN A 902 -7.169 -16.914 11.781 1.00 44.44 N ATOM 0 H GLN A 902 -10.122 -18.385 8.421 1.00 34.43 H new ATOM 0 HA GLN A 902 -8.149 -20.532 8.767 1.00 34.52 H new ATOM 0 HB2 GLN A 902 -7.593 -19.206 10.840 1.00 50.31 H new ATOM 0 HB3 GLN A 902 -7.297 -18.386 9.320 1.00 50.31 H new ATOM 0 HG2 GLN A 902 -9.058 -16.882 9.616 1.00 22.40 H new ATOM 0 HG3 GLN A 902 -10.013 -18.010 10.559 1.00 22.40 H new ATOM 0 HE21 GLN A 902 -6.590 -17.276 11.023 1.00 44.44 H new ATOM 0 HE22 GLN A 902 -6.732 -16.499 12.604 1.00 44.44 H new ATOM 1801 N THR A 903 -9.146 -21.740 10.712 1.00 40.34 N ATOM 1802 CA THR A 903 -9.846 -22.601 11.649 1.00 73.41 C ATOM 1803 C THR A 903 -8.849 -23.317 12.562 1.00 34.52 C ATOM 1804 O THR A 903 -7.753 -23.674 12.132 1.00 35.03 O ATOM 1805 CB THR A 903 -10.728 -23.558 10.844 1.00 51.24 C ATOM 1806 OG1 THR A 903 -11.230 -22.754 9.779 1.00 63.40 O ATOM 1807 CG2 THR A 903 -11.981 -23.985 11.610 1.00 14.25 C ATOM 0 H THR A 903 -8.193 -22.032 10.494 1.00 40.34 H new ATOM 0 HA THR A 903 -10.490 -22.023 12.312 1.00 73.41 H new ATOM 0 HB THR A 903 -10.150 -24.442 10.572 1.00 51.24 H new ATOM 0 HG1 THR A 903 -11.812 -23.296 9.206 1.00 63.40 H new ATOM 0 HG21 THR A 903 -12.571 -24.663 10.993 1.00 14.25 H new ATOM 0 HG22 THR A 903 -11.690 -24.492 12.530 1.00 14.25 H new ATOM 0 HG23 THR A 903 -12.576 -23.105 11.853 1.00 14.25 H new ATOM 1815 N LEU A 904 -9.265 -23.507 13.806 1.00 54.42 N ATOM 1816 CA LEU A 904 -8.423 -24.174 14.784 1.00 44.35 C ATOM 1817 C LEU A 904 -9.120 -25.447 15.267 1.00 1.35 C ATOM 1818 O LEU A 904 -10.184 -25.381 15.881 1.00 3.04 O ATOM 1819 CB LEU A 904 -8.047 -23.212 15.912 1.00 5.51 C ATOM 1820 CG LEU A 904 -9.055 -22.100 16.209 1.00 4.43 C ATOM 1821 CD1 LEU A 904 -10.233 -22.632 17.027 1.00 71.22 C ATOM 1822 CD2 LEU A 904 -8.375 -20.911 16.892 1.00 44.15 C ATOM 0 H LEU A 904 -10.175 -23.210 14.159 1.00 54.42 H new ATOM 0 HA LEU A 904 -7.480 -24.480 14.330 1.00 44.35 H new ATOM 0 HB2 LEU A 904 -7.897 -23.792 16.823 1.00 5.51 H new ATOM 0 HB3 LEU A 904 -7.090 -22.752 15.666 1.00 5.51 H new ATOM 0 HG LEU A 904 -9.456 -21.741 15.261 1.00 4.43 H new ATOM 0 HD11 LEU A 904 -10.935 -21.821 17.224 1.00 71.22 H new ATOM 0 HD12 LEU A 904 -10.737 -23.420 16.468 1.00 71.22 H new ATOM 0 HD13 LEU A 904 -9.868 -23.034 17.972 1.00 71.22 H new ATOM 0 HD21 LEU A 904 -9.114 -20.135 17.092 1.00 44.15 H new ATOM 0 HD22 LEU A 904 -7.928 -21.238 17.831 1.00 44.15 H new ATOM 0 HD23 LEU A 904 -7.598 -20.513 16.240 1.00 44.15 H new ATOM 1834 N TYR A 905 -8.492 -26.576 14.973 1.00 51.42 N ATOM 1835 CA TYR A 905 -9.039 -27.862 15.370 1.00 1.21 C ATOM 1836 C TYR A 905 -9.095 -27.986 16.894 1.00 35.41 C ATOM 1837 O TYR A 905 -8.749 -27.048 17.610 1.00 34.34 O ATOM 1838 CB TYR A 905 -8.078 -28.917 14.819 1.00 24.05 C ATOM 1839 CG TYR A 905 -8.263 -29.211 13.329 1.00 11.45 C ATOM 1840 CD1 TYR A 905 -8.882 -28.284 12.515 1.00 11.04 C ATOM 1841 CD2 TYR A 905 -7.811 -30.402 12.799 1.00 34.24 C ATOM 1842 CE1 TYR A 905 -9.057 -28.560 11.113 1.00 63.30 C ATOM 1843 CE2 TYR A 905 -7.986 -30.679 11.397 1.00 1.40 C ATOM 1844 CZ TYR A 905 -8.600 -29.744 10.623 1.00 10.00 C ATOM 1845 OH TYR A 905 -8.765 -30.005 9.299 1.00 61.05 O ATOM 0 H TYR A 905 -7.609 -26.627 14.464 1.00 51.42 H new ATOM 0 HA TYR A 905 -10.054 -27.982 14.990 1.00 1.21 H new ATOM 0 HB2 TYR A 905 -7.054 -28.584 14.989 1.00 24.05 H new ATOM 0 HB3 TYR A 905 -8.210 -29.842 15.380 1.00 24.05 H new ATOM 0 HD1 TYR A 905 -9.235 -27.351 12.930 1.00 11.04 H new ATOM 0 HD2 TYR A 905 -7.326 -31.127 13.436 1.00 34.24 H new ATOM 0 HE1 TYR A 905 -9.540 -27.844 10.465 1.00 63.30 H new ATOM 0 HE2 TYR A 905 -7.638 -31.608 10.970 1.00 1.40 H new ATOM 0 HH TYR A 905 -7.889 -30.139 8.880 1.00 61.05 H new ATOM 1855 N SER A 906 -9.534 -29.152 17.345 1.00 74.54 N ATOM 1856 CA SER A 906 -9.641 -29.412 18.770 1.00 2.14 C ATOM 1857 C SER A 906 -8.708 -30.559 19.164 1.00 11.05 C ATOM 1858 O SER A 906 -7.889 -30.414 20.070 1.00 22.34 O ATOM 1859 CB SER A 906 -11.082 -29.740 19.164 1.00 31.43 C ATOM 1860 OG SER A 906 -11.898 -28.574 19.225 1.00 52.30 O ATOM 0 H SER A 906 -9.820 -29.928 16.748 1.00 74.54 H new ATOM 0 HA SER A 906 -9.344 -28.510 19.305 1.00 2.14 H new ATOM 0 HB2 SER A 906 -11.504 -30.440 18.443 1.00 31.43 H new ATOM 0 HB3 SER A 906 -11.088 -30.238 20.134 1.00 31.43 H new ATOM 0 HG SER A 906 -12.811 -28.826 19.478 1.00 52.30 H new ATOM 1866 N LYS A 907 -8.864 -31.673 18.464 1.00 11.05 N ATOM 1867 CA LYS A 907 -8.046 -32.844 18.730 1.00 72.31 C ATOM 1868 C LYS A 907 -7.434 -33.341 17.419 1.00 61.13 C ATOM 1869 O LYS A 907 -7.942 -33.042 16.339 1.00 12.24 O ATOM 1870 CB LYS A 907 -8.858 -33.908 19.471 1.00 33.13 C ATOM 1871 CG LYS A 907 -7.943 -34.838 20.271 1.00 53.11 C ATOM 1872 CD LYS A 907 -7.191 -34.066 21.357 1.00 35.12 C ATOM 1873 CE LYS A 907 -8.125 -33.100 22.089 1.00 32.34 C ATOM 1874 NZ LYS A 907 -9.356 -33.798 22.523 1.00 32.21 N ATOM 0 H LYS A 907 -9.545 -31.789 17.713 1.00 11.05 H new ATOM 0 HA LYS A 907 -7.219 -32.588 19.392 1.00 72.31 H new ATOM 0 HB2 LYS A 907 -9.569 -33.426 20.142 1.00 33.13 H new ATOM 0 HB3 LYS A 907 -9.439 -34.490 18.756 1.00 33.13 H new ATOM 0 HG2 LYS A 907 -8.535 -35.632 20.727 1.00 53.11 H new ATOM 0 HG3 LYS A 907 -7.230 -35.317 19.600 1.00 53.11 H new ATOM 0 HD2 LYS A 907 -6.755 -34.766 22.070 1.00 35.12 H new ATOM 0 HD3 LYS A 907 -6.366 -33.511 20.909 1.00 35.12 H new ATOM 0 HE2 LYS A 907 -7.615 -32.678 22.955 1.00 32.34 H new ATOM 0 HE3 LYS A 907 -8.383 -32.268 21.434 1.00 32.34 H new ATOM 0 HZ1 LYS A 907 -9.530 -33.601 23.529 1.00 32.21 H new ATOM 0 HZ2 LYS A 907 -10.163 -33.461 21.960 1.00 32.21 H new ATOM 0 HZ3 LYS A 907 -9.241 -34.822 22.385 1.00 32.21 H new ATOM 1887 N TRP A 908 -6.351 -34.092 17.556 1.00 42.24 N ATOM 1888 CA TRP A 908 -5.664 -34.633 16.395 1.00 22.12 C ATOM 1889 C TRP A 908 -6.576 -35.679 15.751 1.00 51.33 C ATOM 1890 O TRP A 908 -6.531 -35.885 14.539 1.00 25.10 O ATOM 1891 CB TRP A 908 -4.293 -35.192 16.781 1.00 20.21 C ATOM 1892 CG TRP A 908 -3.496 -34.290 17.725 1.00 12.25 C ATOM 1893 CD1 TRP A 908 -2.576 -33.369 17.406 1.00 34.14 C ATOM 1894 CD2 TRP A 908 -3.587 -34.259 19.166 1.00 63.34 C ATOM 1895 NE1 TRP A 908 -2.069 -32.750 18.531 1.00 54.23 N ATOM 1896 CE2 TRP A 908 -2.703 -33.308 19.634 1.00 35.44 C ATOM 1897 CE3 TRP A 908 -4.389 -35.010 20.043 1.00 63.21 C ATOM 1898 CZ2 TRP A 908 -2.538 -33.021 20.994 1.00 4.55 C ATOM 1899 CZ3 TRP A 908 -4.211 -34.711 21.399 1.00 40.40 C ATOM 1900 CH2 TRP A 908 -3.326 -33.756 21.887 1.00 20.41 C ATOM 0 H TRP A 908 -5.932 -34.339 18.453 1.00 42.24 H new ATOM 0 HA TRP A 908 -5.464 -33.849 15.665 1.00 22.12 H new ATOM 0 HB2 TRP A 908 -4.429 -36.165 17.253 1.00 20.21 H new ATOM 0 HB3 TRP A 908 -3.711 -35.356 15.874 1.00 20.21 H new ATOM 0 HD1 TRP A 908 -2.270 -33.140 16.396 1.00 34.14 H new ATOM 0 HE1 TRP A 908 -1.359 -32.018 18.549 1.00 54.23 H new ATOM 0 HE3 TRP A 908 -5.087 -35.758 19.698 1.00 63.21 H new ATOM 0 HZ2 TRP A 908 -1.839 -32.272 21.336 1.00 4.55 H new ATOM 0 HZ3 TRP A 908 -4.802 -35.261 22.116 1.00 40.40 H new ATOM 0 HH2 TRP A 908 -3.247 -33.582 22.950 1.00 20.41 H new ATOM 1911 N LYS A 909 -7.383 -36.311 16.590 1.00 53.11 N ATOM 1912 CA LYS A 909 -8.305 -37.330 16.117 1.00 22.12 C ATOM 1913 C LYS A 909 -8.975 -36.847 14.830 1.00 75.45 C ATOM 1914 O LYS A 909 -9.342 -37.654 13.977 1.00 74.15 O ATOM 1915 CB LYS A 909 -9.294 -37.711 17.220 1.00 11.04 C ATOM 1916 CG LYS A 909 -10.482 -36.747 17.248 1.00 33.30 C ATOM 1917 CD LYS A 909 -11.402 -37.044 18.434 1.00 23.44 C ATOM 1918 CE LYS A 909 -12.850 -36.672 18.112 1.00 12.11 C ATOM 1919 NZ LYS A 909 -13.350 -37.473 16.972 1.00 42.40 N ATOM 0 H LYS A 909 -7.418 -36.137 17.595 1.00 53.11 H new ATOM 0 HA LYS A 909 -7.768 -38.246 15.872 1.00 22.12 H new ATOM 0 HB2 LYS A 909 -9.650 -38.728 17.058 1.00 11.04 H new ATOM 0 HB3 LYS A 909 -8.789 -37.700 18.186 1.00 11.04 H new ATOM 0 HG2 LYS A 909 -10.121 -35.721 17.312 1.00 33.30 H new ATOM 0 HG3 LYS A 909 -11.044 -36.830 16.318 1.00 33.30 H new ATOM 0 HD2 LYS A 909 -11.343 -38.102 18.688 1.00 23.44 H new ATOM 0 HD3 LYS A 909 -11.066 -36.487 19.308 1.00 23.44 H new ATOM 0 HE2 LYS A 909 -13.478 -36.842 18.986 1.00 12.11 H new ATOM 0 HE3 LYS A 909 -12.915 -35.610 17.874 1.00 12.11 H new ATOM 0 HZ1 LYS A 909 -14.376 -37.613 17.069 1.00 42.40 H new ATOM 0 HZ2 LYS A 909 -13.152 -36.972 16.082 1.00 42.40 H new ATOM 0 HZ3 LYS A 909 -12.874 -38.398 16.962 1.00 42.40 H new ATOM 1932 N ASP A 910 -9.115 -35.534 14.729 1.00 11.34 N ATOM 1933 CA ASP A 910 -9.735 -34.934 13.560 1.00 32.01 C ATOM 1934 C ASP A 910 -8.645 -34.471 12.591 1.00 13.34 C ATOM 1935 O ASP A 910 -8.706 -33.359 12.069 1.00 3.43 O ATOM 1936 CB ASP A 910 -10.574 -33.714 13.946 1.00 32.32 C ATOM 1937 CG ASP A 910 -11.488 -33.182 12.841 1.00 75.22 C ATOM 1938 OD1 ASP A 910 -12.611 -33.672 12.650 1.00 73.34 O ATOM 1939 OD2 ASP A 910 -10.999 -32.209 12.150 1.00 61.24 O ATOM 0 H ASP A 910 -8.809 -34.868 15.438 1.00 11.34 H new ATOM 0 HA ASP A 910 -10.379 -35.683 13.098 1.00 32.01 H new ATOM 0 HB2 ASP A 910 -11.186 -33.972 14.810 1.00 32.32 H new ATOM 0 HB3 ASP A 910 -9.903 -32.914 14.258 1.00 32.32 H new ATOM 1945 N PHE A 911 -7.674 -35.347 12.381 1.00 51.14 N ATOM 1946 CA PHE A 911 -6.572 -35.042 11.484 1.00 53.41 C ATOM 1947 C PHE A 911 -6.998 -35.189 10.022 1.00 54.42 C ATOM 1948 O PHE A 911 -7.647 -36.168 9.656 1.00 51.40 O ATOM 1949 CB PHE A 911 -5.460 -36.049 11.782 1.00 33.15 C ATOM 1950 CG PHE A 911 -5.857 -37.506 11.533 1.00 11.33 C ATOM 1951 CD1 PHE A 911 -5.778 -38.027 10.280 1.00 70.04 C ATOM 1952 CD2 PHE A 911 -6.289 -38.279 12.565 1.00 2.03 C ATOM 1953 CE1 PHE A 911 -6.146 -39.379 10.048 1.00 13.24 C ATOM 1954 CE2 PHE A 911 -6.657 -39.631 12.334 1.00 11.31 C ATOM 1955 CZ PHE A 911 -6.578 -40.152 11.080 1.00 31.14 C ATOM 0 H PHE A 911 -7.627 -36.268 12.816 1.00 51.14 H new ATOM 0 HA PHE A 911 -6.242 -34.014 11.637 1.00 53.41 H new ATOM 0 HB2 PHE A 911 -4.592 -35.809 11.167 1.00 33.15 H new ATOM 0 HB3 PHE A 911 -5.154 -35.939 12.822 1.00 33.15 H new ATOM 0 HD1 PHE A 911 -5.435 -37.413 9.461 1.00 70.04 H new ATOM 0 HD2 PHE A 911 -6.352 -37.865 13.560 1.00 2.03 H new ATOM 0 HE1 PHE A 911 -6.083 -39.793 9.052 1.00 13.24 H new ATOM 0 HE2 PHE A 911 -6.999 -40.245 13.154 1.00 11.31 H new ATOM 0 HZ PHE A 911 -6.858 -41.180 10.904 1.00 31.14 H new ATOM 1965 N HIS A 912 -6.616 -34.201 9.225 1.00 34.22 N ATOM 1966 CA HIS A 912 -6.951 -34.208 7.811 1.00 22.42 C ATOM 1967 C HIS A 912 -5.679 -34.408 6.984 1.00 32.41 C ATOM 1968 O HIS A 912 -5.678 -34.181 5.775 1.00 12.34 O ATOM 1969 CB HIS A 912 -7.714 -32.939 7.427 1.00 34.52 C ATOM 1970 CG HIS A 912 -9.196 -33.005 7.710 1.00 74.31 C ATOM 1971 ND1 HIS A 912 -10.119 -33.446 6.777 1.00 42.32 N ATOM 1972 CD2 HIS A 912 -9.905 -32.683 8.830 1.00 72.22 C ATOM 1973 CE1 HIS A 912 -11.325 -33.386 7.321 1.00 32.21 C ATOM 1974 NE2 HIS A 912 -11.191 -32.913 8.593 1.00 1.12 N ATOM 0 H HIS A 912 -6.078 -33.391 9.532 1.00 34.22 H new ATOM 0 HA HIS A 912 -7.618 -35.042 7.596 1.00 22.42 H new ATOM 0 HB2 HIS A 912 -7.288 -32.094 7.968 1.00 34.52 H new ATOM 0 HB3 HIS A 912 -7.565 -32.745 6.365 1.00 34.52 H new ATOM 0 HD2 HIS A 912 -9.491 -32.305 9.753 1.00 72.22 H new ATOM 0 HE1 HIS A 912 -12.252 -33.663 6.841 1.00 32.21 H new ATOM 0 HE2 HIS A 912 -11.953 -32.761 9.254 1.00 1.12 H new ATOM 1982 N PHE A 913 -4.627 -34.832 7.669 1.00 71.12 N ATOM 1983 CA PHE A 913 -3.352 -35.065 7.013 1.00 63.42 C ATOM 1984 C PHE A 913 -3.072 -36.563 6.875 1.00 61.31 C ATOM 1985 O PHE A 913 -3.933 -37.389 7.174 1.00 70.35 O ATOM 1986 CB PHE A 913 -2.273 -34.436 7.896 1.00 24.33 C ATOM 1987 CG PHE A 913 -2.632 -33.045 8.423 1.00 72.35 C ATOM 1988 CD1 PHE A 913 -3.332 -32.917 9.582 1.00 44.22 C ATOM 1989 CD2 PHE A 913 -2.252 -31.938 7.731 1.00 54.40 C ATOM 1990 CE1 PHE A 913 -3.665 -31.626 10.070 1.00 13.12 C ATOM 1991 CE2 PHE A 913 -2.586 -30.647 8.219 1.00 12.43 C ATOM 1992 CZ PHE A 913 -3.286 -30.518 9.379 1.00 64.03 C ATOM 0 H PHE A 913 -4.632 -35.020 8.671 1.00 71.12 H new ATOM 0 HA PHE A 913 -3.363 -34.631 6.013 1.00 63.42 H new ATOM 0 HB2 PHE A 913 -2.081 -35.095 8.742 1.00 24.33 H new ATOM 0 HB3 PHE A 913 -1.346 -34.369 7.327 1.00 24.33 H new ATOM 0 HD1 PHE A 913 -3.634 -33.797 10.131 1.00 44.22 H new ATOM 0 HD2 PHE A 913 -1.696 -32.041 6.811 1.00 54.40 H new ATOM 0 HE1 PHE A 913 -4.220 -31.524 10.991 1.00 13.12 H new ATOM 0 HE2 PHE A 913 -2.285 -29.767 7.670 1.00 12.43 H new ATOM 0 HZ PHE A 913 -3.540 -29.536 9.750 1.00 64.03 H new ATOM 2002 N GLU A 914 -1.865 -36.868 6.422 1.00 24.13 N ATOM 2003 CA GLU A 914 -1.461 -38.252 6.241 1.00 24.02 C ATOM 2004 C GLU A 914 -0.014 -38.447 6.701 1.00 35.41 C ATOM 2005 O GLU A 914 0.742 -37.484 6.808 1.00 43.52 O ATOM 2006 CB GLU A 914 -1.637 -38.689 4.785 1.00 4.44 C ATOM 2007 CG GLU A 914 -0.476 -38.193 3.920 1.00 12.32 C ATOM 2008 CD GLU A 914 -0.710 -38.527 2.446 1.00 51.15 C ATOM 2009 OE1 GLU A 914 -1.312 -37.725 1.716 1.00 42.11 O ATOM 2010 OE2 GLU A 914 -0.241 -39.666 2.064 1.00 65.15 O ATOM 0 H GLU A 914 -1.153 -36.180 6.175 1.00 24.13 H new ATOM 0 HA GLU A 914 -2.105 -38.881 6.855 1.00 24.02 H new ATOM 0 HB2 GLU A 914 -1.696 -39.776 4.732 1.00 4.44 H new ATOM 0 HB3 GLU A 914 -2.578 -38.300 4.396 1.00 4.44 H new ATOM 0 HG2 GLU A 914 -0.363 -37.115 4.039 1.00 12.32 H new ATOM 0 HG3 GLU A 914 0.454 -38.650 4.257 1.00 12.32 H new ATOM 2018 N LYS A 915 0.326 -39.701 6.961 1.00 31.12 N ATOM 2019 CA LYS A 915 1.668 -40.035 7.407 1.00 31.12 C ATOM 2020 C LYS A 915 2.649 -39.837 6.250 1.00 23.22 C ATOM 2021 O LYS A 915 2.459 -40.391 5.168 1.00 11.05 O ATOM 2022 CB LYS A 915 1.699 -41.443 8.006 1.00 53.22 C ATOM 2023 CG LYS A 915 1.358 -42.496 6.949 1.00 11.41 C ATOM 2024 CD LYS A 915 2.621 -42.993 6.243 1.00 0.22 C ATOM 2025 CE LYS A 915 2.350 -43.268 4.763 1.00 54.32 C ATOM 2026 NZ LYS A 915 3.248 -44.331 4.260 1.00 35.52 N ATOM 0 H LYS A 915 -0.304 -40.498 6.871 1.00 31.12 H new ATOM 0 HA LYS A 915 1.981 -39.366 8.209 1.00 31.12 H new ATOM 0 HB2 LYS A 915 2.687 -41.644 8.420 1.00 53.22 H new ATOM 0 HB3 LYS A 915 0.989 -41.507 8.831 1.00 53.22 H new ATOM 0 HG2 LYS A 915 0.845 -43.335 7.419 1.00 11.41 H new ATOM 0 HG3 LYS A 915 0.671 -42.072 6.217 1.00 11.41 H new ATOM 0 HD2 LYS A 915 3.412 -42.249 6.339 1.00 0.22 H new ATOM 0 HD3 LYS A 915 2.978 -43.903 6.726 1.00 0.22 H new ATOM 0 HE2 LYS A 915 1.311 -43.567 4.627 1.00 54.32 H new ATOM 0 HE3 LYS A 915 2.497 -42.356 4.185 1.00 54.32 H new ATOM 0 HZ1 LYS A 915 3.051 -44.505 3.254 1.00 35.52 H new ATOM 0 HZ2 LYS A 915 4.238 -44.031 4.372 1.00 35.52 H new ATOM 0 HZ3 LYS A 915 3.088 -45.205 4.800 1.00 35.52 H new ATOM 2039 N ILE A 916 3.678 -39.046 6.517 1.00 13.14 N ATOM 2040 CA ILE A 916 4.689 -38.768 5.512 1.00 3.00 C ATOM 2041 C ILE A 916 6.077 -38.880 6.146 1.00 20.44 C ATOM 2042 O ILE A 916 6.281 -38.455 7.282 1.00 14.42 O ATOM 2043 CB ILE A 916 4.425 -37.416 4.846 1.00 63.23 C ATOM 2044 CG1 ILE A 916 2.977 -37.317 4.362 1.00 42.02 C ATOM 2045 CG2 ILE A 916 5.426 -37.156 3.718 1.00 73.44 C ATOM 2046 CD1 ILE A 916 2.579 -35.860 4.119 1.00 12.21 C ATOM 0 H ILE A 916 3.833 -38.589 7.416 1.00 13.14 H new ATOM 0 HA ILE A 916 4.643 -39.506 4.712 1.00 3.00 H new ATOM 0 HB ILE A 916 4.569 -36.634 5.591 1.00 63.23 H new ATOM 0 HG12 ILE A 916 2.857 -37.889 3.442 1.00 42.02 H new ATOM 0 HG13 ILE A 916 2.311 -37.761 5.102 1.00 42.02 H new ATOM 0 HG21 ILE A 916 5.216 -36.189 3.261 1.00 73.44 H new ATOM 0 HG22 ILE A 916 6.438 -37.154 4.123 1.00 73.44 H new ATOM 0 HG23 ILE A 916 5.338 -37.939 2.965 1.00 73.44 H new ATOM 0 HD11 ILE A 916 1.545 -35.818 3.776 1.00 12.21 H new ATOM 0 HD12 ILE A 916 2.677 -35.297 5.047 1.00 12.21 H new ATOM 0 HD13 ILE A 916 3.231 -35.426 3.361 1.00 12.21 H new ATOM 2058 N PRO A 917 7.020 -39.471 5.365 1.00 62.13 N ATOM 2059 CA PRO A 917 8.383 -39.645 5.838 1.00 11.20 C ATOM 2060 C PRO A 917 9.145 -38.318 5.815 1.00 72.21 C ATOM 2061 O PRO A 917 9.207 -37.652 4.783 1.00 50.12 O ATOM 2062 CB PRO A 917 8.988 -40.693 4.919 1.00 31.51 C ATOM 2063 CG PRO A 917 8.101 -40.728 3.685 1.00 32.11 C ATOM 2064 CD PRO A 917 6.815 -39.987 4.014 1.00 21.35 C ATOM 0 HA PRO A 917 8.429 -39.972 6.877 1.00 11.20 H new ATOM 0 HB2 PRO A 917 10.014 -40.436 4.655 1.00 31.51 H new ATOM 0 HB3 PRO A 917 9.019 -41.668 5.405 1.00 31.51 H new ATOM 0 HG2 PRO A 917 8.605 -40.261 2.839 1.00 32.11 H new ATOM 0 HG3 PRO A 917 7.886 -41.757 3.399 1.00 32.11 H new ATOM 0 HD2 PRO A 917 6.631 -39.180 3.305 1.00 21.35 H new ATOM 0 HD3 PRO A 917 5.952 -40.652 3.971 1.00 21.35 H new ATOM 2072 N PHE A 918 9.706 -37.974 6.965 1.00 75.40 N ATOM 2073 CA PHE A 918 10.461 -36.739 7.090 1.00 70.54 C ATOM 2074 C PHE A 918 11.681 -36.747 6.166 1.00 31.32 C ATOM 2075 O PHE A 918 12.546 -37.614 6.282 1.00 2.13 O ATOM 2076 CB PHE A 918 10.936 -36.650 8.541 1.00 34.13 C ATOM 2077 CG PHE A 918 11.059 -35.219 9.069 1.00 60.23 C ATOM 2078 CD1 PHE A 918 9.957 -34.564 9.521 1.00 14.24 C ATOM 2079 CD2 PHE A 918 12.271 -34.603 9.085 1.00 41.53 C ATOM 2080 CE1 PHE A 918 10.071 -33.236 10.011 1.00 42.22 C ATOM 2081 CE2 PHE A 918 12.386 -33.274 9.574 1.00 34.40 C ATOM 2082 CZ PHE A 918 11.283 -32.619 10.027 1.00 62.12 C ATOM 0 H PHE A 918 9.653 -38.529 7.819 1.00 75.40 H new ATOM 0 HA PHE A 918 9.835 -35.890 6.814 1.00 70.54 H new ATOM 0 HB2 PHE A 918 10.241 -37.202 9.174 1.00 34.13 H new ATOM 0 HB3 PHE A 918 11.905 -37.142 8.626 1.00 34.13 H new ATOM 0 HD1 PHE A 918 8.994 -35.054 9.507 1.00 14.24 H new ATOM 0 HD2 PHE A 918 13.146 -35.124 8.726 1.00 41.53 H new ATOM 0 HE1 PHE A 918 9.195 -32.716 10.371 1.00 42.22 H new ATOM 0 HE2 PHE A 918 13.348 -32.784 9.586 1.00 34.40 H new ATOM 0 HZ PHE A 918 11.370 -31.609 10.399 1.00 62.12 H new ATOM 2092 N ASP A 919 11.711 -35.772 5.270 1.00 60.11 N ATOM 2093 CA ASP A 919 12.811 -35.656 4.327 1.00 14.21 C ATOM 2094 C ASP A 919 13.839 -34.662 4.870 1.00 41.41 C ATOM 2095 O ASP A 919 13.489 -33.545 5.247 1.00 11.45 O ATOM 2096 CB ASP A 919 12.322 -35.139 2.973 1.00 43.44 C ATOM 2097 CG ASP A 919 11.896 -36.223 1.982 1.00 73.53 C ATOM 2098 OD1 ASP A 919 11.474 -37.320 2.378 1.00 65.41 O ATOM 2099 OD2 ASP A 919 12.011 -35.902 0.738 1.00 42.42 O ATOM 0 H ASP A 919 10.992 -35.055 5.177 1.00 60.11 H new ATOM 0 HA ASP A 919 13.251 -36.645 4.198 1.00 14.21 H new ATOM 0 HB2 ASP A 919 11.479 -34.469 3.140 1.00 43.44 H new ATOM 0 HB3 ASP A 919 13.116 -34.545 2.520 1.00 43.44 H new ATOM 2105 N PRO A 920 15.121 -35.116 4.892 1.00 11.54 N ATOM 2106 CA PRO A 920 16.203 -34.279 5.383 1.00 53.43 C ATOM 2107 C PRO A 920 16.566 -33.199 4.362 1.00 44.43 C ATOM 2108 O PRO A 920 17.214 -32.210 4.703 1.00 52.23 O ATOM 2109 CB PRO A 920 17.347 -35.239 5.664 1.00 34.23 C ATOM 2110 CG PRO A 920 17.027 -36.507 4.889 1.00 41.35 C ATOM 2111 CD PRO A 920 15.573 -36.433 4.453 1.00 13.42 C ATOM 0 HA PRO A 920 15.933 -33.728 6.284 1.00 53.43 H new ATOM 0 HB2 PRO A 920 18.299 -34.816 5.344 1.00 34.23 H new ATOM 0 HB3 PRO A 920 17.431 -35.444 6.731 1.00 34.23 H new ATOM 0 HG2 PRO A 920 17.681 -36.600 4.022 1.00 41.35 H new ATOM 0 HG3 PRO A 920 17.195 -37.387 5.510 1.00 41.35 H new ATOM 0 HD2 PRO A 920 15.477 -36.545 3.373 1.00 13.42 H new ATOM 0 HD3 PRO A 920 14.982 -37.227 4.909 1.00 13.42 H new ATOM 2119 N ALA A 921 16.134 -33.424 3.130 1.00 61.31 N ATOM 2120 CA ALA A 921 16.406 -32.483 2.057 1.00 11.20 C ATOM 2121 C ALA A 921 15.679 -31.167 2.343 1.00 72.25 C ATOM 2122 O ALA A 921 16.075 -30.114 1.845 1.00 22.25 O ATOM 2123 CB ALA A 921 15.992 -33.099 0.719 1.00 30.44 C ATOM 0 H ALA A 921 15.597 -34.245 2.851 1.00 61.31 H new ATOM 0 HA ALA A 921 17.472 -32.265 1.999 1.00 11.20 H new ATOM 0 HB1 ALA A 921 16.196 -32.393 -0.086 1.00 30.44 H new ATOM 0 HB2 ALA A 921 16.558 -34.015 0.550 1.00 30.44 H new ATOM 0 HB3 ALA A 921 14.927 -33.329 0.738 1.00 30.44 H new ATOM 2129 N GLU A 922 14.628 -31.271 3.142 1.00 15.41 N ATOM 2130 CA GLU A 922 13.841 -30.102 3.500 1.00 64.13 C ATOM 2131 C GLU A 922 14.400 -29.454 4.768 1.00 64.10 C ATOM 2132 O GLU A 922 14.209 -28.261 4.996 1.00 52.42 O ATOM 2133 CB GLU A 922 12.366 -30.467 3.675 1.00 51.51 C ATOM 2134 CG GLU A 922 11.980 -31.641 2.774 1.00 64.25 C ATOM 2135 CD GLU A 922 10.504 -31.567 2.377 1.00 24.15 C ATOM 2136 OE1 GLU A 922 9.624 -31.648 3.247 1.00 23.13 O ATOM 2137 OE2 GLU A 922 10.285 -31.419 1.115 1.00 45.41 O ATOM 0 H GLU A 922 14.302 -32.146 3.552 1.00 15.41 H new ATOM 0 HA GLU A 922 13.908 -29.380 2.687 1.00 64.13 H new ATOM 0 HB2 GLU A 922 12.173 -30.725 4.716 1.00 51.51 H new ATOM 0 HB3 GLU A 922 11.744 -29.604 3.439 1.00 51.51 H new ATOM 0 HG2 GLU A 922 12.602 -31.636 1.879 1.00 64.25 H new ATOM 0 HG3 GLU A 922 12.174 -32.580 3.292 1.00 64.25 H new ATOM 2145 N MET A 923 15.081 -30.269 5.560 1.00 34.53 N ATOM 2146 CA MET A 923 15.669 -29.791 6.800 1.00 53.43 C ATOM 2147 C MET A 923 16.755 -28.749 6.525 1.00 63.15 C ATOM 2148 O MET A 923 16.826 -27.726 7.204 1.00 70.11 O ATOM 2149 CB MET A 923 16.273 -30.968 7.567 1.00 71.42 C ATOM 2150 CG MET A 923 15.178 -31.833 8.195 1.00 0.24 C ATOM 2151 SD MET A 923 15.912 -33.115 9.197 1.00 62.23 S ATOM 2152 CE MET A 923 15.482 -32.522 10.824 1.00 2.14 C ATOM 0 H MET A 923 15.239 -31.258 5.367 1.00 34.53 H new ATOM 0 HA MET A 923 14.885 -29.323 7.395 1.00 53.43 H new ATOM 0 HB2 MET A 923 16.878 -31.574 6.893 1.00 71.42 H new ATOM 0 HB3 MET A 923 16.939 -30.596 8.346 1.00 71.42 H new ATOM 0 HG2 MET A 923 14.520 -31.215 8.806 1.00 0.24 H new ATOM 0 HG3 MET A 923 14.562 -32.278 7.414 1.00 0.24 H new ATOM 0 HE1 MET A 923 16.339 -32.630 11.489 1.00 2.14 H new ATOM 0 HE2 MET A 923 15.199 -31.471 10.765 1.00 2.14 H new ATOM 0 HE3 MET A 923 14.645 -33.102 11.213 1.00 2.14 H new ATOM 2162 N SER A 924 17.575 -29.045 5.527 1.00 61.42 N ATOM 2163 CA SER A 924 18.655 -28.147 5.153 1.00 32.54 C ATOM 2164 C SER A 924 19.134 -28.466 3.736 1.00 71.32 C ATOM 2165 O SER A 924 18.788 -29.507 3.179 1.00 23.43 O ATOM 2166 CB SER A 924 19.819 -28.245 6.142 1.00 53.24 C ATOM 2167 OG SER A 924 19.644 -27.379 7.260 1.00 53.45 O ATOM 0 H SER A 924 17.513 -29.894 4.966 1.00 61.42 H new ATOM 0 HA SER A 924 18.276 -27.125 5.179 1.00 32.54 H new ATOM 0 HB2 SER A 924 19.912 -29.273 6.491 1.00 53.24 H new ATOM 0 HB3 SER A 924 20.750 -27.996 5.632 1.00 53.24 H new ATOM 0 HG SER A 924 18.692 -27.322 7.484 1.00 53.45 H new ATOM 2173 N LYS A 925 19.923 -27.551 3.192 1.00 15.12 N ATOM 2174 CA LYS A 925 20.453 -27.721 1.850 1.00 33.41 C ATOM 2175 C LYS A 925 21.145 -29.082 1.749 1.00 60.10 C ATOM 2176 O LYS A 925 21.135 -29.711 0.692 1.00 52.32 O ATOM 2177 CB LYS A 925 21.355 -26.543 1.477 1.00 74.34 C ATOM 2178 CG LYS A 925 22.024 -26.774 0.120 1.00 2.23 C ATOM 2179 CD LYS A 925 21.162 -26.223 -1.017 1.00 41.04 C ATOM 2180 CE LYS A 925 19.862 -27.018 -1.155 1.00 23.32 C ATOM 2181 NZ LYS A 925 19.401 -27.018 -2.561 1.00 33.10 N ATOM 0 H LYS A 925 20.208 -26.689 3.657 1.00 15.12 H new ATOM 0 HA LYS A 925 19.646 -27.718 1.118 1.00 33.41 H new ATOM 0 HB2 LYS A 925 20.767 -25.626 1.445 1.00 74.34 H new ATOM 0 HB3 LYS A 925 22.117 -26.407 2.244 1.00 74.34 H new ATOM 0 HG2 LYS A 925 23.002 -26.293 0.106 1.00 2.23 H new ATOM 0 HG3 LYS A 925 22.192 -27.841 -0.030 1.00 2.23 H new ATOM 0 HD2 LYS A 925 20.933 -25.174 -0.829 1.00 41.04 H new ATOM 0 HD3 LYS A 925 21.719 -26.264 -1.953 1.00 41.04 H new ATOM 0 HE2 LYS A 925 20.018 -28.043 -0.817 1.00 23.32 H new ATOM 0 HE3 LYS A 925 19.094 -26.585 -0.514 1.00 23.32 H new ATOM 0 HZ1 LYS A 925 18.518 -27.562 -2.637 1.00 33.10 H new ATOM 0 HZ2 LYS A 925 19.233 -26.040 -2.871 1.00 33.10 H new ATOM 0 HZ3 LYS A 925 20.128 -27.452 -3.165 1.00 33.10 H new