USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=33 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 870 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 871 HIS : no HE2:sc= -1.43 K(o=-1.4,f=-3.2!) USER MOD Single : A 805 ASN : amide:sc= -7.02! C(o=-7!,f=-4.7!) USER MOD Single : A 806 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.202) USER MOD Single : A 807 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 810 CYS SG : rot 159:sc= 0.298! USER MOD Single : A 812 LYS NZ :NH3+ -117:sc= -0.673 (180deg=-3.28!) USER MOD Single : A 813 CYS SG : rot -49:sc= -0.155 USER MOD Single : A 814 LYS NZ :NH3+ -161:sc= -0.0321 (180deg=-0.382) USER MOD Single : A 818 CYS SG : rot -63:sc= -6.49! USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -91:sc= 1.23 USER MOD Single : A 829 CYS SG : rot 31:sc= -0.547 USER MOD Single : A 830 HIS : no HD1:sc= -5.66! C(o=-5.7!,f=-4.8!) USER MOD Single : A 831 TYR OH : rot 165:sc= -0.326 USER MOD Single : A 832 THR OG1 : rot 130:sc= -1 USER MOD Single : A 839 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 841 CYS SG : rot -35:sc= 0 USER MOD Single : A 844 SER OG : rot 180:sc= -0.354 USER MOD Single : A 858 LYS NZ :NH3+ 160:sc= -0.129 (180deg=-0.712) USER MOD Single : A 861 LYS NZ :NH3+ -167:sc= -0.0155 (180deg=-0.235) USER MOD Single : A 864 CYS SG : rot 60:sc= -1.88! USER MOD Single : A 867 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 868 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 869 CYS SG : rot 180:sc= 0 USER MOD Single : A 876 HIS : no HD1:sc= 0.322 K(o=0.32,f=-1.5) USER MOD Single : A 878 LYS NZ :NH3+ -115:sc= -4.47! (180deg=-6.08!) USER MOD Single : A 879 TYR OH : rot 180:sc= 0 USER MOD Single : A 880 LYS NZ :NH3+ -164:sc= -0.141 (180deg=-0.566) USER MOD Single : A 881 THR OG1 : rot 180:sc= -0.735 USER MOD Single : A 888 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 891 SER OG : rot 101:sc= -1.17 USER MOD Single : A 899 THR OG1 : rot 170:sc= -1.84 USER MOD Single : A 902 GLN : amide:sc= -2.68! K(o=-2.7!,f=0) USER MOD Single : A 903 THR OG1 : rot 180:sc= -1.14! USER MOD Single : A 905 TYR OH : rot 180:sc= 0 USER MOD Single : A 906 SER OG : rot 180:sc= -0.232 USER MOD Single : A 907 LYS NZ :NH3+ -133:sc= 0.204 (180deg=0) USER MOD Single : A 909 LYS NZ :NH3+ -160:sc= -0.0134 (180deg=-0.224) USER MOD Single : A 912 HIS : no HD1:sc= -1.55! C(o=-1.5!,f=-4.3!) USER MOD Single : A 915 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 MET CE :methyl -136:sc= -5.5 (180deg=-10.8!) USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 925 LYS NZ :NH3+ 135:sc= -1.01 (180deg=-3.04!) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 -0.050 -26.285 -2.640 1.00 23.43 N ATOM 209 CA ASN A 805 0.632 -25.928 -1.407 1.00 64.44 C ATOM 210 C ASN A 805 -0.244 -24.965 -0.605 1.00 52.20 C ATOM 211 O ASN A 805 -1.135 -24.323 -1.159 1.00 53.10 O ATOM 212 CB ASN A 805 1.962 -25.229 -1.697 1.00 11.24 C ATOM 213 CG ASN A 805 2.412 -24.390 -0.499 1.00 10.11 C ATOM 214 OD1 ASN A 805 2.568 -23.182 -0.577 1.00 61.43 O ATOM 215 ND2 ASN A 805 2.611 -25.095 0.611 1.00 3.01 N ATOM 0 HA ASN A 805 0.820 -26.844 -0.848 1.00 64.44 H new ATOM 0 HB2 ASN A 805 2.724 -25.972 -1.932 1.00 11.24 H new ATOM 0 HB3 ASN A 805 1.858 -24.591 -2.574 1.00 11.24 H new ATOM 0 HD21 ASN A 805 2.913 -24.627 1.465 1.00 3.01 H new ATOM 0 HD22 ASN A 805 2.462 -26.104 0.608 1.00 3.01 H new ATOM 222 N LYS A 806 0.039 -24.894 0.687 1.00 3.13 N ATOM 223 CA LYS A 806 -0.712 -24.019 1.571 1.00 32.34 C ATOM 224 C LYS A 806 0.257 -23.287 2.502 1.00 71.21 C ATOM 225 O LYS A 806 1.291 -23.834 2.881 1.00 5.21 O ATOM 226 CB LYS A 806 -1.797 -24.807 2.309 1.00 24.04 C ATOM 227 CG LYS A 806 -2.362 -23.998 3.479 1.00 71.15 C ATOM 228 CD LYS A 806 -3.861 -24.256 3.650 1.00 45.04 C ATOM 229 CE LYS A 806 -4.127 -25.716 4.022 1.00 5.13 C ATOM 230 NZ LYS A 806 -4.688 -26.452 2.867 1.00 4.42 N ATOM 0 H LYS A 806 0.778 -25.428 1.143 1.00 3.13 H new ATOM 0 HA LYS A 806 -1.238 -23.257 0.996 1.00 32.34 H new ATOM 0 HB2 LYS A 806 -2.600 -25.063 1.617 1.00 24.04 H new ATOM 0 HB3 LYS A 806 -1.383 -25.746 2.677 1.00 24.04 H new ATOM 0 HG2 LYS A 806 -1.837 -24.263 4.397 1.00 71.15 H new ATOM 0 HG3 LYS A 806 -2.189 -22.935 3.308 1.00 71.15 H new ATOM 0 HD2 LYS A 806 -4.260 -23.601 4.424 1.00 45.04 H new ATOM 0 HD3 LYS A 806 -4.384 -24.012 2.725 1.00 45.04 H new ATOM 0 HE2 LYS A 806 -3.200 -26.189 4.347 1.00 5.13 H new ATOM 0 HE3 LYS A 806 -4.820 -25.763 4.862 1.00 5.13 H new ATOM 0 HZ1 LYS A 806 -5.126 -27.336 3.198 1.00 4.42 H new ATOM 0 HZ2 LYS A 806 -5.406 -25.865 2.397 1.00 4.42 H new ATOM 0 HZ3 LYS A 806 -3.927 -26.674 2.194 1.00 4.42 H new ATOM 243 N LYS A 807 -0.113 -22.061 2.843 1.00 63.40 N ATOM 244 CA LYS A 807 0.711 -21.249 3.722 1.00 50.31 C ATOM 245 C LYS A 807 0.190 -21.367 5.156 1.00 63.44 C ATOM 246 O LYS A 807 -1.008 -21.543 5.372 1.00 2.22 O ATOM 247 CB LYS A 807 0.781 -19.808 3.210 1.00 31.43 C ATOM 248 CG LYS A 807 1.441 -18.892 4.242 1.00 11.52 C ATOM 249 CD LYS A 807 1.595 -17.471 3.694 1.00 25.33 C ATOM 250 CE LYS A 807 2.076 -17.493 2.242 1.00 74.32 C ATOM 251 NZ LYS A 807 2.665 -16.187 1.871 1.00 72.20 N ATOM 0 H LYS A 807 -0.972 -21.611 2.527 1.00 63.40 H new ATOM 0 HA LYS A 807 1.738 -21.613 3.725 1.00 50.31 H new ATOM 0 HB2 LYS A 807 1.344 -19.776 2.277 1.00 31.43 H new ATOM 0 HB3 LYS A 807 -0.224 -19.448 2.988 1.00 31.43 H new ATOM 0 HG2 LYS A 807 0.841 -18.872 5.152 1.00 11.52 H new ATOM 0 HG3 LYS A 807 2.419 -19.289 4.513 1.00 11.52 H new ATOM 0 HD2 LYS A 807 0.641 -16.948 3.757 1.00 25.33 H new ATOM 0 HD3 LYS A 807 2.304 -16.916 4.308 1.00 25.33 H new ATOM 0 HE2 LYS A 807 2.815 -18.283 2.110 1.00 74.32 H new ATOM 0 HE3 LYS A 807 1.241 -17.723 1.580 1.00 74.32 H new ATOM 0 HZ1 LYS A 807 2.986 -16.219 0.882 1.00 72.20 H new ATOM 0 HZ2 LYS A 807 1.949 -15.440 1.978 1.00 72.20 H new ATOM 0 HZ3 LYS A 807 3.474 -15.982 2.491 1.00 72.20 H new ATOM 264 N LEU A 808 1.116 -21.267 6.098 1.00 64.13 N ATOM 265 CA LEU A 808 0.766 -21.361 7.505 1.00 71.12 C ATOM 266 C LEU A 808 1.181 -20.072 8.216 1.00 10.15 C ATOM 267 O LEU A 808 2.179 -19.452 7.853 1.00 40.40 O ATOM 268 CB LEU A 808 1.366 -22.625 8.123 1.00 31.51 C ATOM 269 CG LEU A 808 0.734 -23.949 7.689 1.00 72.51 C ATOM 270 CD1 LEU A 808 1.492 -24.558 6.508 1.00 43.33 C ATOM 271 CD2 LEU A 808 0.632 -24.921 8.866 1.00 5.15 C ATOM 0 H LEU A 808 2.109 -21.122 5.914 1.00 64.13 H new ATOM 0 HA LEU A 808 -0.313 -21.458 7.624 1.00 71.12 H new ATOM 0 HB2 LEU A 808 2.428 -22.655 7.880 1.00 31.51 H new ATOM 0 HB3 LEU A 808 1.289 -22.547 9.207 1.00 31.51 H new ATOM 0 HG LEU A 808 -0.282 -23.746 7.350 1.00 72.51 H new ATOM 0 HD11 LEU A 808 1.022 -25.498 6.220 1.00 43.33 H new ATOM 0 HD12 LEU A 808 1.468 -23.867 5.665 1.00 43.33 H new ATOM 0 HD13 LEU A 808 2.527 -24.743 6.796 1.00 43.33 H new ATOM 0 HD21 LEU A 808 0.179 -25.854 8.529 1.00 5.15 H new ATOM 0 HD22 LEU A 808 1.629 -25.122 9.259 1.00 5.15 H new ATOM 0 HD23 LEU A 808 0.015 -24.480 9.649 1.00 5.15 H new ATOM 283 N LEU A 809 0.394 -19.707 9.218 1.00 51.22 N ATOM 284 CA LEU A 809 0.667 -18.503 9.984 1.00 41.32 C ATOM 285 C LEU A 809 0.690 -18.846 11.475 1.00 54.14 C ATOM 286 O LEU A 809 0.222 -19.910 11.877 1.00 23.04 O ATOM 287 CB LEU A 809 -0.329 -17.400 9.622 1.00 54.44 C ATOM 288 CG LEU A 809 0.125 -16.413 8.544 1.00 74.02 C ATOM 289 CD1 LEU A 809 -0.015 -17.023 7.148 1.00 74.31 C ATOM 290 CD2 LEU A 809 -0.624 -15.084 8.666 1.00 32.42 C ATOM 0 H LEU A 809 -0.433 -20.224 9.517 1.00 51.22 H new ATOM 0 HA LEU A 809 1.651 -18.107 9.733 1.00 41.32 H new ATOM 0 HB2 LEU A 809 -1.255 -17.869 9.290 1.00 54.44 H new ATOM 0 HB3 LEU A 809 -0.563 -16.838 10.526 1.00 54.44 H new ATOM 0 HG LEU A 809 1.183 -16.202 8.699 1.00 74.02 H new ATOM 0 HD11 LEU A 809 0.314 -16.301 6.401 1.00 74.31 H new ATOM 0 HD12 LEU A 809 0.599 -17.921 7.080 1.00 74.31 H new ATOM 0 HD13 LEU A 809 -1.058 -17.282 6.967 1.00 74.31 H new ATOM 0 HD21 LEU A 809 -0.282 -14.401 7.888 1.00 32.42 H new ATOM 0 HD22 LEU A 809 -1.694 -15.258 8.552 1.00 32.42 H new ATOM 0 HD23 LEU A 809 -0.430 -14.645 9.645 1.00 32.42 H new ATOM 302 N CYS A 810 1.238 -17.924 12.253 1.00 34.51 N ATOM 303 CA CYS A 810 1.327 -18.116 13.691 1.00 62.23 C ATOM 304 C CYS A 810 0.227 -17.287 14.355 1.00 14.13 C ATOM 305 O CYS A 810 0.330 -16.064 14.437 1.00 12.13 O ATOM 306 CB CYS A 810 2.715 -17.755 14.224 1.00 11.01 C ATOM 307 SG CYS A 810 3.014 -18.605 15.817 1.00 71.22 S ATOM 0 H CYS A 810 1.625 -17.043 11.915 1.00 34.51 H new ATOM 0 HA CYS A 810 1.181 -19.169 13.930 1.00 62.23 H new ATOM 0 HB2 CYS A 810 3.478 -18.042 13.500 1.00 11.01 H new ATOM 0 HB3 CYS A 810 2.793 -16.676 14.358 1.00 11.01 H new ATOM 0 HG CYS A 810 4.293 -18.664 16.044 1.00 71.22 H new ATOM 313 N ARG A 811 -0.802 -17.986 14.813 1.00 41.51 N ATOM 314 CA ARG A 811 -1.921 -17.329 15.468 1.00 44.02 C ATOM 315 C ARG A 811 -1.418 -16.206 16.378 1.00 74.31 C ATOM 316 O ARG A 811 -2.124 -15.225 16.607 1.00 72.33 O ATOM 317 CB ARG A 811 -2.734 -18.324 16.298 1.00 2.02 C ATOM 318 CG ARG A 811 -3.852 -17.614 17.064 1.00 1.02 C ATOM 319 CD ARG A 811 -4.463 -18.536 18.122 1.00 40.44 C ATOM 320 NE ARG A 811 -5.763 -17.994 18.575 1.00 55.42 N ATOM 321 CZ ARG A 811 -6.376 -18.356 19.722 1.00 1.31 C ATOM 322 NH1 ARG A 811 -5.810 -19.265 20.544 1.00 63.14 N ATOM 323 NH2 ARG A 811 -7.537 -17.807 20.028 1.00 21.35 N ATOM 0 H ARG A 811 -0.884 -19.000 14.743 1.00 41.51 H new ATOM 0 HA ARG A 811 -2.562 -16.912 14.691 1.00 44.02 H new ATOM 0 HB2 ARG A 811 -3.162 -19.084 15.644 1.00 2.02 H new ATOM 0 HB3 ARG A 811 -2.078 -18.839 17.000 1.00 2.02 H new ATOM 0 HG2 ARG A 811 -3.458 -16.717 17.542 1.00 1.02 H new ATOM 0 HG3 ARG A 811 -4.626 -17.290 16.368 1.00 1.02 H new ATOM 0 HD2 ARG A 811 -4.600 -19.536 17.710 1.00 40.44 H new ATOM 0 HD3 ARG A 811 -3.784 -18.631 18.969 1.00 40.44 H new ATOM 0 HE ARG A 811 -6.225 -17.303 17.983 1.00 55.42 H new ATOM 0 HH11 ARG A 811 -4.912 -19.684 20.300 1.00 63.14 H new ATOM 0 HH12 ARG A 811 -6.280 -19.533 21.409 1.00 63.14 H new ATOM 0 HH21 ARG A 811 -7.957 -17.121 19.402 1.00 21.35 H new ATOM 0 HH22 ARG A 811 -8.014 -18.069 20.891 1.00 21.35 H new ATOM 336 N LYS A 812 -0.203 -16.388 16.872 1.00 2.15 N ATOM 337 CA LYS A 812 0.402 -15.402 17.752 1.00 21.45 C ATOM 338 C LYS A 812 0.129 -14.000 17.205 1.00 73.10 C ATOM 339 O LYS A 812 -0.743 -13.293 17.707 1.00 14.12 O ATOM 340 CB LYS A 812 1.888 -15.705 17.954 1.00 2.14 C ATOM 341 CG LYS A 812 2.097 -16.674 19.120 1.00 2.42 C ATOM 342 CD LYS A 812 2.360 -15.915 20.423 1.00 64.33 C ATOM 343 CE LYS A 812 1.075 -15.278 20.955 1.00 25.15 C ATOM 344 NZ LYS A 812 0.920 -13.905 20.426 1.00 74.04 N ATOM 0 H LYS A 812 0.379 -17.203 16.680 1.00 2.15 H new ATOM 0 HA LYS A 812 -0.047 -15.450 18.744 1.00 21.45 H new ATOM 0 HB2 LYS A 812 2.303 -16.134 17.042 1.00 2.14 H new ATOM 0 HB3 LYS A 812 2.429 -14.778 18.145 1.00 2.14 H new ATOM 0 HG2 LYS A 812 1.216 -17.306 19.235 1.00 2.42 H new ATOM 0 HG3 LYS A 812 2.937 -17.334 18.903 1.00 2.42 H new ATOM 0 HD2 LYS A 812 2.768 -16.597 21.169 1.00 64.33 H new ATOM 0 HD3 LYS A 812 3.110 -15.142 20.253 1.00 64.33 H new ATOM 0 HE2 LYS A 812 0.216 -15.884 20.668 1.00 25.15 H new ATOM 0 HE3 LYS A 812 1.098 -15.254 22.044 1.00 25.15 H new ATOM 0 HZ1 LYS A 812 0.942 -13.225 21.213 1.00 74.04 H new ATOM 0 HZ2 LYS A 812 1.697 -13.697 19.767 1.00 74.04 H new ATOM 0 HZ3 LYS A 812 0.012 -13.826 19.926 1.00 74.04 H new ATOM 357 N CYS A 813 0.890 -13.640 16.183 1.00 45.14 N ATOM 358 CA CYS A 813 0.741 -12.335 15.561 1.00 3.24 C ATOM 359 C CYS A 813 0.297 -12.541 14.112 1.00 41.40 C ATOM 360 O CYS A 813 0.469 -11.656 13.275 1.00 61.03 O ATOM 361 CB CYS A 813 2.030 -11.514 15.653 1.00 74.55 C ATOM 362 SG CYS A 813 1.688 -9.765 15.238 1.00 62.11 S ATOM 0 H CYS A 813 1.612 -14.229 15.769 1.00 45.14 H new ATOM 0 HA CYS A 813 -0.017 -11.760 16.093 1.00 3.24 H new ATOM 0 HB2 CYS A 813 2.444 -11.583 16.659 1.00 74.55 H new ATOM 0 HB3 CYS A 813 2.778 -11.919 14.971 1.00 74.55 H new ATOM 0 HG CYS A 813 1.009 -9.706 14.131 1.00 62.11 H new ATOM 368 N LYS A 814 -0.266 -13.713 13.860 1.00 62.21 N ATOM 369 CA LYS A 814 -0.736 -14.046 12.526 1.00 31.40 C ATOM 370 C LYS A 814 0.345 -13.687 11.504 1.00 32.24 C ATOM 371 O LYS A 814 0.172 -12.763 10.711 1.00 32.13 O ATOM 372 CB LYS A 814 -2.086 -13.381 12.252 1.00 34.13 C ATOM 373 CG LYS A 814 -2.820 -13.072 13.559 1.00 51.22 C ATOM 374 CD LYS A 814 -3.164 -14.358 14.312 1.00 21.24 C ATOM 375 CE LYS A 814 -4.239 -15.156 13.572 1.00 31.43 C ATOM 376 NZ LYS A 814 -5.522 -14.418 13.568 1.00 22.11 N ATOM 0 H LYS A 814 -0.407 -14.444 14.557 1.00 62.21 H new ATOM 0 HA LYS A 814 -0.912 -15.118 12.441 1.00 31.40 H new ATOM 0 HB2 LYS A 814 -1.934 -12.460 11.689 1.00 34.13 H new ATOM 0 HB3 LYS A 814 -2.699 -14.036 11.632 1.00 34.13 H new ATOM 0 HG2 LYS A 814 -2.198 -12.434 14.187 1.00 51.22 H new ATOM 0 HG3 LYS A 814 -3.733 -12.516 13.345 1.00 51.22 H new ATOM 0 HD2 LYS A 814 -2.268 -14.968 14.426 1.00 21.24 H new ATOM 0 HD3 LYS A 814 -3.513 -14.114 15.315 1.00 21.24 H new ATOM 0 HE2 LYS A 814 -3.919 -15.346 12.548 1.00 31.43 H new ATOM 0 HE3 LYS A 814 -4.373 -16.127 14.049 1.00 31.43 H new ATOM 0 HZ1 LYS A 814 -6.301 -15.076 13.363 1.00 22.11 H new ATOM 0 HZ2 LYS A 814 -5.674 -13.981 14.500 1.00 22.11 H new ATOM 0 HZ3 LYS A 814 -5.494 -13.677 12.839 1.00 22.11 H new ATOM 389 N ALA A 815 1.436 -14.437 11.557 1.00 50.12 N ATOM 390 CA ALA A 815 2.545 -14.209 10.646 1.00 72.12 C ATOM 391 C ALA A 815 3.025 -15.551 10.088 1.00 54.40 C ATOM 392 O ALA A 815 2.878 -16.585 10.737 1.00 75.12 O ATOM 393 CB ALA A 815 3.656 -13.449 11.373 1.00 32.45 C ATOM 0 H ALA A 815 1.576 -15.203 12.216 1.00 50.12 H new ATOM 0 HA ALA A 815 2.229 -13.595 9.803 1.00 72.12 H new ATOM 0 HB1 ALA A 815 4.488 -13.278 10.689 1.00 32.45 H new ATOM 0 HB2 ALA A 815 3.272 -12.491 11.724 1.00 32.45 H new ATOM 0 HB3 ALA A 815 4.001 -14.035 12.225 1.00 32.45 H new ATOM 399 N LEU A 816 3.589 -15.489 8.891 1.00 72.53 N ATOM 400 CA LEU A 816 4.091 -16.687 8.238 1.00 1.31 C ATOM 401 C LEU A 816 4.777 -17.578 9.275 1.00 2.13 C ATOM 402 O LEU A 816 5.555 -17.095 10.097 1.00 13.21 O ATOM 403 CB LEU A 816 4.989 -16.316 7.056 1.00 54.12 C ATOM 404 CG LEU A 816 5.779 -17.465 6.427 1.00 75.50 C ATOM 405 CD1 LEU A 816 7.004 -17.817 7.274 1.00 55.54 C ATOM 406 CD2 LEU A 816 4.881 -18.681 6.187 1.00 54.34 C ATOM 0 H LEU A 816 3.710 -14.629 8.356 1.00 72.53 H new ATOM 0 HA LEU A 816 3.268 -17.264 7.815 1.00 1.31 H new ATOM 0 HB2 LEU A 816 4.369 -15.862 6.283 1.00 54.12 H new ATOM 0 HB3 LEU A 816 5.695 -15.554 7.387 1.00 54.12 H new ATOM 0 HG LEU A 816 6.144 -17.136 5.454 1.00 75.50 H new ATOM 0 HD11 LEU A 816 7.548 -18.637 6.804 1.00 55.54 H new ATOM 0 HD12 LEU A 816 7.655 -16.946 7.351 1.00 55.54 H new ATOM 0 HD13 LEU A 816 6.683 -18.119 8.271 1.00 55.54 H new ATOM 0 HD21 LEU A 816 5.467 -19.483 5.739 1.00 54.34 H new ATOM 0 HD22 LEU A 816 4.467 -19.020 7.136 1.00 54.34 H new ATOM 0 HD23 LEU A 816 4.069 -18.406 5.514 1.00 54.34 H new ATOM 418 N ALA A 817 4.465 -18.863 9.203 1.00 33.44 N ATOM 419 CA ALA A 817 5.041 -19.827 10.126 1.00 44.41 C ATOM 420 C ALA A 817 5.790 -20.900 9.334 1.00 72.35 C ATOM 421 O ALA A 817 6.940 -21.212 9.637 1.00 4.11 O ATOM 422 CB ALA A 817 3.937 -20.415 11.006 1.00 20.22 C ATOM 0 H ALA A 817 3.820 -19.260 8.519 1.00 33.44 H new ATOM 0 HA ALA A 817 5.760 -19.343 10.787 1.00 44.41 H new ATOM 0 HB1 ALA A 817 4.369 -21.138 11.698 1.00 20.22 H new ATOM 0 HB2 ALA A 817 3.457 -19.615 11.570 1.00 20.22 H new ATOM 0 HB3 ALA A 817 3.197 -20.911 10.378 1.00 20.22 H new ATOM 428 N CYS A 818 5.106 -21.436 8.333 1.00 22.43 N ATOM 429 CA CYS A 818 5.692 -22.469 7.495 1.00 50.41 C ATOM 430 C CYS A 818 4.706 -22.792 6.371 1.00 54.31 C ATOM 431 O CYS A 818 3.718 -22.083 6.184 1.00 11.23 O ATOM 432 CB CYS A 818 6.062 -23.713 8.305 1.00 53.11 C ATOM 433 SG CYS A 818 7.856 -23.715 8.665 1.00 71.02 S ATOM 0 H CYS A 818 4.152 -21.174 8.084 1.00 22.43 H new ATOM 0 HA CYS A 818 6.625 -22.106 7.065 1.00 50.41 H new ATOM 0 HB2 CYS A 818 5.496 -23.732 9.236 1.00 53.11 H new ATOM 0 HB3 CYS A 818 5.793 -24.612 7.750 1.00 53.11 H new ATOM 0 HG CYS A 818 8.522 -23.789 7.551 1.00 71.02 H new ATOM 439 N TYR A 819 5.008 -23.862 5.651 1.00 32.33 N ATOM 440 CA TYR A 819 4.160 -24.288 4.551 1.00 50.24 C ATOM 441 C TYR A 819 3.755 -25.755 4.706 1.00 65.34 C ATOM 442 O TYR A 819 4.477 -26.540 5.319 1.00 33.24 O ATOM 443 CB TYR A 819 5.005 -24.135 3.284 1.00 32.22 C ATOM 444 CG TYR A 819 5.173 -22.687 2.819 1.00 23.35 C ATOM 445 CD1 TYR A 819 6.135 -21.884 3.398 1.00 65.31 C ATOM 446 CD2 TYR A 819 4.363 -22.184 1.822 1.00 64.02 C ATOM 447 CE1 TYR A 819 6.294 -20.522 2.961 1.00 41.45 C ATOM 448 CE2 TYR A 819 4.522 -20.821 1.384 1.00 20.34 C ATOM 449 CZ TYR A 819 5.480 -20.057 1.975 1.00 34.33 C ATOM 450 OH TYR A 819 5.629 -18.770 1.562 1.00 24.32 O ATOM 0 H TYR A 819 5.829 -24.447 5.808 1.00 32.33 H new ATOM 0 HA TYR A 819 3.246 -23.695 4.519 1.00 50.24 H new ATOM 0 HB2 TYR A 819 5.991 -24.565 3.463 1.00 32.22 H new ATOM 0 HB3 TYR A 819 4.546 -24.713 2.482 1.00 32.22 H new ATOM 0 HD1 TYR A 819 6.768 -22.278 4.179 1.00 65.31 H new ATOM 0 HD2 TYR A 819 3.610 -22.812 1.370 1.00 64.02 H new ATOM 0 HE1 TYR A 819 7.043 -19.883 3.406 1.00 41.45 H new ATOM 0 HE2 TYR A 819 3.895 -20.415 0.604 1.00 20.34 H new ATOM 0 HH TYR A 819 4.981 -18.577 0.852 1.00 24.32 H new ATOM 460 N THR A 820 2.603 -26.081 4.139 1.00 63.44 N ATOM 461 CA THR A 820 2.094 -27.441 4.206 1.00 2.31 C ATOM 462 C THR A 820 2.836 -28.338 3.213 1.00 11.23 C ATOM 463 O THR A 820 2.798 -29.562 3.329 1.00 53.24 O ATOM 464 CB THR A 820 0.583 -27.392 3.970 1.00 44.02 C ATOM 465 OG1 THR A 820 0.062 -28.382 4.852 1.00 71.11 O ATOM 466 CG2 THR A 820 0.192 -27.890 2.577 1.00 22.41 C ATOM 0 H THR A 820 2.007 -25.427 3.631 1.00 63.44 H new ATOM 0 HA THR A 820 2.270 -27.882 5.187 1.00 2.31 H new ATOM 0 HB THR A 820 0.227 -26.370 4.103 1.00 44.02 H new ATOM 0 HG1 THR A 820 0.008 -29.241 4.384 1.00 71.11 H new ATOM 0 HG21 THR A 820 -0.890 -27.834 2.461 1.00 22.41 H new ATOM 0 HG22 THR A 820 0.670 -27.268 1.821 1.00 22.41 H new ATOM 0 HG23 THR A 820 0.517 -28.923 2.455 1.00 22.41 H new ATOM 474 N ALA A 821 3.494 -27.694 2.260 1.00 33.02 N ATOM 475 CA ALA A 821 4.243 -28.418 1.248 1.00 61.42 C ATOM 476 C ALA A 821 5.559 -28.914 1.851 1.00 71.31 C ATOM 477 O ALA A 821 6.329 -29.606 1.186 1.00 34.43 O ATOM 478 CB ALA A 821 4.463 -27.516 0.032 1.00 74.12 C ATOM 0 H ALA A 821 3.524 -26.679 2.168 1.00 33.02 H new ATOM 0 HA ALA A 821 3.685 -29.291 0.910 1.00 61.42 H new ATOM 0 HB1 ALA A 821 5.025 -28.060 -0.727 1.00 74.12 H new ATOM 0 HB2 ALA A 821 3.499 -27.215 -0.377 1.00 74.12 H new ATOM 0 HB3 ALA A 821 5.022 -26.630 0.333 1.00 74.12 H new ATOM 484 N ASP A 822 5.777 -28.541 3.103 1.00 34.03 N ATOM 485 CA ASP A 822 6.986 -28.939 3.803 1.00 31.35 C ATOM 486 C ASP A 822 6.609 -29.564 5.148 1.00 22.13 C ATOM 487 O ASP A 822 7.477 -29.829 5.979 1.00 41.13 O ATOM 488 CB ASP A 822 7.886 -27.733 4.078 1.00 11.13 C ATOM 489 CG ASP A 822 8.315 -26.950 2.836 1.00 52.22 C ATOM 490 OD1 ASP A 822 7.597 -26.055 2.366 1.00 52.14 O ATOM 491 OD2 ASP A 822 9.454 -27.296 2.340 1.00 43.21 O ATOM 0 H ASP A 822 5.136 -27.967 3.651 1.00 34.03 H new ATOM 0 HA ASP A 822 7.520 -29.652 3.175 1.00 31.35 H new ATOM 0 HB2 ASP A 822 7.364 -27.056 4.754 1.00 11.13 H new ATOM 0 HB3 ASP A 822 8.780 -28.077 4.599 1.00 11.13 H new ATOM 497 N VAL A 823 5.314 -29.782 5.321 1.00 13.54 N ATOM 498 CA VAL A 823 4.811 -30.370 6.551 1.00 24.22 C ATOM 499 C VAL A 823 4.737 -31.890 6.391 1.00 55.14 C ATOM 500 O VAL A 823 4.187 -32.388 5.409 1.00 12.33 O ATOM 501 CB VAL A 823 3.467 -29.741 6.921 1.00 34.23 C ATOM 502 CG1 VAL A 823 2.331 -30.352 6.099 1.00 74.34 C ATOM 503 CG2 VAL A 823 3.192 -29.876 8.420 1.00 23.44 C ATOM 0 H VAL A 823 4.597 -29.562 4.630 1.00 13.54 H new ATOM 0 HA VAL A 823 5.489 -30.163 7.379 1.00 24.22 H new ATOM 0 HB VAL A 823 3.519 -28.678 6.684 1.00 34.23 H new ATOM 0 HG11 VAL A 823 1.387 -29.887 6.382 1.00 74.34 H new ATOM 0 HG12 VAL A 823 2.516 -30.181 5.039 1.00 74.34 H new ATOM 0 HG13 VAL A 823 2.279 -31.424 6.290 1.00 74.34 H new ATOM 0 HG21 VAL A 823 2.230 -29.421 8.656 1.00 23.44 H new ATOM 0 HG22 VAL A 823 3.170 -30.931 8.692 1.00 23.44 H new ATOM 0 HG23 VAL A 823 3.979 -29.373 8.981 1.00 23.44 H new ATOM 513 N ARG A 824 5.297 -32.585 7.369 1.00 4.34 N ATOM 514 CA ARG A 824 5.301 -34.038 7.349 1.00 1.41 C ATOM 515 C ARG A 824 5.206 -34.589 8.773 1.00 13.32 C ATOM 516 O ARG A 824 6.066 -34.313 9.608 1.00 13.12 O ATOM 517 CB ARG A 824 6.570 -34.576 6.685 1.00 2.23 C ATOM 518 CG ARG A 824 6.304 -34.967 5.230 1.00 3.41 C ATOM 519 CD ARG A 824 6.726 -33.847 4.276 1.00 62.30 C ATOM 520 NE ARG A 824 6.761 -34.354 2.886 1.00 42.32 N ATOM 521 CZ ARG A 824 7.802 -35.027 2.351 1.00 4.34 C ATOM 522 NH1 ARG A 824 8.905 -35.280 3.088 1.00 31.20 N ATOM 523 NH2 ARG A 824 7.726 -35.433 1.098 1.00 42.02 N ATOM 0 H ARG A 824 5.752 -32.169 8.182 1.00 4.34 H new ATOM 0 HA ARG A 824 4.436 -34.364 6.771 1.00 1.41 H new ATOM 0 HB2 ARG A 824 7.354 -33.820 6.725 1.00 2.23 H new ATOM 0 HB3 ARG A 824 6.934 -35.442 7.237 1.00 2.23 H new ATOM 0 HG2 ARG A 824 6.849 -35.880 4.989 1.00 3.41 H new ATOM 0 HG3 ARG A 824 5.244 -35.184 5.096 1.00 3.41 H new ATOM 0 HD2 ARG A 824 6.029 -33.013 4.350 1.00 62.30 H new ATOM 0 HD3 ARG A 824 7.708 -33.468 4.559 1.00 62.30 H new ATOM 0 HE ARG A 824 5.947 -34.184 2.295 1.00 42.32 H new ATOM 0 HH11 ARG A 824 8.956 -34.962 4.056 1.00 31.20 H new ATOM 0 HH12 ARG A 824 9.687 -35.789 2.677 1.00 31.20 H new ATOM 0 HH21 ARG A 824 6.889 -35.237 0.548 1.00 42.02 H new ATOM 0 HH22 ARG A 824 8.504 -35.943 0.679 1.00 42.02 H new ATOM 536 N VAL A 825 4.152 -35.358 9.007 1.00 43.44 N ATOM 537 CA VAL A 825 3.933 -35.950 10.315 1.00 3.13 C ATOM 538 C VAL A 825 4.758 -37.233 10.434 1.00 72.31 C ATOM 539 O VAL A 825 5.105 -37.848 9.426 1.00 13.24 O ATOM 540 CB VAL A 825 2.438 -36.177 10.543 1.00 15.03 C ATOM 541 CG1 VAL A 825 1.862 -37.131 9.495 1.00 52.22 C ATOM 542 CG2 VAL A 825 2.171 -36.692 11.959 1.00 72.40 C ATOM 0 H VAL A 825 3.441 -35.584 8.312 1.00 43.44 H new ATOM 0 HA VAL A 825 4.269 -35.274 11.101 1.00 3.13 H new ATOM 0 HB VAL A 825 1.933 -35.217 10.435 1.00 15.03 H new ATOM 0 HG11 VAL A 825 0.798 -37.275 9.680 1.00 52.22 H new ATOM 0 HG12 VAL A 825 2.003 -36.707 8.501 1.00 52.22 H new ATOM 0 HG13 VAL A 825 2.374 -38.091 9.556 1.00 52.22 H new ATOM 0 HG21 VAL A 825 1.100 -36.845 12.095 1.00 72.40 H new ATOM 0 HG22 VAL A 825 2.694 -37.637 12.107 1.00 72.40 H new ATOM 0 HG23 VAL A 825 2.528 -35.962 12.685 1.00 72.40 H new ATOM 552 N ILE A 826 5.048 -37.600 11.674 1.00 74.14 N ATOM 553 CA ILE A 826 5.825 -38.799 11.937 1.00 73.20 C ATOM 554 C ILE A 826 4.889 -39.915 12.407 1.00 63.12 C ATOM 555 O ILE A 826 4.781 -40.176 13.604 1.00 70.31 O ATOM 556 CB ILE A 826 6.961 -38.497 12.916 1.00 44.15 C ATOM 557 CG1 ILE A 826 8.043 -37.641 12.252 1.00 34.15 C ATOM 558 CG2 ILE A 826 7.534 -39.787 13.506 1.00 13.15 C ATOM 559 CD1 ILE A 826 8.547 -36.558 13.208 1.00 22.01 C ATOM 0 H ILE A 826 4.759 -37.088 12.507 1.00 74.14 H new ATOM 0 HA ILE A 826 6.306 -39.149 11.024 1.00 73.20 H new ATOM 0 HB ILE A 826 6.553 -37.917 13.744 1.00 44.15 H new ATOM 0 HG12 ILE A 826 8.875 -38.274 11.943 1.00 34.15 H new ATOM 0 HG13 ILE A 826 7.643 -37.178 11.350 1.00 34.15 H new ATOM 0 HG21 ILE A 826 8.340 -39.544 14.199 1.00 13.15 H new ATOM 0 HG22 ILE A 826 6.749 -40.324 14.037 1.00 13.15 H new ATOM 0 HG23 ILE A 826 7.922 -40.413 12.703 1.00 13.15 H new ATOM 0 HD11 ILE A 826 9.315 -35.964 12.712 1.00 22.01 H new ATOM 0 HD12 ILE A 826 7.718 -35.912 13.496 1.00 22.01 H new ATOM 0 HD13 ILE A 826 8.968 -37.026 14.098 1.00 22.01 H new ATOM 571 N GLU A 827 4.237 -40.543 11.440 1.00 61.34 N ATOM 572 CA GLU A 827 3.314 -41.625 11.739 1.00 3.03 C ATOM 573 C GLU A 827 2.174 -41.120 12.625 1.00 53.31 C ATOM 574 O GLU A 827 1.840 -41.745 13.631 1.00 44.54 O ATOM 575 CB GLU A 827 4.041 -42.799 12.398 1.00 22.01 C ATOM 576 CG GLU A 827 5.169 -43.317 11.504 1.00 70.44 C ATOM 577 CD GLU A 827 6.263 -43.990 12.335 1.00 22.01 C ATOM 578 OE1 GLU A 827 5.982 -44.948 13.070 1.00 23.23 O ATOM 579 OE2 GLU A 827 7.442 -43.484 12.197 1.00 73.02 O ATOM 0 H GLU A 827 4.329 -40.323 10.448 1.00 61.34 H new ATOM 0 HA GLU A 827 2.889 -41.983 10.802 1.00 3.03 H new ATOM 0 HB2 GLU A 827 4.449 -42.486 13.359 1.00 22.01 H new ATOM 0 HB3 GLU A 827 3.333 -43.603 12.599 1.00 22.01 H new ATOM 0 HG2 GLU A 827 4.768 -44.027 10.781 1.00 70.44 H new ATOM 0 HG3 GLU A 827 5.596 -42.491 10.936 1.00 70.44 H new ATOM 587 N GLU A 828 1.607 -39.993 12.219 1.00 35.21 N ATOM 588 CA GLU A 828 0.510 -39.397 12.963 1.00 2.23 C ATOM 589 C GLU A 828 0.877 -39.278 14.444 1.00 14.30 C ATOM 590 O GLU A 828 0.017 -39.415 15.313 1.00 71.31 O ATOM 591 CB GLU A 828 -0.778 -40.201 12.780 1.00 33.24 C ATOM 592 CG GLU A 828 -1.026 -40.511 11.303 1.00 52.13 C ATOM 593 CD GLU A 828 -1.891 -41.763 11.143 1.00 54.45 C ATOM 594 OE1 GLU A 828 -1.549 -42.826 11.680 1.00 23.12 O ATOM 595 OE2 GLU A 828 -2.955 -41.603 10.430 1.00 11.34 O ATOM 0 H GLU A 828 1.887 -39.477 11.385 1.00 35.21 H new ATOM 0 HA GLU A 828 0.332 -38.396 12.571 1.00 2.23 H new ATOM 0 HB2 GLU A 828 -0.713 -41.131 13.345 1.00 33.24 H new ATOM 0 HB3 GLU A 828 -1.621 -39.641 13.184 1.00 33.24 H new ATOM 0 HG2 GLU A 828 -1.517 -39.662 10.827 1.00 52.13 H new ATOM 0 HG3 GLU A 828 -0.073 -40.655 10.793 1.00 52.13 H new ATOM 603 N CYS A 829 2.154 -39.023 14.686 1.00 21.10 N ATOM 604 CA CYS A 829 2.645 -38.884 16.047 1.00 52.14 C ATOM 605 C CYS A 829 2.811 -37.393 16.347 1.00 13.03 C ATOM 606 O CYS A 829 2.436 -36.928 17.423 1.00 44.44 O ATOM 607 CB CYS A 829 3.947 -39.658 16.260 1.00 4.41 C ATOM 608 SG CYS A 829 3.696 -41.427 15.868 1.00 73.14 S ATOM 0 H CYS A 829 2.864 -38.909 13.963 1.00 21.10 H new ATOM 0 HA CYS A 829 1.925 -39.316 16.743 1.00 52.14 H new ATOM 0 HB2 CYS A 829 4.733 -39.245 15.627 1.00 4.41 H new ATOM 0 HB3 CYS A 829 4.279 -39.550 17.292 1.00 4.41 H new ATOM 0 HG CYS A 829 2.788 -41.542 14.945 1.00 73.14 H new ATOM 614 N HIS A 830 3.372 -36.685 15.378 1.00 21.31 N ATOM 615 CA HIS A 830 3.592 -35.257 15.526 1.00 41.44 C ATOM 616 C HIS A 830 3.900 -34.641 14.159 1.00 32.01 C ATOM 617 O HIS A 830 4.653 -35.212 13.372 1.00 21.22 O ATOM 618 CB HIS A 830 4.684 -34.979 16.560 1.00 23.24 C ATOM 619 CG HIS A 830 4.220 -35.104 17.992 1.00 60.31 C ATOM 620 ND1 HIS A 830 4.846 -35.924 18.914 1.00 24.23 N ATOM 621 CD2 HIS A 830 3.186 -34.505 18.649 1.00 1.31 C ATOM 622 CE1 HIS A 830 4.209 -35.816 20.071 1.00 42.12 C ATOM 623 NE2 HIS A 830 3.180 -34.936 19.904 1.00 22.23 N ATOM 0 H HIS A 830 3.681 -37.074 14.487 1.00 21.31 H new ATOM 0 HA HIS A 830 2.686 -34.784 15.904 1.00 41.44 H new ATOM 0 HB2 HIS A 830 5.511 -35.670 16.395 1.00 23.24 H new ATOM 0 HB3 HIS A 830 5.073 -33.973 16.401 1.00 23.24 H new ATOM 0 HD2 HIS A 830 2.490 -33.799 18.220 1.00 1.31 H new ATOM 0 HE1 HIS A 830 4.460 -36.333 20.985 1.00 42.12 H new ATOM 0 HE2 HIS A 830 2.515 -34.656 20.625 1.00 22.23 H new ATOM 631 N TYR A 831 3.301 -33.484 13.919 1.00 50.21 N ATOM 632 CA TYR A 831 3.501 -32.784 12.661 1.00 24.32 C ATOM 633 C TYR A 831 4.737 -31.885 12.725 1.00 3.51 C ATOM 634 O TYR A 831 4.902 -31.117 13.672 1.00 43.22 O ATOM 635 CB TYR A 831 2.260 -31.912 12.461 1.00 23.32 C ATOM 636 CG TYR A 831 1.119 -32.614 11.722 1.00 45.03 C ATOM 637 CD1 TYR A 831 1.142 -32.703 10.345 1.00 74.53 C ATOM 638 CD2 TYR A 831 0.068 -33.158 12.432 1.00 40.53 C ATOM 639 CE1 TYR A 831 0.068 -33.364 9.649 1.00 52.13 C ATOM 640 CE2 TYR A 831 -1.006 -33.818 11.736 1.00 42.13 C ATOM 641 CZ TYR A 831 -0.953 -33.888 10.379 1.00 61.54 C ATOM 642 OH TYR A 831 -1.967 -34.512 9.721 1.00 30.22 O ATOM 0 H TYR A 831 2.677 -33.013 14.574 1.00 50.21 H new ATOM 0 HA TYR A 831 3.649 -33.493 11.846 1.00 24.32 H new ATOM 0 HB2 TYR A 831 1.899 -31.582 13.435 1.00 23.32 H new ATOM 0 HB3 TYR A 831 2.543 -31.017 11.906 1.00 23.32 H new ATOM 0 HD1 TYR A 831 1.965 -32.277 9.790 1.00 74.53 H new ATOM 0 HD2 TYR A 831 0.051 -33.089 13.510 1.00 40.53 H new ATOM 0 HE1 TYR A 831 0.073 -33.442 8.572 1.00 52.13 H new ATOM 0 HE2 TYR A 831 -1.835 -34.248 12.279 1.00 42.13 H new ATOM 0 HH TYR A 831 -2.494 -35.040 10.357 1.00 30.22 H new ATOM 652 N THR A 832 5.574 -32.009 11.705 1.00 30.24 N ATOM 653 CA THR A 832 6.790 -31.217 11.634 1.00 51.12 C ATOM 654 C THR A 832 6.927 -30.574 10.252 1.00 14.44 C ATOM 655 O THR A 832 6.161 -30.884 9.341 1.00 43.33 O ATOM 656 CB THR A 832 7.967 -32.123 12.001 1.00 12.45 C ATOM 657 OG1 THR A 832 9.076 -31.546 11.317 1.00 12.25 O ATOM 658 CG2 THR A 832 7.841 -33.521 11.394 1.00 22.42 C ATOM 0 H THR A 832 5.434 -32.646 10.921 1.00 30.24 H new ATOM 0 HA THR A 832 6.765 -30.389 12.343 1.00 51.12 H new ATOM 0 HB THR A 832 8.038 -32.204 13.086 1.00 12.45 H new ATOM 0 HG1 THR A 832 9.822 -31.430 11.942 1.00 12.25 H new ATOM 0 HG21 THR A 832 8.702 -34.123 11.685 1.00 22.42 H new ATOM 0 HG22 THR A 832 6.928 -33.994 11.756 1.00 22.42 H new ATOM 0 HG23 THR A 832 7.803 -33.444 10.307 1.00 22.42 H new ATOM 666 N VAL A 833 7.907 -29.689 10.141 1.00 30.41 N ATOM 667 CA VAL A 833 8.154 -29.000 8.886 1.00 11.43 C ATOM 668 C VAL A 833 9.600 -29.244 8.451 1.00 3.32 C ATOM 669 O VAL A 833 10.468 -29.501 9.284 1.00 32.03 O ATOM 670 CB VAL A 833 7.815 -27.514 9.030 1.00 63.50 C ATOM 671 CG1 VAL A 833 7.977 -26.784 7.696 1.00 41.33 C ATOM 672 CG2 VAL A 833 6.405 -27.326 9.591 1.00 15.43 C ATOM 0 H VAL A 833 8.539 -29.433 10.900 1.00 30.41 H new ATOM 0 HA VAL A 833 7.508 -29.393 8.101 1.00 11.43 H new ATOM 0 HB VAL A 833 8.518 -27.076 9.739 1.00 63.50 H new ATOM 0 HG11 VAL A 833 7.730 -25.730 7.826 1.00 41.33 H new ATOM 0 HG12 VAL A 833 9.008 -26.876 7.354 1.00 41.33 H new ATOM 0 HG13 VAL A 833 7.309 -27.225 6.956 1.00 41.33 H new ATOM 0 HG21 VAL A 833 6.189 -26.262 9.683 1.00 15.43 H new ATOM 0 HG22 VAL A 833 5.681 -27.786 8.918 1.00 15.43 H new ATOM 0 HG23 VAL A 833 6.338 -27.796 10.572 1.00 15.43 H new ATOM 682 N LEU A 834 9.815 -29.154 7.147 1.00 63.21 N ATOM 683 CA LEU A 834 11.142 -29.362 6.591 1.00 34.11 C ATOM 684 C LEU A 834 11.599 -28.086 5.882 1.00 13.43 C ATOM 685 O LEU A 834 10.794 -27.191 5.627 1.00 70.12 O ATOM 686 CB LEU A 834 11.159 -30.603 5.696 1.00 51.44 C ATOM 687 CG LEU A 834 10.699 -31.908 6.349 1.00 51.45 C ATOM 688 CD1 LEU A 834 10.139 -32.875 5.304 1.00 33.34 C ATOM 689 CD2 LEU A 834 11.827 -32.538 7.168 1.00 71.24 C ATOM 0 H LEU A 834 9.093 -28.940 6.459 1.00 63.21 H new ATOM 0 HA LEU A 834 11.861 -29.560 7.386 1.00 34.11 H new ATOM 0 HB2 LEU A 834 10.526 -30.411 4.830 1.00 51.44 H new ATOM 0 HB3 LEU A 834 12.174 -30.744 5.324 1.00 51.44 H new ATOM 0 HG LEU A 834 9.889 -31.678 7.041 1.00 51.45 H new ATOM 0 HD11 LEU A 834 9.819 -33.795 5.794 1.00 33.34 H new ATOM 0 HD12 LEU A 834 9.287 -32.416 4.803 1.00 33.34 H new ATOM 0 HD13 LEU A 834 10.911 -33.105 4.570 1.00 33.34 H new ATOM 0 HD21 LEU A 834 11.474 -33.464 7.622 1.00 71.24 H new ATOM 0 HD22 LEU A 834 12.674 -32.753 6.516 1.00 71.24 H new ATOM 0 HD23 LEU A 834 12.138 -31.846 7.951 1.00 71.24 H new ATOM 701 N GLY A 835 12.889 -28.042 5.585 1.00 50.32 N ATOM 702 CA GLY A 835 13.463 -26.889 4.911 1.00 72.55 C ATOM 703 C GLY A 835 14.247 -26.015 5.891 1.00 65.13 C ATOM 704 O GLY A 835 13.737 -25.651 6.949 1.00 22.21 O ATOM 0 H GLY A 835 13.553 -28.786 5.798 1.00 50.32 H new ATOM 0 HA2 GLY A 835 14.121 -27.223 4.109 1.00 72.55 H new ATOM 0 HA3 GLY A 835 12.670 -26.302 4.449 1.00 72.55 H new ATOM 708 N ASP A 836 15.476 -25.703 5.503 1.00 35.24 N ATOM 709 CA ASP A 836 16.336 -24.878 6.335 1.00 73.52 C ATOM 710 C ASP A 836 15.869 -23.423 6.257 1.00 24.34 C ATOM 711 O ASP A 836 16.279 -22.593 7.067 1.00 51.42 O ATOM 712 CB ASP A 836 17.787 -24.936 5.853 1.00 33.23 C ATOM 713 CG ASP A 836 17.983 -24.671 4.359 1.00 24.13 C ATOM 714 OD1 ASP A 836 17.019 -24.666 3.579 1.00 25.13 O ATOM 715 OD2 ASP A 836 19.204 -24.460 3.999 1.00 20.41 O ATOM 0 H ASP A 836 15.896 -26.007 4.624 1.00 35.24 H new ATOM 0 HA ASP A 836 16.280 -25.254 7.357 1.00 73.52 H new ATOM 0 HB2 ASP A 836 18.370 -24.207 6.416 1.00 33.23 H new ATOM 0 HB3 ASP A 836 18.193 -25.920 6.089 1.00 33.23 H new ATOM 721 N ALA A 837 15.019 -23.159 5.276 1.00 22.22 N ATOM 722 CA ALA A 837 14.493 -21.819 5.082 1.00 12.25 C ATOM 723 C ALA A 837 13.744 -21.382 6.344 1.00 63.35 C ATOM 724 O ALA A 837 13.914 -20.258 6.813 1.00 64.12 O ATOM 725 CB ALA A 837 13.603 -21.795 3.838 1.00 13.53 C ATOM 0 H ALA A 837 14.681 -23.851 4.607 1.00 22.22 H new ATOM 0 HA ALA A 837 15.303 -21.109 4.917 1.00 12.25 H new ATOM 0 HB1 ALA A 837 13.208 -20.789 3.692 1.00 13.53 H new ATOM 0 HB2 ALA A 837 14.189 -22.085 2.966 1.00 13.53 H new ATOM 0 HB3 ALA A 837 12.777 -22.494 3.968 1.00 13.53 H new ATOM 731 N PHE A 838 12.932 -22.295 6.856 1.00 12.43 N ATOM 732 CA PHE A 838 12.157 -22.018 8.054 1.00 53.02 C ATOM 733 C PHE A 838 13.009 -22.195 9.312 1.00 62.41 C ATOM 734 O PHE A 838 12.655 -21.700 10.381 1.00 44.03 O ATOM 735 CB PHE A 838 11.007 -23.027 8.085 1.00 13.41 C ATOM 736 CG PHE A 838 10.285 -23.189 6.746 1.00 52.12 C ATOM 737 CD1 PHE A 838 9.819 -22.094 6.087 1.00 4.21 C ATOM 738 CD2 PHE A 838 10.109 -24.428 6.214 1.00 35.11 C ATOM 739 CE1 PHE A 838 9.149 -22.244 4.844 1.00 24.42 C ATOM 740 CE2 PHE A 838 9.438 -24.579 4.971 1.00 5.32 C ATOM 741 CZ PHE A 838 8.973 -23.484 4.313 1.00 41.45 C ATOM 0 H PHE A 838 12.794 -23.226 6.464 1.00 12.43 H new ATOM 0 HA PHE A 838 11.796 -20.990 8.034 1.00 53.02 H new ATOM 0 HB2 PHE A 838 11.396 -23.997 8.396 1.00 13.41 H new ATOM 0 HB3 PHE A 838 10.285 -22.716 8.840 1.00 13.41 H new ATOM 0 HD1 PHE A 838 9.959 -21.110 6.509 1.00 4.21 H new ATOM 0 HD2 PHE A 838 10.479 -25.298 6.737 1.00 35.11 H new ATOM 0 HE1 PHE A 838 8.780 -21.374 4.321 1.00 24.42 H new ATOM 0 HE2 PHE A 838 9.297 -25.563 4.549 1.00 5.32 H new ATOM 0 HZ PHE A 838 8.463 -23.599 3.368 1.00 41.45 H new ATOM 751 N LYS A 839 14.116 -22.904 9.143 1.00 42.51 N ATOM 752 CA LYS A 839 15.022 -23.152 10.252 1.00 71.45 C ATOM 753 C LYS A 839 15.546 -21.818 10.786 1.00 51.12 C ATOM 754 O LYS A 839 15.839 -21.693 11.974 1.00 53.21 O ATOM 755 CB LYS A 839 16.127 -24.124 9.833 1.00 43.25 C ATOM 756 CG LYS A 839 15.581 -25.546 9.687 1.00 44.35 C ATOM 757 CD LYS A 839 16.716 -26.548 9.466 1.00 74.55 C ATOM 758 CE LYS A 839 16.176 -27.878 8.935 1.00 21.33 C ATOM 759 NZ LYS A 839 15.476 -28.619 10.009 1.00 4.20 N ATOM 0 H LYS A 839 14.406 -23.314 8.255 1.00 42.51 H new ATOM 0 HA LYS A 839 14.495 -23.639 11.073 1.00 71.45 H new ATOM 0 HB2 LYS A 839 16.563 -23.799 8.888 1.00 43.25 H new ATOM 0 HB3 LYS A 839 16.927 -24.112 10.574 1.00 43.25 H new ATOM 0 HG2 LYS A 839 15.020 -25.818 10.581 1.00 44.35 H new ATOM 0 HG3 LYS A 839 14.885 -25.588 8.849 1.00 44.35 H new ATOM 0 HD2 LYS A 839 17.437 -26.136 8.760 1.00 74.55 H new ATOM 0 HD3 LYS A 839 17.247 -26.715 10.403 1.00 74.55 H new ATOM 0 HE2 LYS A 839 15.492 -27.695 8.106 1.00 21.33 H new ATOM 0 HE3 LYS A 839 16.996 -28.480 8.544 1.00 21.33 H new ATOM 0 HZ1 LYS A 839 15.116 -29.519 9.632 1.00 4.20 H new ATOM 0 HZ2 LYS A 839 16.139 -28.810 10.788 1.00 4.20 H new ATOM 0 HZ3 LYS A 839 14.681 -28.049 10.363 1.00 4.20 H new ATOM 772 N GLU A 840 15.648 -20.854 9.882 1.00 22.42 N ATOM 773 CA GLU A 840 16.132 -19.534 10.248 1.00 52.22 C ATOM 774 C GLU A 840 14.956 -18.603 10.550 1.00 11.21 C ATOM 775 O GLU A 840 15.148 -17.499 11.059 1.00 70.53 O ATOM 776 CB GLU A 840 17.023 -18.952 9.148 1.00 32.43 C ATOM 777 CG GLU A 840 16.324 -19.011 7.788 1.00 23.13 C ATOM 778 CD GLU A 840 16.939 -18.005 6.813 1.00 74.34 C ATOM 779 OE1 GLU A 840 16.219 -17.165 6.254 1.00 55.34 O ATOM 780 OE2 GLU A 840 18.213 -18.118 6.644 1.00 14.50 O ATOM 0 H GLU A 840 15.404 -20.961 8.897 1.00 22.42 H new ATOM 0 HA GLU A 840 16.738 -19.627 11.149 1.00 52.22 H new ATOM 0 HB2 GLU A 840 17.274 -17.919 9.387 1.00 32.43 H new ATOM 0 HB3 GLU A 840 17.961 -19.506 9.103 1.00 32.43 H new ATOM 0 HG2 GLU A 840 16.404 -20.017 7.377 1.00 23.13 H new ATOM 0 HG3 GLU A 840 15.262 -18.801 7.911 1.00 23.13 H new ATOM 788 N CYS A 841 13.764 -19.082 10.224 1.00 3.23 N ATOM 789 CA CYS A 841 12.557 -18.306 10.455 1.00 64.14 C ATOM 790 C CYS A 841 12.237 -18.349 11.950 1.00 31.10 C ATOM 791 O CYS A 841 11.544 -17.473 12.465 1.00 3.14 O ATOM 792 CB CYS A 841 11.389 -18.812 9.606 1.00 43.03 C ATOM 793 SG CYS A 841 10.093 -17.525 9.494 1.00 2.14 S ATOM 0 H CYS A 841 13.608 -19.997 9.802 1.00 3.23 H new ATOM 0 HA CYS A 841 12.722 -17.273 10.150 1.00 64.14 H new ATOM 0 HB2 CYS A 841 11.741 -19.073 8.608 1.00 43.03 H new ATOM 0 HB3 CYS A 841 10.975 -19.719 10.046 1.00 43.03 H new ATOM 0 HG CYS A 841 10.030 -16.873 10.617 1.00 2.14 H new ATOM 799 N PHE A 842 12.756 -19.377 12.605 1.00 70.44 N ATOM 800 CA PHE A 842 12.534 -19.546 14.031 1.00 73.03 C ATOM 801 C PHE A 842 13.854 -19.492 14.802 1.00 62.34 C ATOM 802 O PHE A 842 14.891 -19.143 14.240 1.00 63.11 O ATOM 803 CB PHE A 842 11.899 -20.925 14.224 1.00 4.24 C ATOM 804 CG PHE A 842 12.908 -22.039 14.510 1.00 62.23 C ATOM 805 CD1 PHE A 842 13.618 -22.592 13.489 1.00 15.04 C ATOM 806 CD2 PHE A 842 13.096 -22.477 15.784 1.00 75.14 C ATOM 807 CE1 PHE A 842 14.554 -23.626 13.754 1.00 33.32 C ATOM 808 CE2 PHE A 842 14.032 -23.512 16.048 1.00 13.54 C ATOM 809 CZ PHE A 842 14.741 -24.064 15.028 1.00 20.20 C ATOM 0 H PHE A 842 13.330 -20.102 12.174 1.00 70.44 H new ATOM 0 HA PHE A 842 11.894 -18.747 14.405 1.00 73.03 H new ATOM 0 HB2 PHE A 842 11.186 -20.874 15.047 1.00 4.24 H new ATOM 0 HB3 PHE A 842 11.333 -21.182 13.328 1.00 4.24 H new ATOM 0 HD1 PHE A 842 13.469 -22.244 12.477 1.00 15.04 H new ATOM 0 HD2 PHE A 842 12.534 -22.038 16.595 1.00 75.14 H new ATOM 0 HE1 PHE A 842 15.118 -24.065 12.944 1.00 33.32 H new ATOM 0 HE2 PHE A 842 14.181 -23.861 17.059 1.00 13.54 H new ATOM 0 HZ PHE A 842 15.453 -24.851 15.229 1.00 20.20 H new ATOM 819 N VAL A 843 13.773 -19.844 16.076 1.00 11.45 N ATOM 820 CA VAL A 843 14.949 -19.840 16.930 1.00 13.22 C ATOM 821 C VAL A 843 14.771 -20.877 18.040 1.00 31.45 C ATOM 822 O VAL A 843 13.647 -21.252 18.370 1.00 32.33 O ATOM 823 CB VAL A 843 15.202 -18.429 17.465 1.00 23.05 C ATOM 824 CG1 VAL A 843 15.222 -17.406 16.328 1.00 61.43 C ATOM 825 CG2 VAL A 843 14.166 -18.050 18.525 1.00 31.33 C ATOM 0 H VAL A 843 12.911 -20.134 16.538 1.00 11.45 H new ATOM 0 HA VAL A 843 15.835 -20.121 16.361 1.00 13.22 H new ATOM 0 HB VAL A 843 16.184 -18.422 17.939 1.00 23.05 H new ATOM 0 HG11 VAL A 843 15.404 -16.412 16.736 1.00 61.43 H new ATOM 0 HG12 VAL A 843 16.015 -17.660 15.624 1.00 61.43 H new ATOM 0 HG13 VAL A 843 14.262 -17.417 15.812 1.00 61.43 H new ATOM 0 HG21 VAL A 843 14.369 -17.043 18.888 1.00 31.33 H new ATOM 0 HG22 VAL A 843 13.168 -18.084 18.087 1.00 31.33 H new ATOM 0 HG23 VAL A 843 14.221 -18.753 19.356 1.00 31.33 H new ATOM 835 N SER A 844 15.897 -21.312 18.586 1.00 1.03 N ATOM 836 CA SER A 844 15.880 -22.299 19.653 1.00 51.04 C ATOM 837 C SER A 844 16.848 -21.887 20.763 1.00 3.41 C ATOM 838 O SER A 844 18.006 -21.570 20.496 1.00 44.43 O ATOM 839 CB SER A 844 16.240 -23.688 19.123 1.00 62.30 C ATOM 840 OG SER A 844 15.604 -24.725 19.866 1.00 1.52 O ATOM 0 H SER A 844 16.828 -20.999 18.310 1.00 1.03 H new ATOM 0 HA SER A 844 14.870 -22.345 20.060 1.00 51.04 H new ATOM 0 HB2 SER A 844 15.950 -23.763 18.075 1.00 62.30 H new ATOM 0 HB3 SER A 844 17.321 -23.823 19.165 1.00 62.30 H new ATOM 0 HG SER A 844 15.858 -25.596 19.495 1.00 1.52 H new ATOM 846 N ARG A 845 16.338 -21.904 21.986 1.00 64.23 N ATOM 847 CA ARG A 845 17.144 -21.536 23.138 1.00 74.01 C ATOM 848 C ARG A 845 17.383 -22.756 24.030 1.00 41.12 C ATOM 849 O ARG A 845 16.539 -23.647 24.108 1.00 63.41 O ATOM 850 CB ARG A 845 16.462 -20.439 23.958 1.00 2.02 C ATOM 851 CG ARG A 845 15.621 -19.527 23.063 1.00 45.25 C ATOM 852 CD ARG A 845 16.487 -18.862 21.990 1.00 2.14 C ATOM 853 NE ARG A 845 17.283 -17.767 22.590 1.00 54.05 N ATOM 854 CZ ARG A 845 18.119 -16.969 21.891 1.00 34.35 C ATOM 855 NH1 ARG A 845 18.276 -17.138 20.561 1.00 32.44 N ATOM 856 NH2 ARG A 845 18.780 -16.022 22.529 1.00 2.41 N ATOM 0 H ARG A 845 15.377 -22.167 22.204 1.00 64.23 H new ATOM 0 HA ARG A 845 18.098 -21.159 22.769 1.00 74.01 H new ATOM 0 HB2 ARG A 845 15.828 -20.891 24.720 1.00 2.02 H new ATOM 0 HB3 ARG A 845 17.215 -19.848 24.479 1.00 2.02 H new ATOM 0 HG2 ARG A 845 14.829 -20.107 22.589 1.00 45.25 H new ATOM 0 HG3 ARG A 845 15.136 -18.762 23.670 1.00 45.25 H new ATOM 0 HD2 ARG A 845 17.150 -19.599 21.538 1.00 2.14 H new ATOM 0 HD3 ARG A 845 15.856 -18.469 21.193 1.00 2.14 H new ATOM 0 HE ARG A 845 17.195 -17.605 23.593 1.00 54.05 H new ATOM 0 HH11 ARG A 845 17.761 -17.873 20.076 1.00 32.44 H new ATOM 0 HH12 ARG A 845 18.909 -16.531 20.041 1.00 32.44 H new ATOM 0 HH21 ARG A 845 18.655 -15.902 23.534 1.00 2.41 H new ATOM 0 HH22 ARG A 845 19.416 -15.410 22.017 1.00 2.41 H new ATOM 869 N PRO A 846 18.568 -22.756 24.697 1.00 30.23 N ATOM 870 CA PRO A 846 18.929 -23.852 25.581 1.00 40.14 C ATOM 871 C PRO A 846 18.149 -23.777 26.895 1.00 41.42 C ATOM 872 O PRO A 846 17.180 -23.028 27.003 1.00 15.44 O ATOM 873 CB PRO A 846 20.431 -23.723 25.773 1.00 23.32 C ATOM 874 CG PRO A 846 20.782 -22.300 25.373 1.00 45.33 C ATOM 875 CD PRO A 846 19.592 -21.717 24.629 1.00 34.41 C ATOM 0 HA PRO A 846 18.676 -24.828 25.167 1.00 40.14 H new ATOM 0 HB2 PRO A 846 20.710 -23.918 26.808 1.00 23.32 H new ATOM 0 HB3 PRO A 846 20.967 -24.445 25.157 1.00 23.32 H new ATOM 0 HG2 PRO A 846 21.011 -21.701 26.255 1.00 45.33 H new ATOM 0 HG3 PRO A 846 21.670 -22.289 24.741 1.00 45.33 H new ATOM 0 HD2 PRO A 846 19.249 -20.792 25.093 1.00 34.41 H new ATOM 0 HD3 PRO A 846 19.848 -21.480 23.596 1.00 34.41 H new ATOM 1029 N PHE A 856 6.558 -37.090 24.798 1.00 42.01 N ATOM 1030 CA PHE A 856 7.919 -36.742 24.426 1.00 1.02 C ATOM 1031 C PHE A 856 8.538 -35.784 25.446 1.00 50.53 C ATOM 1032 O PHE A 856 7.858 -35.320 26.360 1.00 53.24 O ATOM 1033 CB PHE A 856 7.847 -36.044 23.066 1.00 31.35 C ATOM 1034 CG PHE A 856 7.919 -36.999 21.873 1.00 52.22 C ATOM 1035 CD1 PHE A 856 7.604 -38.312 22.032 1.00 35.02 C ATOM 1036 CD2 PHE A 856 8.298 -36.534 20.652 1.00 0.32 C ATOM 1037 CE1 PHE A 856 7.670 -39.198 20.924 1.00 2.23 C ATOM 1038 CE2 PHE A 856 8.365 -37.419 19.544 1.00 33.54 C ATOM 1039 CZ PHE A 856 8.049 -38.733 19.704 1.00 44.22 C ATOM 0 HA PHE A 856 8.536 -37.640 24.390 1.00 1.02 H new ATOM 0 HB2 PHE A 856 6.918 -35.477 23.009 1.00 31.35 H new ATOM 0 HB3 PHE A 856 8.664 -35.326 22.994 1.00 31.35 H new ATOM 0 HD1 PHE A 856 7.303 -38.681 23.001 1.00 35.02 H new ATOM 0 HD2 PHE A 856 8.548 -35.491 20.526 1.00 0.32 H new ATOM 0 HE1 PHE A 856 7.419 -40.241 21.051 1.00 2.23 H new ATOM 0 HE2 PHE A 856 8.667 -37.050 18.575 1.00 33.54 H new ATOM 0 HZ PHE A 856 8.099 -39.407 18.861 1.00 44.22 H new ATOM 1049 N GLU A 857 9.821 -35.515 25.255 1.00 62.04 N ATOM 1050 CA GLU A 857 10.539 -34.620 26.146 1.00 24.21 C ATOM 1051 C GLU A 857 11.210 -33.500 25.347 1.00 34.45 C ATOM 1052 O GLU A 857 11.738 -33.738 24.262 1.00 12.43 O ATOM 1053 CB GLU A 857 11.566 -35.387 26.983 1.00 53.24 C ATOM 1054 CG GLU A 857 10.927 -36.604 27.654 1.00 15.12 C ATOM 1055 CD GLU A 857 11.685 -36.990 28.926 1.00 51.41 C ATOM 1056 OE1 GLU A 857 12.646 -37.771 28.862 1.00 53.21 O ATOM 1057 OE2 GLU A 857 11.244 -36.446 30.010 1.00 42.14 O ATOM 0 H GLU A 857 10.382 -35.901 24.496 1.00 62.04 H new ATOM 0 HA GLU A 857 9.822 -34.170 26.833 1.00 24.21 H new ATOM 0 HB2 GLU A 857 12.391 -35.709 26.347 1.00 53.24 H new ATOM 0 HB3 GLU A 857 11.987 -34.728 27.742 1.00 53.24 H new ATOM 0 HG2 GLU A 857 9.887 -36.385 27.898 1.00 15.12 H new ATOM 0 HG3 GLU A 857 10.921 -37.445 26.960 1.00 15.12 H new ATOM 1065 N LYS A 858 11.166 -32.304 25.915 1.00 21.24 N ATOM 1066 CA LYS A 858 11.763 -31.147 25.270 1.00 74.11 C ATOM 1067 C LYS A 858 13.169 -30.924 25.831 1.00 54.05 C ATOM 1068 O LYS A 858 13.402 -31.111 27.024 1.00 71.44 O ATOM 1069 CB LYS A 858 10.847 -29.928 25.402 1.00 21.45 C ATOM 1070 CG LYS A 858 9.375 -30.345 25.398 1.00 70.34 C ATOM 1071 CD LYS A 858 8.462 -29.138 25.619 1.00 3.45 C ATOM 1072 CE LYS A 858 6.998 -29.569 25.727 1.00 64.00 C ATOM 1073 NZ LYS A 858 6.844 -30.626 26.751 1.00 34.22 N ATOM 0 H LYS A 858 10.726 -32.111 26.815 1.00 21.24 H new ATOM 0 HA LYS A 858 11.871 -31.321 24.199 1.00 74.11 H new ATOM 0 HB2 LYS A 858 11.075 -29.395 26.325 1.00 21.45 H new ATOM 0 HB3 LYS A 858 11.035 -29.237 24.580 1.00 21.45 H new ATOM 0 HG2 LYS A 858 9.131 -30.821 24.448 1.00 70.34 H new ATOM 0 HG3 LYS A 858 9.201 -31.085 26.179 1.00 70.34 H new ATOM 0 HD2 LYS A 858 8.759 -28.615 26.528 1.00 3.45 H new ATOM 0 HD3 LYS A 858 8.578 -28.435 24.794 1.00 3.45 H new ATOM 0 HE2 LYS A 858 6.378 -28.711 25.986 1.00 64.00 H new ATOM 0 HE3 LYS A 858 6.648 -29.936 24.762 1.00 64.00 H new ATOM 0 HZ1 LYS A 858 5.851 -30.671 27.057 1.00 34.22 H new ATOM 0 HZ2 LYS A 858 7.124 -31.543 26.348 1.00 34.22 H new ATOM 0 HZ3 LYS A 858 7.449 -30.408 27.569 1.00 34.22 H new ATOM 1086 N ARG A 859 14.069 -30.527 24.943 1.00 13.11 N ATOM 1087 CA ARG A 859 15.445 -30.276 25.334 1.00 25.35 C ATOM 1088 C ARG A 859 15.819 -28.819 25.057 1.00 43.11 C ATOM 1089 O ARG A 859 16.906 -28.373 25.421 1.00 1.14 O ATOM 1090 CB ARG A 859 16.408 -31.195 24.580 1.00 64.20 C ATOM 1091 CG ARG A 859 17.747 -31.306 25.312 1.00 23.22 C ATOM 1092 CD ARG A 859 17.598 -32.103 26.610 1.00 10.31 C ATOM 1093 NE ARG A 859 18.907 -32.662 27.014 1.00 4.54 N ATOM 1094 CZ ARG A 859 19.573 -33.609 26.320 1.00 32.13 C ATOM 1095 NH1 ARG A 859 19.056 -34.112 25.179 1.00 32.53 N ATOM 1096 NH2 ARG A 859 20.736 -34.036 26.774 1.00 24.21 N ATOM 0 H ARG A 859 13.872 -30.373 23.954 1.00 13.11 H new ATOM 0 HA ARG A 859 15.528 -30.479 26.402 1.00 25.35 H new ATOM 0 HB2 ARG A 859 15.964 -32.185 24.475 1.00 64.20 H new ATOM 0 HB3 ARG A 859 16.571 -30.810 23.573 1.00 64.20 H new ATOM 0 HG2 ARG A 859 18.480 -31.790 24.666 1.00 23.22 H new ATOM 0 HG3 ARG A 859 18.127 -30.309 25.535 1.00 23.22 H new ATOM 0 HD2 ARG A 859 17.209 -31.459 27.399 1.00 10.31 H new ATOM 0 HD3 ARG A 859 16.877 -32.908 26.471 1.00 10.31 H new ATOM 0 HE ARG A 859 19.333 -32.309 27.871 1.00 4.54 H new ATOM 0 HH11 ARG A 859 18.156 -33.777 24.836 1.00 32.53 H new ATOM 0 HH12 ARG A 859 19.565 -34.827 24.660 1.00 32.53 H new ATOM 0 HH21 ARG A 859 21.119 -33.651 27.637 1.00 24.21 H new ATOM 0 HH22 ARG A 859 21.252 -34.751 26.262 1.00 24.21 H new ATOM 1109 N ALA A 860 14.898 -28.117 24.414 1.00 34.01 N ATOM 1110 CA ALA A 860 15.117 -26.719 24.084 1.00 72.15 C ATOM 1111 C ALA A 860 13.816 -26.115 23.551 1.00 35.35 C ATOM 1112 O ALA A 860 13.122 -26.736 22.748 1.00 70.34 O ATOM 1113 CB ALA A 860 16.265 -26.606 23.079 1.00 5.03 C ATOM 0 H ALA A 860 13.998 -28.490 24.112 1.00 34.01 H new ATOM 0 HA ALA A 860 15.403 -26.156 24.972 1.00 72.15 H new ATOM 0 HB1 ALA A 860 16.430 -25.557 22.831 1.00 5.03 H new ATOM 0 HB2 ALA A 860 17.173 -27.023 23.515 1.00 5.03 H new ATOM 0 HB3 ALA A 860 16.012 -27.157 22.174 1.00 5.03 H new ATOM 1119 N LYS A 861 13.524 -24.912 24.022 1.00 54.53 N ATOM 1120 CA LYS A 861 12.318 -24.217 23.603 1.00 11.23 C ATOM 1121 C LYS A 861 12.604 -23.435 22.320 1.00 45.31 C ATOM 1122 O LYS A 861 13.699 -22.902 22.145 1.00 63.23 O ATOM 1123 CB LYS A 861 11.775 -23.352 24.743 1.00 43.34 C ATOM 1124 CG LYS A 861 10.902 -24.177 25.690 1.00 53.14 C ATOM 1125 CD LYS A 861 11.558 -25.522 26.009 1.00 52.24 C ATOM 1126 CE LYS A 861 10.662 -26.367 26.917 1.00 4.21 C ATOM 1127 NZ LYS A 861 10.486 -25.707 28.230 1.00 4.02 N ATOM 0 H LYS A 861 14.101 -24.400 24.690 1.00 54.53 H new ATOM 0 HA LYS A 861 11.528 -24.931 23.371 1.00 11.23 H new ATOM 0 HB2 LYS A 861 12.604 -22.913 25.297 1.00 43.34 H new ATOM 0 HB3 LYS A 861 11.193 -22.527 24.333 1.00 43.34 H new ATOM 0 HG2 LYS A 861 10.735 -23.622 26.613 1.00 53.14 H new ATOM 0 HG3 LYS A 861 9.925 -24.343 25.237 1.00 53.14 H new ATOM 0 HD2 LYS A 861 11.757 -26.062 25.083 1.00 52.24 H new ATOM 0 HD3 LYS A 861 12.520 -25.356 26.494 1.00 52.24 H new ATOM 0 HE2 LYS A 861 9.691 -26.515 26.444 1.00 4.21 H new ATOM 0 HE3 LYS A 861 11.102 -27.354 27.056 1.00 4.21 H new ATOM 0 HZ1 LYS A 861 10.068 -26.380 28.904 1.00 4.02 H new ATOM 0 HZ2 LYS A 861 11.410 -25.390 28.586 1.00 4.02 H new ATOM 0 HZ3 LYS A 861 9.856 -24.886 28.124 1.00 4.02 H new ATOM 1140 N ILE A 862 11.601 -23.390 21.456 1.00 63.14 N ATOM 1141 CA ILE A 862 11.732 -22.682 20.193 1.00 12.15 C ATOM 1142 C ILE A 862 10.789 -21.477 20.190 1.00 4.42 C ATOM 1143 O ILE A 862 9.745 -21.499 20.840 1.00 40.04 O ATOM 1144 CB ILE A 862 11.513 -23.637 19.018 1.00 1.22 C ATOM 1145 CG1 ILE A 862 10.022 -23.813 18.725 1.00 13.01 C ATOM 1146 CG2 ILE A 862 12.211 -24.976 19.263 1.00 63.13 C ATOM 1147 CD1 ILE A 862 9.561 -22.849 17.630 1.00 34.01 C ATOM 0 H ILE A 862 10.694 -23.832 21.605 1.00 63.14 H new ATOM 0 HA ILE A 862 12.745 -22.296 20.075 1.00 12.15 H new ATOM 0 HB ILE A 862 11.965 -23.196 18.130 1.00 1.22 H new ATOM 0 HG12 ILE A 862 9.827 -24.840 18.416 1.00 13.01 H new ATOM 0 HG13 ILE A 862 9.446 -23.639 19.634 1.00 13.01 H new ATOM 0 HG21 ILE A 862 12.040 -25.637 18.413 1.00 63.13 H new ATOM 0 HG22 ILE A 862 13.282 -24.811 19.385 1.00 63.13 H new ATOM 0 HG23 ILE A 862 11.810 -25.436 20.166 1.00 63.13 H new ATOM 0 HD11 ILE A 862 8.497 -22.995 17.441 1.00 34.01 H new ATOM 0 HD12 ILE A 862 9.735 -21.822 17.952 1.00 34.01 H new ATOM 0 HD13 ILE A 862 10.122 -23.042 16.716 1.00 34.01 H new ATOM 1159 N PHE A 863 11.192 -20.453 19.452 1.00 62.03 N ATOM 1160 CA PHE A 863 10.397 -19.241 19.355 1.00 13.13 C ATOM 1161 C PHE A 863 10.504 -18.624 17.959 1.00 30.22 C ATOM 1162 O PHE A 863 11.239 -19.125 17.110 1.00 23.51 O ATOM 1163 CB PHE A 863 10.959 -18.254 20.380 1.00 22.13 C ATOM 1164 CG PHE A 863 11.056 -18.818 21.799 1.00 32.33 C ATOM 1165 CD1 PHE A 863 9.938 -19.270 22.429 1.00 2.42 C ATOM 1166 CD2 PHE A 863 12.259 -18.869 22.431 1.00 44.44 C ATOM 1167 CE1 PHE A 863 10.028 -19.793 23.746 1.00 32.30 C ATOM 1168 CE2 PHE A 863 12.349 -19.392 23.747 1.00 20.24 C ATOM 1169 CZ PHE A 863 11.231 -19.844 24.377 1.00 4.44 C ATOM 0 H PHE A 863 12.059 -20.438 18.915 1.00 62.03 H new ATOM 0 HA PHE A 863 9.348 -19.469 19.542 1.00 13.13 H new ATOM 0 HB2 PHE A 863 11.951 -17.937 20.058 1.00 22.13 H new ATOM 0 HB3 PHE A 863 10.329 -17.365 20.396 1.00 22.13 H new ATOM 0 HD1 PHE A 863 8.982 -19.231 21.927 1.00 2.42 H new ATOM 0 HD2 PHE A 863 13.147 -18.511 21.931 1.00 44.44 H new ATOM 0 HE1 PHE A 863 9.140 -20.150 24.247 1.00 32.30 H new ATOM 0 HE2 PHE A 863 13.305 -19.431 24.248 1.00 20.24 H new ATOM 0 HZ PHE A 863 11.299 -20.243 25.378 1.00 4.44 H new ATOM 1179 N CYS A 864 9.760 -17.545 17.765 1.00 73.52 N ATOM 1180 CA CYS A 864 9.762 -16.855 16.486 1.00 32.13 C ATOM 1181 C CYS A 864 11.064 -16.060 16.372 1.00 52.11 C ATOM 1182 O CYS A 864 11.482 -15.406 17.326 1.00 13.12 O ATOM 1183 CB CYS A 864 8.531 -15.961 16.324 1.00 32.11 C ATOM 1184 SG CYS A 864 8.327 -15.490 14.568 1.00 53.23 S ATOM 0 H CYS A 864 9.152 -17.132 18.472 1.00 73.52 H new ATOM 0 HA CYS A 864 9.710 -17.583 15.676 1.00 32.13 H new ATOM 0 HB2 CYS A 864 7.642 -16.485 16.674 1.00 32.11 H new ATOM 0 HB3 CYS A 864 8.637 -15.067 16.939 1.00 32.11 H new ATOM 0 HG CYS A 864 8.168 -16.560 13.847 1.00 53.23 H new ATOM 1190 N ALA A 865 11.669 -16.142 15.196 1.00 32.21 N ATOM 1191 CA ALA A 865 12.915 -15.438 14.945 1.00 71.23 C ATOM 1192 C ALA A 865 12.614 -13.967 14.651 1.00 22.12 C ATOM 1193 O ALA A 865 13.514 -13.128 14.679 1.00 74.40 O ATOM 1194 CB ALA A 865 13.664 -16.120 13.798 1.00 23.23 C ATOM 0 H ALA A 865 11.319 -16.685 14.407 1.00 32.21 H new ATOM 0 HA ALA A 865 13.560 -15.474 15.823 1.00 71.23 H new ATOM 0 HB1 ALA A 865 14.599 -15.592 13.609 1.00 23.23 H new ATOM 0 HB2 ALA A 865 13.879 -17.154 14.068 1.00 23.23 H new ATOM 0 HB3 ALA A 865 13.048 -16.100 12.899 1.00 23.23 H new ATOM 1200 N ARG A 866 11.346 -13.699 14.377 1.00 42.35 N ATOM 1201 CA ARG A 866 10.916 -12.343 14.078 1.00 33.31 C ATOM 1202 C ARG A 866 11.403 -11.381 15.163 1.00 51.30 C ATOM 1203 O ARG A 866 12.107 -11.786 16.086 1.00 2.35 O ATOM 1204 CB ARG A 866 9.391 -12.259 13.978 1.00 23.13 C ATOM 1205 CG ARG A 866 8.876 -13.051 12.775 1.00 30.30 C ATOM 1206 CD ARG A 866 8.977 -12.226 11.491 1.00 40.51 C ATOM 1207 NE ARG A 866 8.402 -10.879 11.708 1.00 34.52 N ATOM 1208 CZ ARG A 866 7.077 -10.620 11.749 1.00 23.14 C ATOM 1209 NH1 ARG A 866 6.179 -11.615 11.588 1.00 10.21 N ATOM 1210 NH2 ARG A 866 6.674 -9.379 11.950 1.00 61.23 N ATOM 0 H ARG A 866 10.603 -14.397 14.356 1.00 42.35 H new ATOM 0 HA ARG A 866 11.348 -12.062 13.118 1.00 33.31 H new ATOM 0 HB2 ARG A 866 8.941 -12.646 14.892 1.00 23.13 H new ATOM 0 HB3 ARG A 866 9.086 -11.216 13.889 1.00 23.13 H new ATOM 0 HG2 ARG A 866 9.452 -13.970 12.667 1.00 30.30 H new ATOM 0 HG3 ARG A 866 7.839 -13.342 12.944 1.00 30.30 H new ATOM 0 HD2 ARG A 866 10.020 -12.140 11.185 1.00 40.51 H new ATOM 0 HD3 ARG A 866 8.448 -12.730 10.682 1.00 40.51 H new ATOM 0 HE ARG A 866 9.046 -10.098 11.834 1.00 34.52 H new ATOM 0 HH11 ARG A 866 6.499 -12.571 11.434 1.00 10.21 H new ATOM 0 HH12 ARG A 866 5.180 -11.411 11.620 1.00 10.21 H new ATOM 0 HH21 ARG A 866 7.360 -8.634 12.071 1.00 61.23 H new ATOM 0 HH22 ARG A 866 5.677 -9.166 11.984 1.00 61.23 H new ATOM 1223 N GLN A 867 11.008 -10.125 15.015 1.00 4.52 N ATOM 1224 CA GLN A 867 11.396 -9.101 15.971 1.00 41.01 C ATOM 1225 C GLN A 867 10.908 -9.472 17.373 1.00 44.21 C ATOM 1226 O GLN A 867 11.435 -8.977 18.368 1.00 1.12 O ATOM 1227 CB GLN A 867 10.865 -7.729 15.551 1.00 61.13 C ATOM 1228 CG GLN A 867 11.864 -7.010 14.642 1.00 54.53 C ATOM 1229 CD GLN A 867 12.881 -6.216 15.464 1.00 21.44 C ATOM 1230 OE1 GLN A 867 13.111 -6.477 16.634 1.00 60.32 O ATOM 1231 NE2 GLN A 867 13.476 -5.236 14.790 1.00 33.22 N ATOM 0 H GLN A 867 10.423 -9.793 14.248 1.00 4.52 H new ATOM 0 HA GLN A 867 12.484 -9.043 15.990 1.00 41.01 H new ATOM 0 HB2 GLN A 867 9.914 -7.846 15.031 1.00 61.13 H new ATOM 0 HB3 GLN A 867 10.672 -7.123 16.436 1.00 61.13 H new ATOM 0 HG2 GLN A 867 12.384 -7.738 14.019 1.00 54.53 H new ATOM 0 HG3 GLN A 867 11.331 -6.338 13.969 1.00 54.53 H new ATOM 0 HE21 GLN A 867 13.237 -5.071 13.812 1.00 33.22 H new ATOM 0 HE22 GLN A 867 14.171 -4.649 15.251 1.00 33.22 H new ATOM 1240 N ASN A 868 9.908 -10.339 17.406 1.00 33.44 N ATOM 1241 CA ASN A 868 9.343 -10.782 18.670 1.00 60.21 C ATOM 1242 C ASN A 868 9.968 -12.123 19.061 1.00 3.31 C ATOM 1243 O ASN A 868 10.092 -13.020 18.229 1.00 25.12 O ATOM 1244 CB ASN A 868 7.830 -10.981 18.558 1.00 63.05 C ATOM 1245 CG ASN A 868 7.099 -9.637 18.563 1.00 73.32 C ATOM 1246 OD1 ASN A 868 6.942 -8.982 17.545 1.00 22.35 O ATOM 1247 ND2 ASN A 868 6.661 -9.265 19.762 1.00 11.50 N ATOM 0 H ASN A 868 9.474 -10.747 16.578 1.00 33.44 H new ATOM 0 HA ASN A 868 9.552 -10.018 19.419 1.00 60.21 H new ATOM 0 HB2 ASN A 868 7.598 -11.522 17.641 1.00 63.05 H new ATOM 0 HB3 ASN A 868 7.478 -11.594 19.388 1.00 63.05 H new ATOM 0 HD21 ASN A 868 6.159 -8.384 19.871 1.00 11.50 H new ATOM 0 HD22 ASN A 868 6.827 -9.861 20.573 1.00 11.50 H new ATOM 1254 N CYS A 869 10.345 -12.216 20.328 1.00 65.23 N ATOM 1255 CA CYS A 869 10.955 -13.432 20.839 1.00 32.04 C ATOM 1256 C CYS A 869 9.936 -14.140 21.734 1.00 31.15 C ATOM 1257 O CYS A 869 9.994 -15.357 21.906 1.00 43.34 O ATOM 1258 CB CYS A 869 12.261 -13.141 21.581 1.00 62.21 C ATOM 1259 SG CYS A 869 13.631 -12.949 20.383 1.00 22.11 S ATOM 0 H CYS A 869 10.240 -11.470 21.015 1.00 65.23 H new ATOM 0 HA CYS A 869 11.224 -14.085 20.008 1.00 32.04 H new ATOM 0 HB2 CYS A 869 12.157 -12.233 22.176 1.00 62.21 H new ATOM 0 HB3 CYS A 869 12.484 -13.952 22.274 1.00 62.21 H new ATOM 0 HG CYS A 869 14.735 -12.700 21.023 1.00 22.11 H new ATOM 1265 N SER A 870 9.026 -13.348 22.282 1.00 73.10 N ATOM 1266 CA SER A 870 7.995 -13.884 23.155 1.00 3.02 C ATOM 1267 C SER A 870 7.057 -14.794 22.360 1.00 13.21 C ATOM 1268 O SER A 870 6.287 -15.557 22.941 1.00 30.31 O ATOM 1269 CB SER A 870 7.203 -12.760 23.826 1.00 30.32 C ATOM 1270 OG SER A 870 6.211 -12.216 22.960 1.00 0.30 O ATOM 0 H SER A 870 8.981 -12.339 22.138 1.00 73.10 H new ATOM 0 HA SER A 870 8.479 -14.468 23.938 1.00 3.02 H new ATOM 0 HB2 SER A 870 6.726 -13.141 24.729 1.00 30.32 H new ATOM 0 HB3 SER A 870 7.887 -11.970 24.136 1.00 30.32 H new ATOM 0 HG SER A 870 5.726 -11.503 23.425 1.00 0.30 H new ATOM 1276 N HIS A 871 7.151 -14.682 21.043 1.00 24.24 N ATOM 1277 CA HIS A 871 6.320 -15.485 20.163 1.00 64.25 C ATOM 1278 C HIS A 871 6.785 -16.942 20.206 1.00 33.44 C ATOM 1279 O HIS A 871 7.879 -17.263 19.745 1.00 30.33 O ATOM 1280 CB HIS A 871 6.314 -14.907 18.746 1.00 73.41 C ATOM 1281 CG HIS A 871 5.487 -13.652 18.599 1.00 71.35 C ATOM 1282 ND1 HIS A 871 4.881 -13.024 19.672 1.00 13.41 N ATOM 1283 CD2 HIS A 871 5.174 -12.916 17.494 1.00 74.01 C ATOM 1284 CE1 HIS A 871 4.234 -11.959 19.222 1.00 15.31 C ATOM 1285 NE2 HIS A 871 4.416 -11.894 17.872 1.00 71.01 N ATOM 0 H HIS A 871 7.790 -14.047 20.564 1.00 24.24 H new ATOM 0 HA HIS A 871 5.287 -15.459 20.509 1.00 64.25 H new ATOM 0 HB2 HIS A 871 7.340 -14.691 18.448 1.00 73.41 H new ATOM 0 HB3 HIS A 871 5.935 -15.663 18.058 1.00 73.41 H new ATOM 0 HD1 HIS A 871 4.925 -13.329 20.644 1.00 13.41 H new ATOM 0 HD2 HIS A 871 5.489 -13.129 16.483 1.00 74.01 H new ATOM 0 HE1 HIS A 871 3.663 -11.264 19.820 1.00 15.31 H new ATOM 1293 N ASP A 872 5.929 -17.786 20.765 1.00 3.12 N ATOM 1294 CA ASP A 872 6.238 -19.201 20.875 1.00 30.53 C ATOM 1295 C ASP A 872 5.447 -19.975 19.819 1.00 73.31 C ATOM 1296 O ASP A 872 4.237 -19.796 19.690 1.00 35.52 O ATOM 1297 CB ASP A 872 5.847 -19.745 22.251 1.00 50.00 C ATOM 1298 CG ASP A 872 4.344 -19.762 22.536 1.00 31.32 C ATOM 1299 OD1 ASP A 872 3.622 -18.807 22.214 1.00 73.21 O ATOM 1300 OD2 ASP A 872 3.913 -20.827 23.123 1.00 14.13 O ATOM 0 H ASP A 872 5.022 -17.516 21.146 1.00 3.12 H new ATOM 0 HA ASP A 872 7.311 -19.324 20.730 1.00 30.53 H new ATOM 0 HB2 ASP A 872 6.231 -20.761 22.346 1.00 50.00 H new ATOM 0 HB3 ASP A 872 6.340 -19.145 23.016 1.00 50.00 H new ATOM 1306 N TRP A 873 6.162 -20.819 19.090 1.00 43.22 N ATOM 1307 CA TRP A 873 5.542 -21.621 18.049 1.00 41.53 C ATOM 1308 C TRP A 873 5.343 -23.035 18.597 1.00 63.14 C ATOM 1309 O TRP A 873 4.212 -23.500 18.729 1.00 63.34 O ATOM 1310 CB TRP A 873 6.372 -21.588 16.764 1.00 24.21 C ATOM 1311 CG TRP A 873 6.352 -20.239 16.043 1.00 13.34 C ATOM 1312 CD1 TRP A 873 5.896 -19.065 16.503 1.00 63.14 C ATOM 1313 CD2 TRP A 873 6.828 -19.970 14.708 1.00 52.12 C ATOM 1314 NE1 TRP A 873 6.043 -18.064 15.565 1.00 43.54 N ATOM 1315 CE2 TRP A 873 6.628 -18.631 14.439 1.00 71.35 C ATOM 1316 CE3 TRP A 873 7.408 -20.829 13.759 1.00 64.44 C ATOM 1317 CZ2 TRP A 873 6.980 -18.033 13.223 1.00 52.03 C ATOM 1318 CZ3 TRP A 873 7.754 -20.216 12.549 1.00 65.05 C ATOM 1319 CH2 TRP A 873 7.560 -18.870 12.262 1.00 53.01 C ATOM 0 H TRP A 873 7.166 -20.965 19.200 1.00 43.22 H new ATOM 0 HA TRP A 873 4.568 -21.214 17.776 1.00 41.53 H new ATOM 0 HB2 TRP A 873 7.404 -21.845 17.004 1.00 24.21 H new ATOM 0 HB3 TRP A 873 6.002 -22.356 16.085 1.00 24.21 H new ATOM 0 HD1 TRP A 873 5.468 -18.921 17.484 1.00 63.14 H new ATOM 0 HE1 TRP A 873 5.772 -17.087 15.677 1.00 43.54 H new ATOM 0 HE3 TRP A 873 7.574 -21.879 13.948 1.00 64.44 H new ATOM 0 HZ2 TRP A 873 6.813 -16.982 13.036 1.00 52.03 H new ATOM 0 HZ3 TRP A 873 8.203 -20.832 11.785 1.00 65.05 H new ATOM 0 HH2 TRP A 873 7.855 -18.472 11.303 1.00 53.01 H new ATOM 1330 N GLY A 874 6.460 -23.680 18.901 1.00 41.21 N ATOM 1331 CA GLY A 874 6.423 -25.032 19.432 1.00 52.04 C ATOM 1332 C GLY A 874 7.542 -25.252 20.452 1.00 53.42 C ATOM 1333 O GLY A 874 7.717 -24.450 21.368 1.00 45.11 O ATOM 0 H GLY A 874 7.396 -23.291 18.790 1.00 41.21 H new ATOM 0 HA2 GLY A 874 5.457 -25.216 19.902 1.00 52.04 H new ATOM 0 HA3 GLY A 874 6.523 -25.749 18.617 1.00 52.04 H new ATOM 1337 N ILE A 875 8.269 -26.342 20.259 1.00 42.01 N ATOM 1338 CA ILE A 875 9.366 -26.677 21.151 1.00 62.21 C ATOM 1339 C ILE A 875 10.257 -27.728 20.485 1.00 52.25 C ATOM 1340 O ILE A 875 9.764 -28.611 19.785 1.00 52.15 O ATOM 1341 CB ILE A 875 8.832 -27.103 22.520 1.00 5.52 C ATOM 1342 CG1 ILE A 875 7.491 -27.825 22.385 1.00 33.53 C ATOM 1343 CG2 ILE A 875 8.746 -25.907 23.471 1.00 42.43 C ATOM 1344 CD1 ILE A 875 7.601 -29.011 21.424 1.00 12.13 C ATOM 0 H ILE A 875 8.120 -27.005 19.498 1.00 42.01 H new ATOM 0 HA ILE A 875 9.988 -25.801 21.335 1.00 62.21 H new ATOM 0 HB ILE A 875 9.536 -27.811 22.956 1.00 5.52 H new ATOM 0 HG12 ILE A 875 7.162 -28.175 23.364 1.00 33.53 H new ATOM 0 HG13 ILE A 875 6.734 -27.129 22.024 1.00 33.53 H new ATOM 0 HG21 ILE A 875 8.364 -26.237 24.437 1.00 42.43 H new ATOM 0 HG22 ILE A 875 9.738 -25.474 23.602 1.00 42.43 H new ATOM 0 HG23 ILE A 875 8.075 -25.157 23.052 1.00 42.43 H new ATOM 0 HD11 ILE A 875 6.634 -29.507 21.346 1.00 12.13 H new ATOM 0 HD12 ILE A 875 7.907 -28.655 20.440 1.00 12.13 H new ATOM 0 HD13 ILE A 875 8.341 -29.717 21.800 1.00 12.13 H new ATOM 1356 N HIS A 876 11.553 -27.597 20.726 1.00 60.42 N ATOM 1357 CA HIS A 876 12.517 -28.525 20.158 1.00 51.42 C ATOM 1358 C HIS A 876 12.557 -29.802 20.999 1.00 63.12 C ATOM 1359 O HIS A 876 13.022 -29.786 22.137 1.00 4.34 O ATOM 1360 CB HIS A 876 13.889 -27.863 20.018 1.00 64.22 C ATOM 1361 CG HIS A 876 14.699 -28.370 18.848 1.00 71.10 C ATOM 1362 ND1 HIS A 876 14.859 -27.648 17.678 1.00 3.13 N ATOM 1363 CD2 HIS A 876 15.392 -29.533 18.681 1.00 74.04 C ATOM 1364 CE1 HIS A 876 15.615 -28.354 16.851 1.00 65.30 C ATOM 1365 NE2 HIS A 876 15.944 -29.522 17.474 1.00 71.52 N ATOM 0 H HIS A 876 11.958 -26.863 21.307 1.00 60.42 H new ATOM 0 HA HIS A 876 12.209 -28.805 19.151 1.00 51.42 H new ATOM 0 HB2 HIS A 876 13.753 -26.787 19.913 1.00 64.22 H new ATOM 0 HB3 HIS A 876 14.455 -28.025 20.936 1.00 64.22 H new ATOM 0 HD2 HIS A 876 15.477 -30.328 19.407 1.00 74.04 H new ATOM 0 HE1 HIS A 876 15.918 -28.057 15.858 1.00 65.30 H new ATOM 0 HE2 HIS A 876 16.520 -30.265 17.077 1.00 71.52 H new ATOM 1373 N VAL A 877 12.064 -30.879 20.405 1.00 13.22 N ATOM 1374 CA VAL A 877 12.037 -32.163 21.085 1.00 4.43 C ATOM 1375 C VAL A 877 13.072 -33.093 20.449 1.00 23.04 C ATOM 1376 O VAL A 877 13.830 -32.678 19.573 1.00 32.45 O ATOM 1377 CB VAL A 877 10.620 -32.739 21.061 1.00 43.03 C ATOM 1378 CG1 VAL A 877 9.615 -31.746 21.647 1.00 35.42 C ATOM 1379 CG2 VAL A 877 10.221 -33.151 19.643 1.00 73.35 C ATOM 0 H VAL A 877 11.680 -30.889 19.460 1.00 13.22 H new ATOM 0 HA VAL A 877 12.307 -32.045 22.135 1.00 4.43 H new ATOM 0 HB VAL A 877 10.610 -33.633 21.685 1.00 43.03 H new ATOM 0 HG11 VAL A 877 8.616 -32.180 21.618 1.00 35.42 H new ATOM 0 HG12 VAL A 877 9.884 -31.523 22.679 1.00 35.42 H new ATOM 0 HG13 VAL A 877 9.628 -30.827 21.062 1.00 35.42 H new ATOM 0 HG21 VAL A 877 9.210 -33.557 19.653 1.00 73.35 H new ATOM 0 HG22 VAL A 877 10.256 -32.281 18.988 1.00 73.35 H new ATOM 0 HG23 VAL A 877 10.913 -33.909 19.276 1.00 73.35 H new ATOM 1389 N LYS A 878 13.071 -34.333 20.915 1.00 22.33 N ATOM 1390 CA LYS A 878 14.001 -35.326 20.403 1.00 14.11 C ATOM 1391 C LYS A 878 13.275 -36.663 20.244 1.00 71.41 C ATOM 1392 O LYS A 878 12.468 -37.041 21.092 1.00 24.14 O ATOM 1393 CB LYS A 878 15.245 -35.403 21.290 1.00 32.12 C ATOM 1394 CG LYS A 878 16.016 -36.701 21.041 1.00 43.41 C ATOM 1395 CD LYS A 878 16.710 -36.673 19.677 1.00 15.12 C ATOM 1396 CE LYS A 878 17.240 -38.058 19.304 1.00 64.32 C ATOM 1397 NZ LYS A 878 16.263 -39.105 19.676 1.00 71.52 N ATOM 0 H LYS A 878 12.441 -34.673 21.642 1.00 22.33 H new ATOM 0 HA LYS A 878 14.360 -35.038 19.415 1.00 14.11 H new ATOM 0 HB2 LYS A 878 15.891 -34.548 21.091 1.00 32.12 H new ATOM 0 HB3 LYS A 878 14.953 -35.345 22.338 1.00 32.12 H new ATOM 0 HG2 LYS A 878 16.757 -36.845 21.827 1.00 43.41 H new ATOM 0 HG3 LYS A 878 15.333 -37.549 21.088 1.00 43.41 H new ATOM 0 HD2 LYS A 878 16.009 -36.330 18.915 1.00 15.12 H new ATOM 0 HD3 LYS A 878 17.533 -35.958 19.698 1.00 15.12 H new ATOM 0 HE2 LYS A 878 17.438 -38.102 18.233 1.00 64.32 H new ATOM 0 HE3 LYS A 878 18.187 -38.240 19.811 1.00 64.32 H new ATOM 0 HZ1 LYS A 878 16.669 -39.712 20.417 1.00 71.52 H new ATOM 0 HZ2 LYS A 878 15.394 -38.658 20.033 1.00 71.52 H new ATOM 0 HZ3 LYS A 878 16.038 -39.682 18.841 1.00 71.52 H new ATOM 1410 N TYR A 879 13.588 -37.343 19.151 1.00 74.44 N ATOM 1411 CA TYR A 879 12.975 -38.631 18.869 1.00 4.23 C ATOM 1412 C TYR A 879 13.931 -39.533 18.085 1.00 11.23 C ATOM 1413 O TYR A 879 14.927 -39.062 17.539 1.00 2.41 O ATOM 1414 CB TYR A 879 11.748 -38.334 18.005 1.00 64.32 C ATOM 1415 CG TYR A 879 10.804 -39.526 17.835 1.00 30.03 C ATOM 1416 CD1 TYR A 879 10.644 -40.431 18.865 1.00 74.35 C ATOM 1417 CD2 TYR A 879 10.112 -39.696 16.653 1.00 3.30 C ATOM 1418 CE1 TYR A 879 9.755 -41.553 18.705 1.00 52.10 C ATOM 1419 CE2 TYR A 879 9.223 -40.817 16.493 1.00 24.35 C ATOM 1420 CZ TYR A 879 9.089 -41.691 17.527 1.00 14.43 C ATOM 1421 OH TYR A 879 8.249 -42.750 17.377 1.00 40.14 O ATOM 0 H TYR A 879 14.258 -37.027 18.450 1.00 74.44 H new ATOM 0 HA TYR A 879 12.719 -39.145 19.795 1.00 4.23 H new ATOM 0 HB2 TYR A 879 11.195 -37.506 18.449 1.00 64.32 H new ATOM 0 HB3 TYR A 879 12.081 -38.004 17.021 1.00 64.32 H new ATOM 0 HD1 TYR A 879 11.185 -40.298 19.790 1.00 74.35 H new ATOM 0 HD2 TYR A 879 10.238 -38.988 15.848 1.00 3.30 H new ATOM 0 HE1 TYR A 879 9.620 -42.269 19.503 1.00 52.10 H new ATOM 0 HE2 TYR A 879 8.675 -40.961 15.573 1.00 24.35 H new ATOM 0 HH TYR A 879 7.841 -42.720 16.486 1.00 40.14 H new ATOM 1431 N LYS A 880 13.593 -40.814 18.055 1.00 44.42 N ATOM 1432 CA LYS A 880 14.409 -41.786 17.347 1.00 51.22 C ATOM 1433 C LYS A 880 14.961 -41.149 16.070 1.00 54.22 C ATOM 1434 O LYS A 880 16.169 -40.963 15.937 1.00 42.12 O ATOM 1435 CB LYS A 880 13.617 -43.071 17.100 1.00 32.42 C ATOM 1436 CG LYS A 880 13.071 -43.640 18.412 1.00 44.51 C ATOM 1437 CD LYS A 880 14.093 -43.490 19.541 1.00 61.10 C ATOM 1438 CE LYS A 880 13.673 -44.297 20.771 1.00 13.11 C ATOM 1439 NZ LYS A 880 12.198 -44.386 20.853 1.00 34.11 N ATOM 0 H LYS A 880 12.766 -41.201 18.509 1.00 44.42 H new ATOM 0 HA LYS A 880 15.266 -42.078 17.954 1.00 51.22 H new ATOM 0 HB2 LYS A 880 12.793 -42.868 16.416 1.00 32.42 H new ATOM 0 HB3 LYS A 880 14.257 -43.810 16.618 1.00 32.42 H new ATOM 0 HG2 LYS A 880 12.149 -43.125 18.680 1.00 44.51 H new ATOM 0 HG3 LYS A 880 12.821 -44.693 18.280 1.00 44.51 H new ATOM 0 HD2 LYS A 880 15.071 -43.826 19.198 1.00 61.10 H new ATOM 0 HD3 LYS A 880 14.193 -42.438 19.808 1.00 61.10 H new ATOM 0 HE2 LYS A 880 14.101 -45.298 20.720 1.00 13.11 H new ATOM 0 HE3 LYS A 880 14.066 -43.827 21.673 1.00 13.11 H new ATOM 0 HZ1 LYS A 880 11.921 -44.690 21.808 1.00 34.11 H new ATOM 0 HZ2 LYS A 880 11.782 -43.454 20.652 1.00 34.11 H new ATOM 0 HZ3 LYS A 880 11.853 -45.077 20.157 1.00 34.11 H new ATOM 1452 N THR A 881 14.048 -40.832 15.163 1.00 43.21 N ATOM 1453 CA THR A 881 14.428 -40.220 13.901 1.00 4.52 C ATOM 1454 C THR A 881 15.508 -39.160 14.127 1.00 44.42 C ATOM 1455 O THR A 881 16.698 -39.440 13.984 1.00 14.33 O ATOM 1456 CB THR A 881 13.162 -39.667 13.244 1.00 44.34 C ATOM 1457 OG1 THR A 881 13.620 -38.538 12.504 1.00 11.10 O ATOM 1458 CG2 THR A 881 12.185 -39.075 14.261 1.00 51.52 C ATOM 0 H THR A 881 13.046 -40.988 15.277 1.00 43.21 H new ATOM 0 HA THR A 881 14.870 -40.951 13.224 1.00 4.52 H new ATOM 0 HB THR A 881 12.667 -40.461 12.685 1.00 44.34 H new ATOM 0 HG1 THR A 881 12.863 -38.119 12.044 1.00 11.10 H new ATOM 0 HG21 THR A 881 11.304 -38.697 13.742 1.00 51.52 H new ATOM 0 HG22 THR A 881 11.885 -39.847 14.970 1.00 51.52 H new ATOM 0 HG23 THR A 881 12.668 -38.258 14.797 1.00 51.52 H new ATOM 1466 N PHE A 882 15.055 -37.964 14.475 1.00 25.21 N ATOM 1467 CA PHE A 882 15.968 -36.861 14.722 1.00 42.22 C ATOM 1468 C PHE A 882 15.376 -35.875 15.731 1.00 42.42 C ATOM 1469 O PHE A 882 14.223 -36.013 16.136 1.00 22.03 O ATOM 1470 CB PHE A 882 16.174 -36.144 13.386 1.00 2.42 C ATOM 1471 CG PHE A 882 17.277 -36.752 12.517 1.00 53.31 C ATOM 1472 CD1 PHE A 882 18.583 -36.492 12.795 1.00 74.51 C ATOM 1473 CD2 PHE A 882 16.951 -37.551 11.466 1.00 31.42 C ATOM 1474 CE1 PHE A 882 19.606 -37.057 11.988 1.00 13.21 C ATOM 1475 CE2 PHE A 882 17.974 -38.116 10.659 1.00 1.34 C ATOM 1476 CZ PHE A 882 19.280 -37.856 10.937 1.00 30.44 C ATOM 0 H PHE A 882 14.068 -37.735 14.592 1.00 25.21 H new ATOM 0 HA PHE A 882 16.906 -37.238 15.130 1.00 42.22 H new ATOM 0 HB2 PHE A 882 15.237 -36.159 12.829 1.00 2.42 H new ATOM 0 HB3 PHE A 882 16.413 -35.098 13.580 1.00 2.42 H new ATOM 0 HD1 PHE A 882 18.842 -35.856 13.629 1.00 74.51 H new ATOM 0 HD2 PHE A 882 15.914 -37.756 11.245 1.00 31.42 H new ATOM 0 HE1 PHE A 882 20.643 -36.852 12.209 1.00 13.21 H new ATOM 0 HE2 PHE A 882 17.715 -38.752 9.825 1.00 1.34 H new ATOM 0 HZ PHE A 882 20.058 -38.284 10.323 1.00 30.44 H new ATOM 1486 N GLU A 883 16.192 -34.901 16.107 1.00 22.11 N ATOM 1487 CA GLU A 883 15.764 -33.892 17.061 1.00 72.11 C ATOM 1488 C GLU A 883 15.195 -32.676 16.327 1.00 4.45 C ATOM 1489 O GLU A 883 15.947 -31.826 15.852 1.00 61.24 O ATOM 1490 CB GLU A 883 16.914 -33.487 17.985 1.00 62.24 C ATOM 1491 CG GLU A 883 18.201 -33.258 17.190 1.00 63.44 C ATOM 1492 CD GLU A 883 19.228 -32.484 18.019 1.00 53.01 C ATOM 1493 OE1 GLU A 883 20.230 -33.063 18.463 1.00 62.22 O ATOM 1494 OE2 GLU A 883 18.955 -31.236 18.196 1.00 3.41 O ATOM 0 H GLU A 883 17.148 -34.789 15.768 1.00 22.11 H new ATOM 0 HA GLU A 883 14.977 -34.318 17.682 1.00 72.11 H new ATOM 0 HB2 GLU A 883 16.649 -32.578 18.525 1.00 62.24 H new ATOM 0 HB3 GLU A 883 17.077 -34.265 18.731 1.00 62.24 H new ATOM 0 HG2 GLU A 883 18.621 -34.217 16.887 1.00 63.44 H new ATOM 0 HG3 GLU A 883 17.975 -32.707 16.277 1.00 63.44 H new ATOM 1502 N ILE A 884 13.873 -32.630 16.259 1.00 20.41 N ATOM 1503 CA ILE A 884 13.195 -31.532 15.592 1.00 63.04 C ATOM 1504 C ILE A 884 12.054 -31.028 16.478 1.00 25.30 C ATOM 1505 O ILE A 884 11.627 -31.722 17.399 1.00 34.02 O ATOM 1506 CB ILE A 884 12.746 -31.952 14.191 1.00 41.24 C ATOM 1507 CG1 ILE A 884 12.435 -33.449 14.140 1.00 32.02 C ATOM 1508 CG2 ILE A 884 13.780 -31.546 13.139 1.00 41.54 C ATOM 1509 CD1 ILE A 884 11.333 -33.814 15.137 1.00 1.22 C ATOM 0 H ILE A 884 13.253 -33.336 16.655 1.00 20.41 H new ATOM 0 HA ILE A 884 13.878 -30.695 15.446 1.00 63.04 H new ATOM 0 HB ILE A 884 11.822 -31.423 13.956 1.00 41.24 H new ATOM 0 HG12 ILE A 884 12.125 -33.726 13.132 1.00 32.02 H new ATOM 0 HG13 ILE A 884 13.337 -34.019 14.364 1.00 32.02 H new ATOM 0 HG21 ILE A 884 13.436 -31.856 12.152 1.00 41.54 H new ATOM 0 HG22 ILE A 884 13.909 -30.464 13.155 1.00 41.54 H new ATOM 0 HG23 ILE A 884 14.732 -32.028 13.360 1.00 41.54 H new ATOM 0 HD11 ILE A 884 11.131 -34.884 15.081 1.00 1.22 H new ATOM 0 HD12 ILE A 884 11.656 -33.558 16.146 1.00 1.22 H new ATOM 0 HD13 ILE A 884 10.426 -33.260 14.895 1.00 1.22 H new ATOM 1521 N PRO A 885 11.582 -29.793 16.160 1.00 22.24 N ATOM 1522 CA PRO A 885 10.499 -29.188 16.917 1.00 23.54 C ATOM 1523 C PRO A 885 9.157 -29.831 16.563 1.00 72.12 C ATOM 1524 O PRO A 885 8.795 -29.914 15.390 1.00 14.32 O ATOM 1525 CB PRO A 885 10.559 -27.709 16.575 1.00 15.21 C ATOM 1526 CG PRO A 885 11.366 -27.610 15.291 1.00 5.24 C ATOM 1527 CD PRO A 885 12.065 -28.943 15.076 1.00 14.32 C ATOM 0 HA PRO A 885 10.601 -29.338 17.992 1.00 23.54 H new ATOM 0 HB2 PRO A 885 9.558 -27.299 16.440 1.00 15.21 H new ATOM 0 HB3 PRO A 885 11.031 -27.142 17.377 1.00 15.21 H new ATOM 0 HG2 PRO A 885 10.715 -27.380 14.448 1.00 5.24 H new ATOM 0 HG3 PRO A 885 12.096 -26.803 15.360 1.00 5.24 H new ATOM 0 HD2 PRO A 885 11.820 -29.366 14.102 1.00 14.32 H new ATOM 0 HD3 PRO A 885 13.149 -28.832 15.112 1.00 14.32 H new ATOM 1535 N VAL A 886 8.455 -30.269 17.598 1.00 62.44 N ATOM 1536 CA VAL A 886 7.161 -30.902 17.410 1.00 15.11 C ATOM 1537 C VAL A 886 6.058 -29.854 17.573 1.00 74.03 C ATOM 1538 O VAL A 886 5.982 -29.182 18.600 1.00 53.31 O ATOM 1539 CB VAL A 886 7.010 -32.082 18.372 1.00 24.12 C ATOM 1540 CG1 VAL A 886 5.535 -32.400 18.624 1.00 61.02 C ATOM 1541 CG2 VAL A 886 7.755 -33.313 17.851 1.00 45.51 C ATOM 0 H VAL A 886 8.758 -30.198 18.569 1.00 62.44 H new ATOM 0 HA VAL A 886 7.078 -31.309 16.402 1.00 15.11 H new ATOM 0 HB VAL A 886 7.458 -31.797 19.324 1.00 24.12 H new ATOM 0 HG11 VAL A 886 5.457 -33.243 19.311 1.00 61.02 H new ATOM 0 HG12 VAL A 886 5.044 -31.530 19.060 1.00 61.02 H new ATOM 0 HG13 VAL A 886 5.051 -32.655 17.681 1.00 61.02 H new ATOM 0 HG21 VAL A 886 7.632 -34.137 18.553 1.00 45.51 H new ATOM 0 HG22 VAL A 886 7.350 -33.600 16.880 1.00 45.51 H new ATOM 0 HG23 VAL A 886 8.815 -33.080 17.748 1.00 45.51 H new ATOM 1551 N ILE A 887 5.230 -29.748 16.543 1.00 1.25 N ATOM 1552 CA ILE A 887 4.135 -28.793 16.559 1.00 33.22 C ATOM 1553 C ILE A 887 2.805 -29.549 16.513 1.00 11.45 C ATOM 1554 O ILE A 887 2.767 -30.724 16.152 1.00 14.31 O ATOM 1555 CB ILE A 887 4.300 -27.770 15.434 1.00 53.20 C ATOM 1556 CG1 ILE A 887 5.779 -27.497 15.154 1.00 52.15 C ATOM 1557 CG2 ILE A 887 3.528 -26.485 15.744 1.00 65.12 C ATOM 1558 CD1 ILE A 887 6.429 -26.747 16.318 1.00 34.44 C ATOM 0 H ILE A 887 5.296 -30.308 15.693 1.00 1.25 H new ATOM 0 HA ILE A 887 4.144 -28.218 17.485 1.00 33.22 H new ATOM 0 HB ILE A 887 3.873 -28.191 14.524 1.00 53.20 H new ATOM 0 HG12 ILE A 887 6.301 -28.439 14.987 1.00 52.15 H new ATOM 0 HG13 ILE A 887 5.878 -26.912 14.240 1.00 52.15 H new ATOM 0 HG21 ILE A 887 3.662 -25.774 14.928 1.00 65.12 H new ATOM 0 HG22 ILE A 887 2.468 -26.715 15.855 1.00 65.12 H new ATOM 0 HG23 ILE A 887 3.903 -26.049 16.670 1.00 65.12 H new ATOM 0 HD11 ILE A 887 7.480 -26.566 16.093 1.00 34.44 H new ATOM 0 HD12 ILE A 887 5.920 -25.794 16.466 1.00 34.44 H new ATOM 0 HD13 ILE A 887 6.350 -27.345 17.226 1.00 34.44 H new ATOM 1570 N LYS A 888 1.747 -28.843 16.885 1.00 40.20 N ATOM 1571 CA LYS A 888 0.419 -29.432 16.891 1.00 52.01 C ATOM 1572 C LYS A 888 -0.437 -28.760 15.815 1.00 71.40 C ATOM 1573 O LYS A 888 0.028 -27.857 15.121 1.00 33.32 O ATOM 1574 CB LYS A 888 -0.191 -29.365 18.292 1.00 10.45 C ATOM 1575 CG LYS A 888 -0.026 -27.968 18.896 1.00 72.14 C ATOM 1576 CD LYS A 888 -0.668 -27.891 20.282 1.00 1.44 C ATOM 1577 CE LYS A 888 -0.807 -26.438 20.742 1.00 51.13 C ATOM 1578 NZ LYS A 888 -1.462 -26.374 22.068 1.00 43.15 N ATOM 0 H LYS A 888 1.783 -27.869 17.184 1.00 40.20 H new ATOM 0 HA LYS A 888 0.472 -30.492 16.642 1.00 52.01 H new ATOM 0 HB2 LYS A 888 -1.249 -29.622 18.244 1.00 10.45 H new ATOM 0 HB3 LYS A 888 0.287 -30.103 18.936 1.00 10.45 H new ATOM 0 HG2 LYS A 888 1.033 -27.722 18.968 1.00 72.14 H new ATOM 0 HG3 LYS A 888 -0.482 -27.227 18.239 1.00 72.14 H new ATOM 0 HD2 LYS A 888 -1.650 -28.364 20.259 1.00 1.44 H new ATOM 0 HD3 LYS A 888 -0.063 -28.447 20.998 1.00 1.44 H new ATOM 0 HE2 LYS A 888 0.177 -25.971 20.793 1.00 51.13 H new ATOM 0 HE3 LYS A 888 -1.390 -25.874 20.014 1.00 51.13 H new ATOM 0 HZ1 LYS A 888 -1.548 -25.381 22.365 1.00 43.15 H new ATOM 0 HZ2 LYS A 888 -2.408 -26.801 22.009 1.00 43.15 H new ATOM 0 HZ3 LYS A 888 -0.890 -26.895 22.763 1.00 43.15 H new ATOM 1591 N ILE A 889 -1.672 -29.228 15.710 1.00 54.41 N ATOM 1592 CA ILE A 889 -2.597 -28.684 14.730 1.00 14.52 C ATOM 1593 C ILE A 889 -3.151 -27.352 15.242 1.00 44.01 C ATOM 1594 O ILE A 889 -3.417 -26.443 14.457 1.00 62.43 O ATOM 1595 CB ILE A 889 -3.680 -29.709 14.389 1.00 54.13 C ATOM 1596 CG1 ILE A 889 -4.574 -29.205 13.254 1.00 52.04 C ATOM 1597 CG2 ILE A 889 -4.490 -30.086 15.631 1.00 23.02 C ATOM 1598 CD1 ILE A 889 -4.053 -29.677 11.895 1.00 72.13 C ATOM 0 H ILE A 889 -2.054 -29.978 16.287 1.00 54.41 H new ATOM 0 HA ILE A 889 -2.080 -28.476 13.793 1.00 14.52 H new ATOM 0 HB ILE A 889 -3.191 -30.617 14.036 1.00 54.13 H new ATOM 0 HG12 ILE A 889 -5.593 -29.564 13.402 1.00 52.04 H new ATOM 0 HG13 ILE A 889 -4.614 -28.116 13.274 1.00 52.04 H new ATOM 0 HG21 ILE A 889 -5.253 -30.816 15.360 1.00 23.02 H new ATOM 0 HG22 ILE A 889 -3.827 -30.516 16.381 1.00 23.02 H new ATOM 0 HG23 ILE A 889 -4.969 -29.195 16.038 1.00 23.02 H new ATOM 0 HD11 ILE A 889 -4.706 -29.305 11.106 1.00 72.13 H new ATOM 0 HD12 ILE A 889 -3.044 -29.296 11.740 1.00 72.13 H new ATOM 0 HD13 ILE A 889 -4.037 -30.767 11.870 1.00 72.13 H new ATOM 1610 N GLU A 890 -3.307 -27.279 16.555 1.00 12.55 N ATOM 1611 CA GLU A 890 -3.824 -26.073 17.181 1.00 21.23 C ATOM 1612 C GLU A 890 -2.671 -25.176 17.638 1.00 75.31 C ATOM 1613 O GLU A 890 -2.800 -24.445 18.619 1.00 73.14 O ATOM 1614 CB GLU A 890 -4.748 -26.416 18.351 1.00 34.01 C ATOM 1615 CG GLU A 890 -3.960 -27.024 19.513 1.00 32.11 C ATOM 1616 CD GLU A 890 -4.871 -27.857 20.417 1.00 72.20 C ATOM 1617 OE1 GLU A 890 -5.982 -27.419 20.751 1.00 52.05 O ATOM 1618 OE2 GLU A 890 -4.389 -28.999 20.774 1.00 64.13 O ATOM 0 H GLU A 890 -3.085 -28.035 17.203 1.00 12.55 H new ATOM 0 HA GLU A 890 -4.413 -25.528 16.443 1.00 21.23 H new ATOM 0 HB2 GLU A 890 -5.263 -25.516 18.688 1.00 34.01 H new ATOM 0 HB3 GLU A 890 -5.514 -27.117 18.020 1.00 34.01 H new ATOM 0 HG2 GLU A 890 -3.157 -27.650 19.124 1.00 32.11 H new ATOM 0 HG3 GLU A 890 -3.492 -26.230 20.095 1.00 32.11 H new ATOM 1626 N SER A 891 -1.571 -25.262 16.905 1.00 51.10 N ATOM 1627 CA SER A 891 -0.397 -24.467 17.222 1.00 22.14 C ATOM 1628 C SER A 891 -0.284 -23.289 16.252 1.00 33.24 C ATOM 1629 O SER A 891 0.155 -22.206 16.634 1.00 13.43 O ATOM 1630 CB SER A 891 0.874 -25.318 17.174 1.00 72.04 C ATOM 1631 OG SER A 891 2.039 -24.526 16.958 1.00 32.02 O ATOM 0 H SER A 891 -1.468 -25.870 16.093 1.00 51.10 H new ATOM 0 HA SER A 891 -0.508 -24.084 18.237 1.00 22.14 H new ATOM 0 HB2 SER A 891 0.978 -25.868 18.109 1.00 72.04 H new ATOM 0 HB3 SER A 891 0.785 -26.057 16.378 1.00 72.04 H new ATOM 0 HG SER A 891 2.501 -24.385 17.810 1.00 32.02 H new ATOM 1637 N PHE A 892 -0.689 -23.541 15.016 1.00 23.51 N ATOM 1638 CA PHE A 892 -0.639 -22.515 13.988 1.00 21.54 C ATOM 1639 C PHE A 892 -1.918 -22.518 13.149 1.00 50.31 C ATOM 1640 O PHE A 892 -2.840 -23.286 13.419 1.00 54.45 O ATOM 1641 CB PHE A 892 0.551 -22.845 13.085 1.00 73.24 C ATOM 1642 CG PHE A 892 0.700 -24.335 12.771 1.00 73.31 C ATOM 1643 CD1 PHE A 892 -0.330 -25.017 12.201 1.00 15.44 C ATOM 1644 CD2 PHE A 892 1.862 -24.979 13.062 1.00 41.53 C ATOM 1645 CE1 PHE A 892 -0.192 -26.399 11.910 1.00 32.53 C ATOM 1646 CE2 PHE A 892 2.000 -26.362 12.771 1.00 43.53 C ATOM 1647 CZ PHE A 892 0.970 -27.043 12.201 1.00 1.21 C ATOM 0 H PHE A 892 -1.053 -24.441 14.703 1.00 23.51 H new ATOM 0 HA PHE A 892 -0.540 -21.531 14.447 1.00 21.54 H new ATOM 0 HB2 PHE A 892 0.447 -22.296 12.149 1.00 73.24 H new ATOM 0 HB3 PHE A 892 1.465 -22.492 13.562 1.00 73.24 H new ATOM 0 HD1 PHE A 892 -1.253 -24.506 11.970 1.00 15.44 H new ATOM 0 HD2 PHE A 892 2.680 -24.438 13.515 1.00 41.53 H new ATOM 0 HE1 PHE A 892 -1.010 -26.940 11.457 1.00 32.53 H new ATOM 0 HE2 PHE A 892 2.923 -26.873 13.002 1.00 43.53 H new ATOM 0 HZ PHE A 892 1.075 -28.095 11.980 1.00 1.21 H new ATOM 1657 N VAL A 893 -1.933 -21.650 12.148 1.00 5.42 N ATOM 1658 CA VAL A 893 -3.083 -21.542 11.268 1.00 53.34 C ATOM 1659 C VAL A 893 -2.662 -21.894 9.839 1.00 1.45 C ATOM 1660 O VAL A 893 -1.472 -21.925 9.529 1.00 0.53 O ATOM 1661 CB VAL A 893 -3.701 -20.147 11.382 1.00 1.40 C ATOM 1662 CG1 VAL A 893 -3.632 -19.633 12.822 1.00 74.14 C ATOM 1663 CG2 VAL A 893 -3.027 -19.168 10.418 1.00 32.00 C ATOM 0 H VAL A 893 -1.166 -21.015 11.927 1.00 5.42 H new ATOM 0 HA VAL A 893 -3.857 -22.251 11.563 1.00 53.34 H new ATOM 0 HB VAL A 893 -4.752 -20.222 11.103 1.00 1.40 H new ATOM 0 HG11 VAL A 893 -4.078 -18.640 12.876 1.00 74.14 H new ATOM 0 HG12 VAL A 893 -4.178 -20.312 13.477 1.00 74.14 H new ATOM 0 HG13 VAL A 893 -2.591 -19.581 13.140 1.00 74.14 H new ATOM 0 HG21 VAL A 893 -3.485 -18.184 10.519 1.00 32.00 H new ATOM 0 HG22 VAL A 893 -1.965 -19.100 10.653 1.00 32.00 H new ATOM 0 HG23 VAL A 893 -3.150 -19.522 9.395 1.00 32.00 H new ATOM 1673 N VAL A 894 -3.661 -22.150 9.008 1.00 70.10 N ATOM 1674 CA VAL A 894 -3.409 -22.499 7.620 1.00 1.41 C ATOM 1675 C VAL A 894 -4.148 -21.516 6.710 1.00 74.24 C ATOM 1676 O VAL A 894 -5.376 -21.541 6.631 1.00 43.32 O ATOM 1677 CB VAL A 894 -3.798 -23.957 7.368 1.00 53.44 C ATOM 1678 CG1 VAL A 894 -2.566 -24.864 7.384 1.00 14.23 C ATOM 1679 CG2 VAL A 894 -4.841 -24.429 8.382 1.00 32.25 C ATOM 0 H VAL A 894 -4.647 -22.123 9.269 1.00 70.10 H new ATOM 0 HA VAL A 894 -2.346 -22.417 7.392 1.00 1.41 H new ATOM 0 HB VAL A 894 -4.245 -24.018 6.376 1.00 53.44 H new ATOM 0 HG11 VAL A 894 -2.871 -25.895 7.202 1.00 14.23 H new ATOM 0 HG12 VAL A 894 -1.872 -24.548 6.605 1.00 14.23 H new ATOM 0 HG13 VAL A 894 -2.077 -24.796 8.356 1.00 14.23 H new ATOM 0 HG21 VAL A 894 -5.100 -25.468 8.180 1.00 32.25 H new ATOM 0 HG22 VAL A 894 -4.433 -24.345 9.389 1.00 32.25 H new ATOM 0 HG23 VAL A 894 -5.734 -23.810 8.300 1.00 32.25 H new ATOM 1689 N GLU A 895 -3.370 -20.675 6.045 1.00 54.31 N ATOM 1690 CA GLU A 895 -3.936 -19.686 5.143 1.00 51.20 C ATOM 1691 C GLU A 895 -3.535 -19.994 3.699 1.00 54.42 C ATOM 1692 O GLU A 895 -2.444 -19.631 3.263 1.00 2.11 O ATOM 1693 CB GLU A 895 -3.508 -18.272 5.541 1.00 10.03 C ATOM 1694 CG GLU A 895 -4.370 -17.220 4.840 1.00 20.13 C ATOM 1695 CD GLU A 895 -3.694 -15.848 4.873 1.00 55.45 C ATOM 1696 OE1 GLU A 895 -2.566 -15.700 4.379 1.00 33.25 O ATOM 1697 OE2 GLU A 895 -4.384 -14.913 5.434 1.00 74.41 O ATOM 0 H GLU A 895 -2.352 -20.658 6.113 1.00 54.31 H new ATOM 0 HA GLU A 895 -5.022 -19.735 5.217 1.00 51.20 H new ATOM 0 HB2 GLU A 895 -3.591 -18.154 6.621 1.00 10.03 H new ATOM 0 HB3 GLU A 895 -2.460 -18.119 5.283 1.00 10.03 H new ATOM 0 HG2 GLU A 895 -4.546 -17.518 3.806 1.00 20.13 H new ATOM 0 HG3 GLU A 895 -5.345 -17.161 5.325 1.00 20.13 H new ATOM 1705 N ASP A 896 -4.440 -20.659 2.996 1.00 32.34 N ATOM 1706 CA ASP A 896 -4.195 -21.020 1.610 1.00 24.04 C ATOM 1707 C ASP A 896 -3.643 -19.805 0.862 1.00 61.12 C ATOM 1708 O ASP A 896 -4.061 -18.675 1.111 1.00 30.41 O ATOM 1709 CB ASP A 896 -5.487 -21.455 0.917 1.00 32.43 C ATOM 1710 CG ASP A 896 -5.604 -22.957 0.650 1.00 25.43 C ATOM 1711 OD1 ASP A 896 -6.442 -23.649 1.247 1.00 30.11 O ATOM 1712 OD2 ASP A 896 -4.776 -23.421 -0.224 1.00 30.42 O ATOM 0 H ASP A 896 -5.345 -20.957 3.361 1.00 32.34 H new ATOM 0 HA ASP A 896 -3.484 -21.846 1.597 1.00 24.04 H new ATOM 0 HB2 ASP A 896 -6.333 -21.143 1.530 1.00 32.43 H new ATOM 0 HB3 ASP A 896 -5.569 -20.925 -0.032 1.00 32.43 H new ATOM 1718 N ILE A 897 -2.712 -20.079 -0.041 1.00 12.44 N ATOM 1719 CA ILE A 897 -2.099 -19.022 -0.827 1.00 41.11 C ATOM 1720 C ILE A 897 -2.934 -18.778 -2.085 1.00 74.24 C ATOM 1721 O ILE A 897 -2.728 -17.792 -2.791 1.00 2.24 O ATOM 1722 CB ILE A 897 -0.633 -19.351 -1.117 1.00 31.45 C ATOM 1723 CG1 ILE A 897 -0.016 -20.158 0.028 1.00 72.32 C ATOM 1724 CG2 ILE A 897 0.165 -18.081 -1.418 1.00 22.43 C ATOM 1725 CD1 ILE A 897 0.179 -21.621 -0.376 1.00 34.24 C ATOM 0 H ILE A 897 -2.368 -21.017 -0.245 1.00 12.44 H new ATOM 0 HA ILE A 897 -2.087 -18.088 -0.265 1.00 41.11 H new ATOM 0 HB ILE A 897 -0.593 -19.975 -2.010 1.00 31.45 H new ATOM 0 HG12 ILE A 897 0.943 -19.723 0.308 1.00 72.32 H new ATOM 0 HG13 ILE A 897 -0.660 -20.102 0.906 1.00 72.32 H new ATOM 0 HG21 ILE A 897 1.203 -18.343 -1.621 1.00 22.43 H new ATOM 0 HG22 ILE A 897 -0.260 -17.582 -2.289 1.00 22.43 H new ATOM 0 HG23 ILE A 897 0.121 -17.411 -0.559 1.00 22.43 H new ATOM 0 HD11 ILE A 897 0.619 -22.172 0.455 1.00 34.24 H new ATOM 0 HD12 ILE A 897 -0.785 -22.059 -0.632 1.00 34.24 H new ATOM 0 HD13 ILE A 897 0.843 -21.675 -1.239 1.00 34.24 H new ATOM 1737 N ALA A 898 -3.861 -19.694 -2.329 1.00 4.14 N ATOM 1738 CA ALA A 898 -4.728 -19.591 -3.490 1.00 13.25 C ATOM 1739 C ALA A 898 -6.052 -18.945 -3.076 1.00 32.34 C ATOM 1740 O ALA A 898 -6.819 -18.493 -3.925 1.00 21.52 O ATOM 1741 CB ALA A 898 -4.923 -20.977 -4.106 1.00 73.50 C ATOM 0 H ALA A 898 -4.030 -20.511 -1.742 1.00 4.14 H new ATOM 0 HA ALA A 898 -4.276 -18.957 -4.252 1.00 13.25 H new ATOM 0 HB1 ALA A 898 -5.574 -20.900 -4.977 1.00 73.50 H new ATOM 0 HB2 ALA A 898 -3.957 -21.380 -4.409 1.00 73.50 H new ATOM 0 HB3 ALA A 898 -5.378 -21.641 -3.371 1.00 73.50 H new ATOM 1747 N THR A 899 -6.280 -18.923 -1.771 1.00 12.53 N ATOM 1748 CA THR A 899 -7.498 -18.340 -1.234 1.00 12.22 C ATOM 1749 C THR A 899 -7.163 -17.239 -0.225 1.00 73.32 C ATOM 1750 O THR A 899 -7.724 -16.146 -0.285 1.00 21.02 O ATOM 1751 CB THR A 899 -8.342 -19.470 -0.642 1.00 31.33 C ATOM 1752 OG1 THR A 899 -7.742 -19.724 0.626 1.00 72.24 O ATOM 1753 CG2 THR A 899 -8.175 -20.787 -1.404 1.00 1.44 C ATOM 0 H THR A 899 -5.642 -19.299 -1.070 1.00 12.53 H new ATOM 0 HA THR A 899 -8.082 -17.854 -2.016 1.00 12.22 H new ATOM 0 HB THR A 899 -9.392 -19.179 -0.646 1.00 31.33 H new ATOM 0 HG1 THR A 899 -8.316 -20.325 1.145 1.00 72.24 H new ATOM 0 HG21 THR A 899 -8.795 -21.555 -0.943 1.00 1.44 H new ATOM 0 HG22 THR A 899 -8.480 -20.648 -2.441 1.00 1.44 H new ATOM 0 HG23 THR A 899 -7.130 -21.096 -1.371 1.00 1.44 H new ATOM 1761 N GLY A 900 -6.251 -17.566 0.678 1.00 64.32 N ATOM 1762 CA GLY A 900 -5.834 -16.619 1.698 1.00 32.21 C ATOM 1763 C GLY A 900 -6.707 -16.741 2.949 1.00 74.05 C ATOM 1764 O GLY A 900 -6.685 -15.866 3.813 1.00 75.30 O ATOM 0 H GLY A 900 -5.789 -18.474 0.725 1.00 64.32 H new ATOM 0 HA2 GLY A 900 -4.791 -16.796 1.959 1.00 32.21 H new ATOM 0 HA3 GLY A 900 -5.896 -15.604 1.304 1.00 32.21 H new ATOM 1768 N VAL A 901 -7.456 -17.833 3.005 1.00 64.03 N ATOM 1769 CA VAL A 901 -8.335 -18.081 4.135 1.00 44.30 C ATOM 1770 C VAL A 901 -7.559 -18.823 5.225 1.00 14.13 C ATOM 1771 O VAL A 901 -7.197 -19.986 5.052 1.00 11.43 O ATOM 1772 CB VAL A 901 -9.583 -18.833 3.672 1.00 75.44 C ATOM 1773 CG1 VAL A 901 -10.639 -18.877 4.778 1.00 31.41 C ATOM 1774 CG2 VAL A 901 -10.154 -18.215 2.394 1.00 42.23 C ATOM 0 H VAL A 901 -7.472 -18.556 2.286 1.00 64.03 H new ATOM 0 HA VAL A 901 -8.680 -17.141 4.564 1.00 44.30 H new ATOM 0 HB VAL A 901 -9.291 -19.859 3.447 1.00 75.44 H new ATOM 0 HG11 VAL A 901 -11.516 -19.418 4.422 1.00 31.41 H new ATOM 0 HG12 VAL A 901 -10.230 -19.384 5.652 1.00 31.41 H new ATOM 0 HG13 VAL A 901 -10.924 -17.861 5.049 1.00 31.41 H new ATOM 0 HG21 VAL A 901 -11.041 -18.769 2.087 1.00 42.23 H new ATOM 0 HG22 VAL A 901 -10.422 -17.175 2.581 1.00 42.23 H new ATOM 0 HG23 VAL A 901 -9.406 -18.260 1.602 1.00 42.23 H new ATOM 1784 N GLN A 902 -7.328 -18.120 6.325 1.00 63.45 N ATOM 1785 CA GLN A 902 -6.602 -18.698 7.443 1.00 31.30 C ATOM 1786 C GLN A 902 -7.575 -19.357 8.423 1.00 2.24 C ATOM 1787 O GLN A 902 -8.622 -18.793 8.737 1.00 31.12 O ATOM 1788 CB GLN A 902 -5.746 -17.642 8.146 1.00 74.44 C ATOM 1789 CG GLN A 902 -6.623 -16.617 8.866 1.00 15.43 C ATOM 1790 CD GLN A 902 -5.774 -15.493 9.465 1.00 73.25 C ATOM 1791 OE1 GLN A 902 -6.042 -14.316 9.287 1.00 30.14 O ATOM 1792 NE2 GLN A 902 -4.739 -15.921 10.181 1.00 45.31 N ATOM 0 H GLN A 902 -7.631 -17.156 6.465 1.00 63.45 H new ATOM 0 HA GLN A 902 -5.930 -19.465 7.058 1.00 31.30 H new ATOM 0 HB2 GLN A 902 -5.082 -18.125 8.863 1.00 74.44 H new ATOM 0 HB3 GLN A 902 -5.114 -17.136 7.416 1.00 74.44 H new ATOM 0 HG2 GLN A 902 -7.347 -16.198 8.167 1.00 15.43 H new ATOM 0 HG3 GLN A 902 -7.190 -17.109 9.656 1.00 15.43 H new ATOM 0 HE21 GLN A 902 -4.573 -16.921 10.290 1.00 45.31 H new ATOM 0 HE22 GLN A 902 -4.111 -15.249 10.622 1.00 45.31 H new ATOM 1801 N THR A 903 -7.194 -20.541 8.880 1.00 41.21 N ATOM 1802 CA THR A 903 -8.019 -21.282 9.818 1.00 33.12 C ATOM 1803 C THR A 903 -7.146 -22.149 10.728 1.00 51.34 C ATOM 1804 O THR A 903 -6.123 -22.676 10.293 1.00 33.13 O ATOM 1805 CB THR A 903 -9.044 -22.085 9.015 1.00 61.25 C ATOM 1806 OG1 THR A 903 -9.432 -21.202 7.966 1.00 63.25 O ATOM 1807 CG2 THR A 903 -10.338 -22.329 9.793 1.00 30.45 C ATOM 0 H THR A 903 -6.324 -21.005 8.618 1.00 41.21 H new ATOM 0 HA THR A 903 -8.560 -20.610 10.484 1.00 33.12 H new ATOM 0 HB THR A 903 -8.609 -23.042 8.726 1.00 61.25 H new ATOM 0 HG1 THR A 903 -10.095 -21.643 7.395 1.00 63.25 H new ATOM 0 HG21 THR A 903 -11.030 -22.903 9.177 1.00 30.45 H new ATOM 0 HG22 THR A 903 -10.116 -22.885 10.704 1.00 30.45 H new ATOM 0 HG23 THR A 903 -10.792 -21.373 10.054 1.00 30.45 H new ATOM 1815 N LEU A 904 -7.582 -22.269 11.973 1.00 4.11 N ATOM 1816 CA LEU A 904 -6.852 -23.062 12.948 1.00 73.53 C ATOM 1817 C LEU A 904 -7.778 -24.139 13.517 1.00 22.52 C ATOM 1818 O LEU A 904 -8.759 -23.827 14.190 1.00 30.31 O ATOM 1819 CB LEU A 904 -6.229 -22.160 14.015 1.00 62.34 C ATOM 1820 CG LEU A 904 -6.956 -20.842 14.286 1.00 1.24 C ATOM 1821 CD1 LEU A 904 -8.207 -21.071 15.136 1.00 55.22 C ATOM 1822 CD2 LEU A 904 -6.013 -19.816 14.919 1.00 33.35 C ATOM 0 H LEU A 904 -8.431 -21.831 12.329 1.00 4.11 H new ATOM 0 HA LEU A 904 -6.017 -23.576 12.473 1.00 73.53 H new ATOM 0 HB2 LEU A 904 -6.173 -22.720 14.949 1.00 62.34 H new ATOM 0 HB3 LEU A 904 -5.205 -21.933 13.718 1.00 62.34 H new ATOM 0 HG LEU A 904 -7.286 -20.431 13.332 1.00 1.24 H new ATOM 0 HD11 LEU A 904 -8.705 -20.118 15.314 1.00 55.22 H new ATOM 0 HD12 LEU A 904 -8.886 -21.743 14.611 1.00 55.22 H new ATOM 0 HD13 LEU A 904 -7.923 -21.516 16.090 1.00 55.22 H new ATOM 0 HD21 LEU A 904 -6.555 -18.888 15.101 1.00 33.35 H new ATOM 0 HD22 LEU A 904 -5.632 -20.206 15.863 1.00 33.35 H new ATOM 0 HD23 LEU A 904 -5.179 -19.623 14.244 1.00 33.35 H new ATOM 1834 N TYR A 905 -7.433 -25.385 13.227 1.00 63.25 N ATOM 1835 CA TYR A 905 -8.220 -26.510 13.701 1.00 33.13 C ATOM 1836 C TYR A 905 -8.067 -26.688 15.213 1.00 25.02 C ATOM 1837 O TYR A 905 -7.364 -25.916 15.864 1.00 30.33 O ATOM 1838 CB TYR A 905 -7.659 -27.746 12.995 1.00 53.22 C ATOM 1839 CG TYR A 905 -7.937 -27.782 11.491 1.00 72.43 C ATOM 1840 CD1 TYR A 905 -9.149 -27.339 11.002 1.00 74.40 C ATOM 1841 CD2 TYR A 905 -6.976 -28.258 10.623 1.00 65.44 C ATOM 1842 CE1 TYR A 905 -9.411 -27.374 9.586 1.00 1.13 C ATOM 1843 CE2 TYR A 905 -7.237 -28.293 9.207 1.00 11.10 C ATOM 1844 CZ TYR A 905 -8.442 -27.849 8.759 1.00 41.03 C ATOM 1845 OH TYR A 905 -8.689 -27.882 7.422 1.00 41.52 O ATOM 0 H TYR A 905 -6.618 -25.640 12.669 1.00 63.25 H new ATOM 0 HA TYR A 905 -9.278 -26.353 13.491 1.00 33.13 H new ATOM 0 HB2 TYR A 905 -6.582 -27.786 13.156 1.00 53.22 H new ATOM 0 HB3 TYR A 905 -8.084 -28.639 13.454 1.00 53.22 H new ATOM 0 HD1 TYR A 905 -9.901 -26.966 11.681 1.00 74.40 H new ATOM 0 HD2 TYR A 905 -6.027 -28.605 11.006 1.00 65.44 H new ATOM 0 HE1 TYR A 905 -10.355 -27.031 9.190 1.00 1.13 H new ATOM 0 HE2 TYR A 905 -6.493 -28.663 8.517 1.00 11.10 H new ATOM 0 HH TYR A 905 -7.908 -28.244 6.954 1.00 41.52 H new ATOM 1855 N SER A 906 -8.735 -27.710 15.728 1.00 51.44 N ATOM 1856 CA SER A 906 -8.682 -27.999 17.151 1.00 45.33 C ATOM 1857 C SER A 906 -7.924 -29.306 17.391 1.00 72.21 C ATOM 1858 O SER A 906 -6.959 -29.338 18.153 1.00 41.24 O ATOM 1859 CB SER A 906 -10.087 -28.082 17.749 1.00 11.30 C ATOM 1860 OG SER A 906 -10.830 -29.175 17.217 1.00 20.41 O ATOM 0 H SER A 906 -9.316 -28.348 15.185 1.00 51.44 H new ATOM 0 HA SER A 906 -8.154 -27.184 17.646 1.00 45.33 H new ATOM 0 HB2 SER A 906 -10.015 -28.186 18.832 1.00 11.30 H new ATOM 0 HB3 SER A 906 -10.620 -27.152 17.553 1.00 11.30 H new ATOM 0 HG SER A 906 -11.721 -29.195 17.625 1.00 20.41 H new ATOM 1866 N LYS A 907 -8.391 -30.353 16.727 1.00 63.52 N ATOM 1867 CA LYS A 907 -7.770 -31.660 16.859 1.00 64.55 C ATOM 1868 C LYS A 907 -7.117 -32.046 15.530 1.00 65.22 C ATOM 1869 O LYS A 907 -7.530 -31.576 14.471 1.00 32.01 O ATOM 1870 CB LYS A 907 -8.784 -32.687 17.366 1.00 31.11 C ATOM 1871 CG LYS A 907 -8.092 -33.795 18.163 1.00 44.32 C ATOM 1872 CD LYS A 907 -7.993 -33.425 19.644 1.00 12.12 C ATOM 1873 CE LYS A 907 -6.849 -32.438 19.888 1.00 35.53 C ATOM 1874 NZ LYS A 907 -6.347 -32.560 21.275 1.00 34.02 N ATOM 0 H LYS A 907 -9.192 -30.323 16.096 1.00 63.52 H new ATOM 0 HA LYS A 907 -6.979 -31.631 17.608 1.00 64.55 H new ATOM 0 HB2 LYS A 907 -9.525 -32.192 17.993 1.00 31.11 H new ATOM 0 HB3 LYS A 907 -9.320 -33.122 16.522 1.00 31.11 H new ATOM 0 HG2 LYS A 907 -8.646 -34.727 18.054 1.00 44.32 H new ATOM 0 HG3 LYS A 907 -7.094 -33.969 17.760 1.00 44.32 H new ATOM 0 HD2 LYS A 907 -8.934 -32.986 19.976 1.00 12.12 H new ATOM 0 HD3 LYS A 907 -7.834 -34.325 20.238 1.00 12.12 H new ATOM 0 HE2 LYS A 907 -6.039 -32.629 19.184 1.00 35.53 H new ATOM 0 HE3 LYS A 907 -7.194 -31.420 19.708 1.00 35.53 H new ATOM 0 HZ1 LYS A 907 -6.253 -31.613 21.695 1.00 34.02 H new ATOM 0 HZ2 LYS A 907 -7.016 -33.124 21.838 1.00 34.02 H new ATOM 0 HZ3 LYS A 907 -5.419 -33.029 21.268 1.00 34.02 H new ATOM 1887 N TRP A 908 -6.107 -32.898 15.629 1.00 60.53 N ATOM 1888 CA TRP A 908 -5.393 -33.353 14.448 1.00 44.23 C ATOM 1889 C TRP A 908 -6.357 -34.190 13.605 1.00 23.41 C ATOM 1890 O TRP A 908 -6.168 -34.334 12.398 1.00 10.21 O ATOM 1891 CB TRP A 908 -4.122 -34.112 14.834 1.00 62.01 C ATOM 1892 CG TRP A 908 -3.369 -33.503 16.018 1.00 3.03 C ATOM 1893 CD1 TRP A 908 -2.428 -32.549 15.995 1.00 14.53 C ATOM 1894 CD2 TRP A 908 -3.532 -33.848 17.410 1.00 10.21 C ATOM 1895 NE1 TRP A 908 -1.975 -32.254 17.265 1.00 34.23 N ATOM 1896 CE2 TRP A 908 -2.668 -33.069 18.153 1.00 70.31 C ATOM 1897 CE3 TRP A 908 -4.382 -34.786 18.021 1.00 21.43 C ATOM 1898 CZ2 TRP A 908 -2.570 -33.150 19.547 1.00 3.22 C ATOM 1899 CZ3 TRP A 908 -4.272 -34.855 19.415 1.00 4.33 C ATOM 1900 CH2 TRP A 908 -3.407 -34.078 20.178 1.00 62.24 C ATOM 0 H TRP A 908 -5.766 -33.285 16.509 1.00 60.53 H new ATOM 0 HA TRP A 908 -5.056 -32.506 13.851 1.00 44.23 H new ATOM 0 HB2 TRP A 908 -4.385 -35.142 15.075 1.00 62.01 H new ATOM 0 HB3 TRP A 908 -3.456 -34.147 13.972 1.00 62.01 H new ATOM 0 HD1 TRP A 908 -2.069 -32.071 15.096 1.00 14.53 H new ATOM 0 HE1 TRP A 908 -1.263 -31.565 17.507 1.00 34.23 H new ATOM 0 HE3 TRP A 908 -5.066 -35.405 17.459 1.00 21.43 H new ATOM 0 HZ2 TRP A 908 -1.885 -32.530 20.106 1.00 3.22 H new ATOM 0 HZ3 TRP A 908 -4.903 -35.561 19.934 1.00 4.33 H new ATOM 0 HH2 TRP A 908 -3.381 -34.190 21.252 1.00 62.24 H new ATOM 1911 N LYS A 909 -7.369 -34.722 14.275 1.00 41.33 N ATOM 1912 CA LYS A 909 -8.363 -35.541 13.603 1.00 61.33 C ATOM 1913 C LYS A 909 -8.802 -34.847 12.312 1.00 11.20 C ATOM 1914 O LYS A 909 -9.239 -35.503 11.368 1.00 42.24 O ATOM 1915 CB LYS A 909 -9.519 -35.866 14.550 1.00 32.05 C ATOM 1916 CG LYS A 909 -10.550 -34.736 14.565 1.00 53.31 C ATOM 1917 CD LYS A 909 -11.575 -34.914 13.443 1.00 42.33 C ATOM 1918 CE LYS A 909 -12.889 -34.208 13.783 1.00 31.31 C ATOM 1919 NZ LYS A 909 -13.620 -34.953 14.833 1.00 51.31 N ATOM 0 H LYS A 909 -7.522 -34.602 15.276 1.00 41.33 H new ATOM 0 HA LYS A 909 -7.935 -36.502 13.319 1.00 61.33 H new ATOM 0 HB2 LYS A 909 -9.997 -36.795 14.240 1.00 32.05 H new ATOM 0 HB3 LYS A 909 -9.135 -36.026 15.557 1.00 32.05 H new ATOM 0 HG2 LYS A 909 -11.060 -34.717 15.528 1.00 53.31 H new ATOM 0 HG3 LYS A 909 -10.045 -33.777 14.452 1.00 53.31 H new ATOM 0 HD2 LYS A 909 -11.173 -34.514 12.512 1.00 42.33 H new ATOM 0 HD3 LYS A 909 -11.760 -35.976 13.280 1.00 42.33 H new ATOM 0 HE2 LYS A 909 -12.686 -33.193 14.123 1.00 31.31 H new ATOM 0 HE3 LYS A 909 -13.507 -34.127 12.889 1.00 31.31 H new ATOM 0 HZ1 LYS A 909 -14.623 -34.680 14.818 1.00 51.31 H new ATOM 0 HZ2 LYS A 909 -13.536 -35.974 14.656 1.00 51.31 H new ATOM 0 HZ3 LYS A 909 -13.214 -34.729 15.764 1.00 51.31 H new ATOM 1932 N ASP A 910 -8.671 -33.528 12.313 1.00 31.41 N ATOM 1933 CA ASP A 910 -9.049 -32.738 11.154 1.00 11.20 C ATOM 1934 C ASP A 910 -7.830 -32.555 10.248 1.00 51.43 C ATOM 1935 O ASP A 910 -7.643 -31.490 9.661 1.00 3.33 O ATOM 1936 CB ASP A 910 -9.541 -31.350 11.570 1.00 34.54 C ATOM 1937 CG ASP A 910 -11.014 -31.283 11.979 1.00 54.44 C ATOM 1938 OD1 ASP A 910 -11.912 -31.239 11.125 1.00 54.34 O ATOM 1939 OD2 ASP A 910 -11.228 -31.276 13.251 1.00 42.52 O ATOM 0 H ASP A 910 -8.308 -32.987 13.098 1.00 31.41 H new ATOM 0 HA ASP A 910 -9.850 -33.264 10.634 1.00 11.20 H new ATOM 0 HB2 ASP A 910 -8.932 -30.999 12.403 1.00 34.54 H new ATOM 0 HB3 ASP A 910 -9.377 -30.660 10.743 1.00 34.54 H new ATOM 1945 N PHE A 911 -7.033 -33.609 10.161 1.00 21.24 N ATOM 1946 CA PHE A 911 -5.837 -33.578 9.336 1.00 32.14 C ATOM 1947 C PHE A 911 -6.193 -33.370 7.863 1.00 41.40 C ATOM 1948 O PHE A 911 -7.289 -33.721 7.430 1.00 51.04 O ATOM 1949 CB PHE A 911 -5.149 -34.935 9.495 1.00 24.05 C ATOM 1950 CG PHE A 911 -5.970 -36.115 8.971 1.00 43.31 C ATOM 1951 CD1 PHE A 911 -5.964 -36.410 7.643 1.00 35.04 C ATOM 1952 CD2 PHE A 911 -6.705 -36.868 9.832 1.00 23.13 C ATOM 1953 CE1 PHE A 911 -6.726 -37.505 7.157 1.00 54.04 C ATOM 1954 CE2 PHE A 911 -7.467 -37.963 9.345 1.00 4.04 C ATOM 1955 CZ PHE A 911 -7.461 -38.258 8.018 1.00 74.31 C ATOM 0 H PHE A 911 -7.192 -34.491 10.648 1.00 21.24 H new ATOM 0 HA PHE A 911 -5.192 -32.756 9.646 1.00 32.14 H new ATOM 0 HB2 PHE A 911 -4.193 -34.910 8.971 1.00 24.05 H new ATOM 0 HB3 PHE A 911 -4.930 -35.098 10.550 1.00 24.05 H new ATOM 0 HD1 PHE A 911 -5.380 -35.812 6.959 1.00 35.04 H new ATOM 0 HD2 PHE A 911 -6.709 -36.633 10.886 1.00 23.13 H new ATOM 0 HE1 PHE A 911 -6.722 -37.740 6.103 1.00 54.04 H new ATOM 0 HE2 PHE A 911 -8.051 -38.561 10.029 1.00 4.04 H new ATOM 0 HZ PHE A 911 -8.040 -39.091 7.648 1.00 74.31 H new ATOM 1965 N HIS A 912 -5.245 -32.799 7.134 1.00 55.24 N ATOM 1966 CA HIS A 912 -5.445 -32.539 5.718 1.00 71.31 C ATOM 1967 C HIS A 912 -4.341 -33.224 4.910 1.00 43.30 C ATOM 1968 O HIS A 912 -4.237 -33.025 3.701 1.00 50.24 O ATOM 1969 CB HIS A 912 -5.532 -31.036 5.448 1.00 12.22 C ATOM 1970 CG HIS A 912 -4.666 -30.198 6.358 1.00 41.42 C ATOM 1971 ND1 HIS A 912 -4.685 -30.323 7.736 1.00 63.00 N ATOM 1972 CD2 HIS A 912 -3.755 -29.223 6.072 1.00 15.12 C ATOM 1973 CE1 HIS A 912 -3.821 -29.457 8.247 1.00 75.34 C ATOM 1974 NE2 HIS A 912 -3.247 -28.776 7.214 1.00 60.11 N ATOM 0 H HIS A 912 -4.337 -32.509 7.497 1.00 55.24 H new ATOM 0 HA HIS A 912 -6.397 -32.962 5.398 1.00 71.31 H new ATOM 0 HB2 HIS A 912 -5.245 -30.846 4.414 1.00 12.22 H new ATOM 0 HB3 HIS A 912 -6.569 -30.717 5.555 1.00 12.22 H new ATOM 0 HD2 HIS A 912 -3.492 -28.874 5.084 1.00 15.12 H new ATOM 0 HE1 HIS A 912 -3.609 -29.316 9.297 1.00 75.34 H new ATOM 0 HE2 HIS A 912 -2.543 -28.043 7.304 1.00 60.11 H new ATOM 1982 N PHE A 913 -3.543 -34.016 5.611 1.00 13.13 N ATOM 1983 CA PHE A 913 -2.450 -34.731 4.975 1.00 53.05 C ATOM 1984 C PHE A 913 -2.395 -36.184 5.449 1.00 35.44 C ATOM 1985 O PHE A 913 -3.332 -36.670 6.083 1.00 64.05 O ATOM 1986 CB PHE A 913 -1.156 -34.025 5.382 1.00 1.53 C ATOM 1987 CG PHE A 913 -0.598 -33.083 4.313 1.00 3.24 C ATOM 1988 CD1 PHE A 913 -1.082 -31.817 4.202 1.00 14.12 C ATOM 1989 CD2 PHE A 913 0.383 -33.512 3.475 1.00 41.55 C ATOM 1990 CE1 PHE A 913 -0.564 -30.943 3.210 1.00 13.02 C ATOM 1991 CE2 PHE A 913 0.901 -32.638 2.482 1.00 2.54 C ATOM 1992 CZ PHE A 913 0.416 -31.372 2.371 1.00 5.32 C ATOM 0 H PHE A 913 -3.632 -34.178 6.614 1.00 13.13 H new ATOM 0 HA PHE A 913 -2.588 -34.735 3.894 1.00 53.05 H new ATOM 0 HB2 PHE A 913 -1.336 -33.456 6.294 1.00 1.53 H new ATOM 0 HB3 PHE A 913 -0.403 -34.777 5.618 1.00 1.53 H new ATOM 0 HD1 PHE A 913 -1.861 -31.476 4.868 1.00 14.12 H new ATOM 0 HD2 PHE A 913 0.768 -34.517 3.564 1.00 41.55 H new ATOM 0 HE1 PHE A 913 -0.948 -29.938 3.122 1.00 13.02 H new ATOM 0 HE2 PHE A 913 1.680 -32.979 1.815 1.00 2.54 H new ATOM 0 HZ PHE A 913 0.810 -30.707 1.616 1.00 5.32 H new ATOM 2002 N GLU A 914 -1.289 -36.838 5.125 1.00 35.05 N ATOM 2003 CA GLU A 914 -1.100 -38.226 5.511 1.00 33.21 C ATOM 2004 C GLU A 914 0.242 -38.401 6.224 1.00 0.21 C ATOM 2005 O GLU A 914 1.040 -37.467 6.289 1.00 25.41 O ATOM 2006 CB GLU A 914 -1.200 -39.151 4.296 1.00 34.15 C ATOM 2007 CG GLU A 914 0.093 -39.126 3.480 1.00 43.21 C ATOM 2008 CD GLU A 914 0.776 -40.495 3.491 1.00 33.24 C ATOM 2009 OE1 GLU A 914 0.103 -41.522 3.667 1.00 13.33 O ATOM 2010 OE2 GLU A 914 2.052 -40.470 3.308 1.00 43.31 O ATOM 0 H GLU A 914 -0.515 -36.432 4.599 1.00 35.05 H new ATOM 0 HA GLU A 914 -1.895 -38.502 6.203 1.00 33.21 H new ATOM 0 HB2 GLU A 914 -1.406 -40.169 4.626 1.00 34.15 H new ATOM 0 HB3 GLU A 914 -2.036 -38.843 3.668 1.00 34.15 H new ATOM 0 HG2 GLU A 914 -0.127 -38.834 2.453 1.00 43.21 H new ATOM 0 HG3 GLU A 914 0.770 -38.375 3.887 1.00 43.21 H new ATOM 2018 N LYS A 915 0.449 -39.603 6.741 1.00 3.00 N ATOM 2019 CA LYS A 915 1.681 -39.912 7.447 1.00 42.11 C ATOM 2020 C LYS A 915 2.817 -40.074 6.435 1.00 70.04 C ATOM 2021 O LYS A 915 2.752 -40.932 5.556 1.00 63.40 O ATOM 2022 CB LYS A 915 1.488 -41.128 8.355 1.00 61.44 C ATOM 2023 CG LYS A 915 2.013 -42.400 7.686 1.00 72.54 C ATOM 2024 CD LYS A 915 1.164 -42.769 6.467 1.00 31.32 C ATOM 2025 CE LYS A 915 -0.027 -43.640 6.872 1.00 12.12 C ATOM 2026 NZ LYS A 915 0.363 -45.067 6.909 1.00 31.20 N ATOM 0 H LYS A 915 -0.216 -40.375 6.685 1.00 3.00 H new ATOM 0 HA LYS A 915 1.957 -39.091 8.108 1.00 42.11 H new ATOM 0 HB2 LYS A 915 2.009 -40.968 9.299 1.00 61.44 H new ATOM 0 HB3 LYS A 915 0.430 -41.246 8.590 1.00 61.44 H new ATOM 0 HG2 LYS A 915 3.049 -42.254 7.381 1.00 72.54 H new ATOM 0 HG3 LYS A 915 2.004 -43.222 8.402 1.00 72.54 H new ATOM 0 HD2 LYS A 915 0.807 -41.862 5.980 1.00 31.32 H new ATOM 0 HD3 LYS A 915 1.777 -43.301 5.740 1.00 31.32 H new ATOM 0 HE2 LYS A 915 -0.394 -43.332 7.851 1.00 12.12 H new ATOM 0 HE3 LYS A 915 -0.845 -43.499 6.166 1.00 12.12 H new ATOM 0 HZ1 LYS A 915 -0.457 -45.644 7.186 1.00 31.20 H new ATOM 0 HZ2 LYS A 915 0.692 -45.362 5.967 1.00 31.20 H new ATOM 0 HZ3 LYS A 915 1.129 -45.200 7.600 1.00 31.20 H new ATOM 2039 N ILE A 916 3.831 -39.236 6.592 1.00 51.23 N ATOM 2040 CA ILE A 916 4.979 -39.275 5.702 1.00 23.44 C ATOM 2041 C ILE A 916 6.257 -39.412 6.533 1.00 43.35 C ATOM 2042 O ILE A 916 6.378 -38.808 7.597 1.00 14.13 O ATOM 2043 CB ILE A 916 4.978 -38.062 4.771 1.00 53.32 C ATOM 2044 CG1 ILE A 916 3.682 -37.995 3.959 1.00 65.40 C ATOM 2045 CG2 ILE A 916 6.217 -38.057 3.874 1.00 62.20 C ATOM 2046 CD1 ILE A 916 3.188 -36.553 3.832 1.00 62.01 C ATOM 0 H ILE A 916 3.882 -38.526 7.322 1.00 51.23 H new ATOM 0 HA ILE A 916 4.926 -40.147 5.050 1.00 23.44 H new ATOM 0 HB ILE A 916 5.021 -37.162 5.384 1.00 53.32 H new ATOM 0 HG12 ILE A 916 3.848 -38.415 2.967 1.00 65.40 H new ATOM 0 HG13 ILE A 916 2.916 -38.604 4.439 1.00 65.40 H new ATOM 0 HG21 ILE A 916 6.191 -37.184 3.222 1.00 62.20 H new ATOM 0 HG22 ILE A 916 7.114 -38.021 4.492 1.00 62.20 H new ATOM 0 HG23 ILE A 916 6.231 -38.962 3.267 1.00 62.20 H new ATOM 0 HD11 ILE A 916 2.266 -36.534 3.251 1.00 62.01 H new ATOM 0 HD12 ILE A 916 2.999 -36.144 4.825 1.00 62.01 H new ATOM 0 HD13 ILE A 916 3.946 -35.952 3.330 1.00 62.01 H new ATOM 2058 N PRO A 917 7.204 -40.230 6.000 1.00 60.11 N ATOM 2059 CA PRO A 917 8.469 -40.453 6.680 1.00 75.42 C ATOM 2060 C PRO A 917 9.389 -39.239 6.539 1.00 70.33 C ATOM 2061 O PRO A 917 9.688 -38.808 5.426 1.00 35.21 O ATOM 2062 CB PRO A 917 9.041 -41.710 6.044 1.00 53.32 C ATOM 2063 CG PRO A 917 8.308 -41.879 4.723 1.00 41.23 C ATOM 2064 CD PRO A 917 7.096 -40.962 4.741 1.00 2.41 C ATOM 0 HA PRO A 917 8.351 -40.585 7.756 1.00 75.42 H new ATOM 0 HB2 PRO A 917 10.115 -41.613 5.885 1.00 53.32 H new ATOM 0 HB3 PRO A 917 8.891 -42.577 6.688 1.00 53.32 H new ATOM 0 HG2 PRO A 917 8.963 -41.629 3.888 1.00 41.23 H new ATOM 0 HG3 PRO A 917 8.000 -42.916 4.587 1.00 41.23 H new ATOM 0 HD2 PRO A 917 7.099 -40.284 3.887 1.00 2.41 H new ATOM 0 HD3 PRO A 917 6.168 -41.531 4.692 1.00 2.41 H new ATOM 2072 N PHE A 918 9.813 -38.722 7.682 1.00 21.45 N ATOM 2073 CA PHE A 918 10.694 -37.567 7.700 1.00 13.45 C ATOM 2074 C PHE A 918 11.922 -37.799 6.819 1.00 62.53 C ATOM 2075 O PHE A 918 12.785 -38.610 7.152 1.00 62.10 O ATOM 2076 CB PHE A 918 11.149 -37.374 9.148 1.00 11.23 C ATOM 2077 CG PHE A 918 11.489 -35.926 9.506 1.00 44.52 C ATOM 2078 CD1 PHE A 918 12.592 -35.334 8.972 1.00 72.51 C ATOM 2079 CD2 PHE A 918 10.690 -35.229 10.358 1.00 72.44 C ATOM 2080 CE1 PHE A 918 12.908 -33.991 9.304 1.00 52.52 C ATOM 2081 CE2 PHE A 918 11.006 -33.885 10.689 1.00 32.35 C ATOM 2082 CZ PHE A 918 12.108 -33.294 10.156 1.00 62.35 C ATOM 0 H PHE A 918 9.563 -39.082 8.603 1.00 21.45 H new ATOM 0 HA PHE A 918 10.167 -36.692 7.319 1.00 13.45 H new ATOM 0 HB2 PHE A 918 10.363 -37.727 9.815 1.00 11.23 H new ATOM 0 HB3 PHE A 918 12.025 -37.997 9.329 1.00 11.23 H new ATOM 0 HD1 PHE A 918 13.227 -35.887 8.295 1.00 72.51 H new ATOM 0 HD2 PHE A 918 9.815 -35.698 10.783 1.00 72.44 H new ATOM 0 HE1 PHE A 918 13.784 -33.522 8.880 1.00 52.52 H new ATOM 0 HE2 PHE A 918 10.370 -33.332 11.365 1.00 32.35 H new ATOM 0 HZ PHE A 918 12.348 -32.272 10.409 1.00 62.35 H new ATOM 2092 N ASP A 919 11.962 -37.074 5.711 1.00 51.11 N ATOM 2093 CA ASP A 919 13.070 -37.191 4.779 1.00 64.33 C ATOM 2094 C ASP A 919 14.303 -36.503 5.369 1.00 55.40 C ATOM 2095 O ASP A 919 14.269 -35.309 5.665 1.00 61.23 O ATOM 2096 CB ASP A 919 12.743 -36.514 3.446 1.00 24.52 C ATOM 2097 CG ASP A 919 11.966 -37.382 2.454 1.00 41.30 C ATOM 2098 OD1 ASP A 919 10.755 -37.199 2.258 1.00 44.12 O ATOM 2099 OD2 ASP A 919 12.664 -38.290 1.861 1.00 71.14 O ATOM 0 H ASP A 919 11.244 -36.403 5.438 1.00 51.11 H new ATOM 0 HA ASP A 919 13.256 -38.251 4.609 1.00 64.33 H new ATOM 0 HB2 ASP A 919 12.166 -35.611 3.646 1.00 24.52 H new ATOM 0 HB3 ASP A 919 13.675 -36.199 2.977 1.00 24.52 H new ATOM 2105 N PRO A 920 15.389 -37.305 5.527 1.00 61.20 N ATOM 2106 CA PRO A 920 16.630 -36.786 6.077 1.00 53.44 C ATOM 2107 C PRO A 920 17.369 -35.929 5.047 1.00 1.31 C ATOM 2108 O PRO A 920 18.286 -35.186 5.396 1.00 55.13 O ATOM 2109 CB PRO A 920 17.417 -38.014 6.502 1.00 73.52 C ATOM 2110 CG PRO A 920 16.797 -39.185 5.756 1.00 61.02 C ATOM 2111 CD PRO A 920 15.465 -38.723 5.188 1.00 61.22 C ATOM 0 HA PRO A 920 16.468 -36.121 6.925 1.00 53.44 H new ATOM 0 HB2 PRO A 920 18.473 -37.907 6.253 1.00 73.52 H new ATOM 0 HB3 PRO A 920 17.358 -38.162 7.580 1.00 73.52 H new ATOM 0 HG2 PRO A 920 17.457 -39.521 4.956 1.00 61.02 H new ATOM 0 HG3 PRO A 920 16.653 -40.032 6.427 1.00 61.02 H new ATOM 0 HD2 PRO A 920 15.420 -38.875 4.110 1.00 61.22 H new ATOM 0 HD3 PRO A 920 14.635 -39.279 5.623 1.00 61.22 H new ATOM 2119 N ALA A 921 16.943 -36.060 3.799 1.00 22.45 N ATOM 2120 CA ALA A 921 17.553 -35.307 2.717 1.00 63.21 C ATOM 2121 C ALA A 921 17.259 -33.818 2.908 1.00 30.03 C ATOM 2122 O ALA A 921 18.005 -32.967 2.426 1.00 31.21 O ATOM 2123 CB ALA A 921 17.041 -35.835 1.375 1.00 20.14 C ATOM 0 H ALA A 921 16.182 -36.677 3.513 1.00 22.45 H new ATOM 0 HA ALA A 921 18.636 -35.433 2.725 1.00 63.21 H new ATOM 0 HB1 ALA A 921 17.499 -35.270 0.563 1.00 20.14 H new ATOM 0 HB2 ALA A 921 17.301 -36.889 1.275 1.00 20.14 H new ATOM 0 HB3 ALA A 921 15.958 -35.723 1.329 1.00 20.14 H new ATOM 2129 N GLU A 922 16.170 -33.549 3.613 1.00 11.31 N ATOM 2130 CA GLU A 922 15.768 -32.177 3.874 1.00 13.02 C ATOM 2131 C GLU A 922 16.520 -31.625 5.087 1.00 41.23 C ATOM 2132 O GLU A 922 17.044 -30.513 5.043 1.00 51.21 O ATOM 2133 CB GLU A 922 14.254 -32.078 4.077 1.00 64.45 C ATOM 2134 CG GLU A 922 13.507 -32.923 3.042 1.00 12.35 C ATOM 2135 CD GLU A 922 12.450 -32.089 2.315 1.00 62.24 C ATOM 2136 OE1 GLU A 922 11.333 -32.573 2.080 1.00 52.23 O ATOM 2137 OE2 GLU A 922 12.824 -30.898 1.991 1.00 54.40 O ATOM 0 H GLU A 922 15.554 -34.257 4.011 1.00 11.31 H new ATOM 0 HA GLU A 922 16.026 -31.572 3.005 1.00 13.02 H new ATOM 0 HB2 GLU A 922 13.995 -32.413 5.081 1.00 64.45 H new ATOM 0 HB3 GLU A 922 13.940 -31.037 3.998 1.00 64.45 H new ATOM 0 HG2 GLU A 922 14.215 -33.330 2.320 1.00 12.35 H new ATOM 0 HG3 GLU A 922 13.031 -33.771 3.534 1.00 12.35 H new ATOM 2145 N MET A 923 16.550 -32.427 6.140 1.00 33.44 N ATOM 2146 CA MET A 923 17.229 -32.033 7.363 1.00 42.03 C ATOM 2147 C MET A 923 18.567 -31.358 7.053 1.00 20.21 C ATOM 2148 O MET A 923 18.828 -30.249 7.515 1.00 3.51 O ATOM 2149 CB MET A 923 17.469 -33.267 8.234 1.00 24.15 C ATOM 2150 CG MET A 923 16.200 -33.657 8.994 1.00 72.40 C ATOM 2151 SD MET A 923 16.629 -34.500 10.508 1.00 53.01 S ATOM 2152 CE MET A 923 15.435 -33.771 11.617 1.00 5.23 C ATOM 0 H MET A 923 16.115 -33.349 6.172 1.00 33.44 H new ATOM 0 HA MET A 923 16.598 -31.320 7.894 1.00 42.03 H new ATOM 0 HB2 MET A 923 17.794 -34.100 7.610 1.00 24.15 H new ATOM 0 HB3 MET A 923 18.274 -33.066 8.941 1.00 24.15 H new ATOM 0 HG2 MET A 923 15.612 -32.767 9.218 1.00 72.40 H new ATOM 0 HG3 MET A 923 15.578 -34.302 8.373 1.00 72.40 H new ATOM 0 HE1 MET A 923 15.923 -33.511 12.556 1.00 5.23 H new ATOM 0 HE2 MET A 923 15.018 -32.872 11.163 1.00 5.23 H new ATOM 0 HE3 MET A 923 14.634 -34.485 11.810 1.00 5.23 H new ATOM 2162 N SER A 924 19.379 -32.056 6.273 1.00 21.52 N ATOM 2163 CA SER A 924 20.683 -31.539 5.896 1.00 5.24 C ATOM 2164 C SER A 924 21.245 -32.340 4.720 1.00 74.01 C ATOM 2165 O SER A 924 20.635 -33.314 4.281 1.00 64.31 O ATOM 2166 CB SER A 924 21.655 -31.580 7.078 1.00 54.11 C ATOM 2167 OG SER A 924 21.755 -32.885 7.641 1.00 30.02 O ATOM 0 H SER A 924 19.159 -32.976 5.892 1.00 21.52 H new ATOM 0 HA SER A 924 20.563 -30.499 5.594 1.00 5.24 H new ATOM 0 HB2 SER A 924 22.640 -31.251 6.749 1.00 54.11 H new ATOM 0 HB3 SER A 924 21.324 -30.879 7.844 1.00 54.11 H new ATOM 0 HG SER A 924 22.386 -32.870 8.391 1.00 30.02 H new ATOM 2173 N LYS A 925 22.400 -31.900 4.243 1.00 54.10 N ATOM 2174 CA LYS A 925 23.050 -32.564 3.126 1.00 52.21 C ATOM 2175 C LYS A 925 23.520 -33.951 3.567 1.00 62.43 C ATOM 2176 O LYS A 925 24.583 -34.088 4.171 1.00 51.32 O ATOM 2177 CB LYS A 925 24.168 -31.687 2.559 1.00 51.04 C ATOM 2178 CG LYS A 925 24.436 -32.022 1.090 1.00 72.11 C ATOM 2179 CD LYS A 925 25.862 -31.637 0.691 1.00 30.41 C ATOM 2180 CE LYS A 925 26.153 -30.176 1.038 1.00 21.14 C ATOM 2181 NZ LYS A 925 26.635 -30.061 2.433 1.00 14.02 N ATOM 0 H LYS A 925 22.903 -31.092 4.610 1.00 54.10 H new ATOM 0 HA LYS A 925 22.346 -32.711 2.307 1.00 52.21 H new ATOM 0 HB2 LYS A 925 23.893 -30.636 2.652 1.00 51.04 H new ATOM 0 HB3 LYS A 925 25.079 -31.831 3.141 1.00 51.04 H new ATOM 0 HG2 LYS A 925 24.283 -33.088 0.923 1.00 72.11 H new ATOM 0 HG3 LYS A 925 23.722 -31.494 0.457 1.00 72.11 H new ATOM 0 HD2 LYS A 925 26.574 -32.285 1.203 1.00 30.41 H new ATOM 0 HD3 LYS A 925 25.999 -31.795 -0.379 1.00 30.41 H new ATOM 0 HE2 LYS A 925 26.901 -29.776 0.354 1.00 21.14 H new ATOM 0 HE3 LYS A 925 25.251 -29.578 0.908 1.00 21.14 H new ATOM 0 HZ1 LYS A 925 27.457 -29.425 2.465 1.00 14.02 H new ATOM 0 HZ2 LYS A 925 25.877 -29.676 3.032 1.00 14.02 H new ATOM 0 HZ3 LYS A 925 26.910 -31.001 2.784 1.00 14.02 H new