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 806 LYS NZ :NH3+ -169:sc= -4.08! (180deg=0) USER MOD Set 1.2: A 912 HIS : no HD1:sc= -12.7! C(o=-17!,f=-23!) USER MOD Set 2.1: A 814 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 902 GLN : amide:sc= -3.69 K(o=-3.7,f=-7.8!) USER MOD Set 3.1: A 888 LYS NZ :NH3+ -119:sc= -0.0614 (180deg=-0.718) USER MOD Set 3.2: A 891 SER OG : rot -148:sc= -2.99! USER MOD Set 4.1: A 810 CYS SG : rot 180:sc= -0.458 USER MOD Set 4.2: A 864 CYS SG : rot -37:sc= -2.73 USER MOD Single : A 805 ASN : amide:sc= -10.6! C(o=-11!,f=-6.3!) USER MOD Single : A 807 LYS NZ :NH3+ -133:sc= 0.314 (180deg=-0.468) USER MOD Single : A 812 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 813 CYS SG : rot 180:sc= 0 USER MOD Single : A 818 CYS SG : rot -112:sc= -0.183 USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -168:sc= -0.0112 USER MOD Single : A 829 CYS SG : rot 62:sc= 0.0735 USER MOD Single : A 830 HIS : no HD1:sc= -1.83 X(o=-1.8,f=-1.4) USER MOD Single : A 831 TYR OH : rot 180:sc= -0.141 USER MOD Single : A 832 THR OG1 : rot 118:sc= 0.408! USER MOD Single : A 839 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.345) USER MOD Single : A 841 CYS SG : rot 70:sc= 1.05 USER MOD Single : A 844 SER OG : rot 19:sc= 0.447 USER MOD Single : A 858 LYS NZ :NH3+ -155:sc= -0.192 (180deg=-1.08) USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 867 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 868 ASN : amide:sc= -0.183 X(o=-0.18,f=0) USER MOD Single : A 869 CYS SG : rot -28:sc= 0.00229 USER MOD Single : A 870 SER OG : rot 180:sc= 0.0306 USER MOD Single : A 871 HIS : no HD1:sc= -4.97! C(o=-5!,f=-5.4!) USER MOD Single : A 876 HIS : no HE2:sc= -0.122 X(o=-0.12,f=-0.5) USER MOD Single : A 878 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.207) USER MOD Single : A 879 TYR OH : rot 180:sc= 0 USER MOD Single : A 880 LYS NZ :NH3+ -149:sc= -1.18 (180deg=-2.45!) USER MOD Single : A 881 THR OG1 : rot 104:sc= 1.39 USER MOD Single : A 899 THR OG1 : rot -172:sc= -3.57! USER MOD Single : A 903 THR OG1 : rot -5:sc= 0.615 USER MOD Single : A 905 TYR OH : rot 130:sc= -0.459 USER MOD Single : A 906 SER OG : rot 180:sc= -0.0121 USER MOD Single : A 907 LYS NZ :NH3+ -139:sc= 0.506 (180deg=0.00683) USER MOD Single : A 909 LYS NZ :NH3+ 152:sc= -0.428 (180deg=-1.22) USER MOD Single : A 915 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 MET CE :methyl -141:sc= -1.4 (180deg=-1.95) USER MOD Single : A 924 SER OG : rot 72:sc= 0.586 USER MOD Single : A 925 LYS NZ :NH3+ -156:sc= -0.0937 (180deg=-0.589) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 0.624 -26.744 -1.607 1.00 32.34 N ATOM 209 CA ASN A 805 1.169 -26.361 -0.315 1.00 73.51 C ATOM 210 C ASN A 805 0.288 -25.274 0.303 1.00 33.23 C ATOM 211 O ASN A 805 -0.334 -24.492 -0.414 1.00 0.42 O ATOM 212 CB ASN A 805 2.584 -25.798 -0.460 1.00 13.14 C ATOM 213 CG ASN A 805 2.930 -24.878 0.713 1.00 52.33 C ATOM 214 OD1 ASN A 805 3.256 -23.714 0.547 1.00 52.23 O ATOM 215 ND2 ASN A 805 2.841 -25.462 1.904 1.00 61.51 N ATOM 0 HA ASN A 805 1.197 -27.249 0.316 1.00 73.51 H new ATOM 0 HB2 ASN A 805 3.302 -26.617 -0.509 1.00 13.14 H new ATOM 0 HB3 ASN A 805 2.666 -25.246 -1.396 1.00 13.14 H new ATOM 0 HD21 ASN A 805 3.052 -24.931 2.749 1.00 61.51 H new ATOM 0 HD22 ASN A 805 2.562 -26.441 1.973 1.00 61.51 H new ATOM 222 N LYS A 806 0.262 -25.260 1.628 1.00 62.32 N ATOM 223 CA LYS A 806 -0.532 -24.282 2.351 1.00 54.11 C ATOM 224 C LYS A 806 0.366 -23.525 3.331 1.00 64.02 C ATOM 225 O LYS A 806 1.364 -24.064 3.807 1.00 63.24 O ATOM 226 CB LYS A 806 -1.736 -24.954 3.014 1.00 33.11 C ATOM 227 CG LYS A 806 -2.143 -24.214 4.290 1.00 31.32 C ATOM 228 CD LYS A 806 -3.576 -24.566 4.695 1.00 71.33 C ATOM 229 CE LYS A 806 -3.788 -26.081 4.699 1.00 31.53 C ATOM 230 NZ LYS A 806 -5.017 -26.431 5.446 1.00 53.40 N ATOM 0 H LYS A 806 0.779 -25.911 2.219 1.00 62.32 H new ATOM 0 HA LYS A 806 -0.946 -23.545 1.663 1.00 54.11 H new ATOM 0 HB2 LYS A 806 -2.575 -24.974 2.318 1.00 33.11 H new ATOM 0 HB3 LYS A 806 -1.494 -25.990 3.252 1.00 33.11 H new ATOM 0 HG2 LYS A 806 -1.459 -24.472 5.098 1.00 31.32 H new ATOM 0 HG3 LYS A 806 -2.059 -23.139 4.133 1.00 31.32 H new ATOM 0 HD2 LYS A 806 -3.787 -24.163 5.686 1.00 71.33 H new ATOM 0 HD3 LYS A 806 -4.278 -24.099 4.004 1.00 71.33 H new ATOM 0 HE2 LYS A 806 -3.862 -26.446 3.675 1.00 31.53 H new ATOM 0 HE3 LYS A 806 -2.927 -26.573 5.152 1.00 31.53 H new ATOM 0 HZ1 LYS A 806 -5.049 -27.459 5.600 1.00 53.40 H new ATOM 0 HZ2 LYS A 806 -5.016 -25.943 6.365 1.00 53.40 H new ATOM 0 HZ3 LYS A 806 -5.851 -26.137 4.899 1.00 53.40 H new ATOM 243 N LYS A 807 -0.020 -22.287 3.603 1.00 22.32 N ATOM 244 CA LYS A 807 0.739 -21.451 4.518 1.00 53.12 C ATOM 245 C LYS A 807 0.106 -21.520 5.909 1.00 13.21 C ATOM 246 O LYS A 807 -1.041 -21.941 6.053 1.00 21.11 O ATOM 247 CB LYS A 807 0.860 -20.029 3.967 1.00 4.43 C ATOM 248 CG LYS A 807 1.294 -19.052 5.063 1.00 51.05 C ATOM 249 CD LYS A 807 1.420 -17.630 4.511 1.00 70.40 C ATOM 250 CE LYS A 807 0.070 -17.117 4.005 1.00 4.13 C ATOM 251 NZ LYS A 807 -0.022 -15.649 4.174 1.00 20.41 N ATOM 0 H LYS A 807 -0.848 -21.843 3.206 1.00 22.32 H new ATOM 0 HA LYS A 807 1.760 -21.820 4.614 1.00 53.12 H new ATOM 0 HB2 LYS A 807 1.583 -20.011 3.152 1.00 4.43 H new ATOM 0 HB3 LYS A 807 -0.097 -19.713 3.551 1.00 4.43 H new ATOM 0 HG2 LYS A 807 0.569 -19.067 5.877 1.00 51.05 H new ATOM 0 HG3 LYS A 807 2.249 -19.370 5.481 1.00 51.05 H new ATOM 0 HD2 LYS A 807 1.797 -16.966 5.289 1.00 70.40 H new ATOM 0 HD3 LYS A 807 2.147 -17.614 3.699 1.00 70.40 H new ATOM 0 HE2 LYS A 807 -0.054 -17.377 2.954 1.00 4.13 H new ATOM 0 HE3 LYS A 807 -0.739 -17.603 4.551 1.00 4.13 H new ATOM 0 HZ1 LYS A 807 -0.938 -15.406 4.603 1.00 20.41 H new ATOM 0 HZ2 LYS A 807 0.748 -15.322 4.792 1.00 20.41 H new ATOM 0 HZ3 LYS A 807 0.059 -15.187 3.246 1.00 20.41 H new ATOM 264 N LEU A 808 0.881 -21.099 6.898 1.00 34.42 N ATOM 265 CA LEU A 808 0.410 -21.108 8.273 1.00 61.11 C ATOM 266 C LEU A 808 0.653 -19.733 8.899 1.00 32.41 C ATOM 267 O LEU A 808 1.562 -19.013 8.490 1.00 12.30 O ATOM 268 CB LEU A 808 1.050 -22.260 9.051 1.00 53.12 C ATOM 269 CG LEU A 808 0.583 -23.667 8.671 1.00 13.43 C ATOM 270 CD1 LEU A 808 1.294 -24.159 7.410 1.00 44.23 C ATOM 271 CD2 LEU A 808 0.756 -24.636 9.842 1.00 34.22 C ATOM 0 H LEU A 808 1.831 -20.750 6.775 1.00 34.42 H new ATOM 0 HA LEU A 808 -0.664 -21.289 8.307 1.00 61.11 H new ATOM 0 HB2 LEU A 808 2.130 -22.208 8.915 1.00 53.12 H new ATOM 0 HB3 LEU A 808 0.855 -22.108 10.113 1.00 53.12 H new ATOM 0 HG LEU A 808 -0.482 -23.624 8.443 1.00 13.43 H new ATOM 0 HD11 LEU A 808 0.944 -25.161 7.162 1.00 44.23 H new ATOM 0 HD12 LEU A 808 1.076 -23.484 6.583 1.00 44.23 H new ATOM 0 HD13 LEU A 808 2.370 -24.184 7.585 1.00 44.23 H new ATOM 0 HD21 LEU A 808 0.417 -25.629 9.546 1.00 34.22 H new ATOM 0 HD22 LEU A 808 1.808 -24.681 10.125 1.00 34.22 H new ATOM 0 HD23 LEU A 808 0.167 -24.290 10.691 1.00 34.22 H new ATOM 283 N LEU A 809 -0.176 -19.411 9.881 1.00 31.33 N ATOM 284 CA LEU A 809 -0.063 -18.136 10.568 1.00 1.20 C ATOM 285 C LEU A 809 -0.052 -18.374 12.079 1.00 32.33 C ATOM 286 O LEU A 809 -0.414 -19.454 12.543 1.00 34.34 O ATOM 287 CB LEU A 809 -1.163 -17.178 10.104 1.00 25.23 C ATOM 288 CG LEU A 809 -0.763 -16.172 9.023 1.00 14.22 C ATOM 289 CD1 LEU A 809 -0.819 -16.809 7.633 1.00 30.15 C ATOM 290 CD2 LEU A 809 -1.620 -14.907 9.108 1.00 32.04 C ATOM 0 H LEU A 809 -0.929 -20.011 10.217 1.00 31.33 H new ATOM 0 HA LEU A 809 0.879 -17.650 10.315 1.00 1.20 H new ATOM 0 HB2 LEU A 809 -1.999 -17.770 9.731 1.00 25.23 H new ATOM 0 HB3 LEU A 809 -1.526 -16.625 10.971 1.00 25.23 H new ATOM 0 HG LEU A 809 0.271 -15.874 9.199 1.00 14.22 H new ATOM 0 HD11 LEU A 809 -0.530 -16.072 6.883 1.00 30.15 H new ATOM 0 HD12 LEU A 809 -0.134 -17.656 7.593 1.00 30.15 H new ATOM 0 HD13 LEU A 809 -1.833 -17.153 7.431 1.00 30.15 H new ATOM 0 HD21 LEU A 809 -1.316 -14.208 8.329 1.00 32.04 H new ATOM 0 HD22 LEU A 809 -2.669 -15.168 8.971 1.00 32.04 H new ATOM 0 HD23 LEU A 809 -1.486 -14.442 10.085 1.00 32.04 H new ATOM 302 N CYS A 810 0.367 -17.348 12.805 1.00 30.21 N ATOM 303 CA CYS A 810 0.430 -17.433 14.254 1.00 13.33 C ATOM 304 C CYS A 810 -0.796 -16.721 14.830 1.00 2.44 C ATOM 305 O CYS A 810 -0.877 -15.494 14.798 1.00 13.33 O ATOM 306 CB CYS A 810 1.736 -16.851 14.799 1.00 60.42 C ATOM 307 SG CYS A 810 2.214 -17.719 16.338 1.00 54.13 S ATOM 0 H CYS A 810 0.666 -16.453 12.417 1.00 30.21 H new ATOM 0 HA CYS A 810 0.420 -18.479 14.560 1.00 13.33 H new ATOM 0 HB2 CYS A 810 2.526 -16.950 14.055 1.00 60.42 H new ATOM 0 HB3 CYS A 810 1.615 -15.786 14.995 1.00 60.42 H new ATOM 0 HG CYS A 810 3.325 -17.219 16.791 1.00 54.13 H new ATOM 313 N ARG A 811 -1.718 -17.521 15.344 1.00 54.20 N ATOM 314 CA ARG A 811 -2.936 -16.982 15.926 1.00 21.34 C ATOM 315 C ARG A 811 -2.619 -15.747 16.771 1.00 2.23 C ATOM 316 O ARG A 811 -3.463 -14.866 16.931 1.00 22.41 O ATOM 317 CB ARG A 811 -3.635 -18.024 16.802 1.00 74.34 C ATOM 318 CG ARG A 811 -4.884 -17.436 17.462 1.00 22.34 C ATOM 319 CD ARG A 811 -5.580 -18.477 18.342 1.00 53.22 C ATOM 320 NE ARG A 811 -6.523 -17.808 19.266 1.00 34.40 N ATOM 321 CZ ARG A 811 -7.004 -18.372 20.395 1.00 51.32 C ATOM 322 NH1 ARG A 811 -6.633 -19.621 20.749 1.00 53.40 N ATOM 323 NH2 ARG A 811 -7.842 -17.683 21.147 1.00 32.10 N ATOM 0 H ARG A 811 -1.647 -18.538 15.370 1.00 54.20 H new ATOM 0 HA ARG A 811 -3.601 -16.706 15.108 1.00 21.34 H new ATOM 0 HB2 ARG A 811 -3.911 -18.887 16.196 1.00 74.34 H new ATOM 0 HB3 ARG A 811 -2.947 -18.380 17.569 1.00 74.34 H new ATOM 0 HG2 ARG A 811 -4.608 -16.571 18.065 1.00 22.34 H new ATOM 0 HG3 ARG A 811 -5.573 -17.083 16.695 1.00 22.34 H new ATOM 0 HD2 ARG A 811 -6.115 -19.193 17.719 1.00 53.22 H new ATOM 0 HD3 ARG A 811 -4.839 -19.040 18.910 1.00 53.22 H new ATOM 0 HE ARG A 811 -6.829 -16.862 19.036 1.00 34.40 H new ATOM 0 HH11 ARG A 811 -5.985 -20.146 20.162 1.00 53.40 H new ATOM 0 HH12 ARG A 811 -7.001 -20.039 21.603 1.00 53.40 H new ATOM 0 HH21 ARG A 811 -8.117 -16.740 20.872 1.00 32.10 H new ATOM 0 HH22 ARG A 811 -8.215 -18.094 22.003 1.00 32.10 H new ATOM 336 N LYS A 812 -1.400 -15.721 17.290 1.00 0.11 N ATOM 337 CA LYS A 812 -0.961 -14.608 18.115 1.00 50.14 C ATOM 338 C LYS A 812 -1.474 -13.299 17.511 1.00 0.35 C ATOM 339 O LYS A 812 -2.413 -12.697 18.031 1.00 23.44 O ATOM 340 CB LYS A 812 0.557 -14.646 18.302 1.00 41.34 C ATOM 341 CG LYS A 812 0.987 -15.917 19.037 1.00 45.43 C ATOM 342 CD LYS A 812 0.338 -15.996 20.420 1.00 64.40 C ATOM 343 CE LYS A 812 -0.973 -16.782 20.366 1.00 54.15 C ATOM 344 NZ LYS A 812 -0.752 -18.189 20.769 1.00 13.41 N ATOM 0 H LYS A 812 -0.703 -16.453 17.155 1.00 0.11 H new ATOM 0 HA LYS A 812 -1.384 -14.685 19.117 1.00 50.14 H new ATOM 0 HB2 LYS A 812 1.048 -14.600 17.330 1.00 41.34 H new ATOM 0 HB3 LYS A 812 0.880 -13.770 18.864 1.00 41.34 H new ATOM 0 HG2 LYS A 812 0.709 -16.793 18.450 1.00 45.43 H new ATOM 0 HG3 LYS A 812 2.072 -15.933 19.139 1.00 45.43 H new ATOM 0 HD2 LYS A 812 1.023 -16.473 21.121 1.00 64.40 H new ATOM 0 HD3 LYS A 812 0.148 -14.990 20.795 1.00 64.40 H new ATOM 0 HE2 LYS A 812 -1.708 -16.320 21.025 1.00 54.15 H new ATOM 0 HE3 LYS A 812 -1.383 -16.747 19.357 1.00 54.15 H new ATOM 0 HZ1 LYS A 812 -1.652 -18.708 20.727 1.00 13.41 H new ATOM 0 HZ2 LYS A 812 -0.067 -18.631 20.124 1.00 13.41 H new ATOM 0 HZ3 LYS A 812 -0.381 -18.218 21.740 1.00 13.41 H new ATOM 357 N CYS A 813 -0.835 -12.896 16.423 1.00 53.41 N ATOM 358 CA CYS A 813 -1.215 -11.669 15.743 1.00 12.35 C ATOM 359 C CYS A 813 -1.505 -12.001 14.278 1.00 4.23 C ATOM 360 O CYS A 813 -1.439 -11.127 13.415 1.00 13.44 O ATOM 361 CB CYS A 813 -0.140 -10.589 15.882 1.00 11.04 C ATOM 362 SG CYS A 813 -0.905 -8.929 15.794 1.00 13.01 S ATOM 0 H CYS A 813 -0.056 -13.397 15.995 1.00 53.41 H new ATOM 0 HA CYS A 813 -2.112 -11.257 16.205 1.00 12.35 H new ATOM 0 HB2 CYS A 813 0.385 -10.707 16.830 1.00 11.04 H new ATOM 0 HB3 CYS A 813 0.602 -10.699 15.091 1.00 11.04 H new ATOM 0 HG CYS A 813 0.016 -8.020 15.915 1.00 13.01 H new ATOM 368 N LYS A 814 -1.818 -13.266 14.042 1.00 33.24 N ATOM 369 CA LYS A 814 -2.118 -13.725 12.696 1.00 1.54 C ATOM 370 C LYS A 814 -0.999 -13.283 11.751 1.00 23.41 C ATOM 371 O LYS A 814 -1.206 -12.423 10.897 1.00 70.34 O ATOM 372 CB LYS A 814 -3.508 -13.252 12.266 1.00 11.25 C ATOM 373 CG LYS A 814 -4.426 -13.076 13.478 1.00 74.13 C ATOM 374 CD LYS A 814 -4.537 -14.377 14.275 1.00 32.20 C ATOM 375 CE LYS A 814 -5.618 -15.288 13.690 1.00 61.51 C ATOM 376 NZ LYS A 814 -6.929 -15.006 14.316 1.00 41.42 N ATOM 0 H LYS A 814 -1.871 -13.988 14.760 1.00 33.24 H new ATOM 0 HA LYS A 814 -2.153 -14.814 12.663 1.00 1.54 H new ATOM 0 HB2 LYS A 814 -3.425 -12.308 11.728 1.00 11.25 H new ATOM 0 HB3 LYS A 814 -3.945 -13.974 11.576 1.00 11.25 H new ATOM 0 HG2 LYS A 814 -4.039 -12.284 14.120 1.00 74.13 H new ATOM 0 HG3 LYS A 814 -5.416 -12.763 13.146 1.00 74.13 H new ATOM 0 HD2 LYS A 814 -3.578 -14.895 14.269 1.00 32.20 H new ATOM 0 HD3 LYS A 814 -4.771 -14.151 15.316 1.00 32.20 H new ATOM 0 HE2 LYS A 814 -5.683 -15.139 12.612 1.00 61.51 H new ATOM 0 HE3 LYS A 814 -5.348 -16.332 13.851 1.00 61.51 H new ATOM 0 HZ1 LYS A 814 -7.651 -15.633 13.907 1.00 41.42 H new ATOM 0 HZ2 LYS A 814 -6.867 -15.171 15.341 1.00 41.42 H new ATOM 0 HZ3 LYS A 814 -7.192 -14.015 14.140 1.00 41.42 H new ATOM 389 N ALA A 815 0.163 -13.893 11.936 1.00 2.53 N ATOM 390 CA ALA A 815 1.316 -13.573 11.111 1.00 75.43 C ATOM 391 C ALA A 815 1.956 -14.871 10.613 1.00 0.32 C ATOM 392 O ALA A 815 1.981 -15.870 11.331 1.00 44.45 O ATOM 393 CB ALA A 815 2.293 -12.710 11.910 1.00 1.32 C ATOM 0 H ALA A 815 0.331 -14.607 12.645 1.00 2.53 H new ATOM 0 HA ALA A 815 1.014 -12.997 10.236 1.00 75.43 H new ATOM 0 HB1 ALA A 815 3.157 -12.470 11.291 1.00 1.32 H new ATOM 0 HB2 ALA A 815 1.798 -11.788 12.215 1.00 1.32 H new ATOM 0 HB3 ALA A 815 2.621 -13.256 12.795 1.00 1.32 H new ATOM 399 N LEU A 816 2.458 -14.814 9.388 1.00 12.43 N ATOM 400 CA LEU A 816 3.097 -15.972 8.786 1.00 14.44 C ATOM 401 C LEU A 816 3.942 -16.688 9.841 1.00 32.24 C ATOM 402 O LEU A 816 4.768 -16.066 10.507 1.00 23.21 O ATOM 403 CB LEU A 816 3.885 -15.562 7.541 1.00 2.31 C ATOM 404 CG LEU A 816 4.821 -16.624 6.960 1.00 53.22 C ATOM 405 CD1 LEU A 816 6.091 -16.755 7.802 1.00 63.22 C ATOM 406 CD2 LEU A 816 4.098 -17.963 6.800 1.00 51.20 C ATOM 0 H LEU A 816 2.435 -13.984 8.796 1.00 12.43 H new ATOM 0 HA LEU A 816 2.348 -16.684 8.440 1.00 14.44 H new ATOM 0 HB2 LEU A 816 3.176 -15.268 6.767 1.00 2.31 H new ATOM 0 HB3 LEU A 816 4.476 -14.679 7.784 1.00 2.31 H new ATOM 0 HG LEU A 816 5.127 -16.302 5.964 1.00 53.22 H new ATOM 0 HD11 LEU A 816 6.739 -17.516 7.367 1.00 63.22 H new ATOM 0 HD12 LEU A 816 6.615 -15.800 7.820 1.00 63.22 H new ATOM 0 HD13 LEU A 816 5.825 -17.043 8.819 1.00 63.22 H new ATOM 0 HD21 LEU A 816 4.785 -18.700 6.385 1.00 51.20 H new ATOM 0 HD22 LEU A 816 3.744 -18.304 7.773 1.00 51.20 H new ATOM 0 HD23 LEU A 816 3.249 -17.840 6.128 1.00 51.20 H new ATOM 418 N ALA A 817 3.706 -17.986 9.961 1.00 34.30 N ATOM 419 CA ALA A 817 4.435 -18.794 10.924 1.00 71.13 C ATOM 420 C ALA A 817 5.328 -19.788 10.177 1.00 15.42 C ATOM 421 O ALA A 817 6.515 -19.907 10.476 1.00 34.22 O ATOM 422 CB ALA A 817 3.445 -19.489 11.861 1.00 63.52 C ATOM 0 H ALA A 817 3.020 -18.499 9.407 1.00 34.30 H new ATOM 0 HA ALA A 817 5.081 -18.168 11.539 1.00 71.13 H new ATOM 0 HB1 ALA A 817 3.992 -20.095 12.583 1.00 63.52 H new ATOM 0 HB2 ALA A 817 2.856 -18.739 12.389 1.00 63.52 H new ATOM 0 HB3 ALA A 817 2.781 -20.129 11.279 1.00 63.52 H new ATOM 428 N CYS A 818 4.722 -20.475 9.220 1.00 12.11 N ATOM 429 CA CYS A 818 5.447 -21.454 8.428 1.00 32.24 C ATOM 430 C CYS A 818 4.501 -22.001 7.357 1.00 43.30 C ATOM 431 O CYS A 818 3.368 -21.540 7.230 1.00 1.44 O ATOM 432 CB CYS A 818 6.027 -22.569 9.301 1.00 75.42 C ATOM 433 SG CYS A 818 4.858 -22.982 10.648 1.00 44.52 S ATOM 0 H CYS A 818 3.737 -20.373 8.975 1.00 12.11 H new ATOM 0 HA CYS A 818 6.301 -20.977 7.947 1.00 32.24 H new ATOM 0 HB2 CYS A 818 6.222 -23.453 8.694 1.00 75.42 H new ATOM 0 HB3 CYS A 818 6.982 -22.254 9.721 1.00 75.42 H new ATOM 0 HG CYS A 818 5.365 -22.620 11.789 1.00 44.52 H new ATOM 439 N TYR A 819 5.002 -22.976 6.613 1.00 42.11 N ATOM 440 CA TYR A 819 4.216 -23.590 5.556 1.00 23.23 C ATOM 441 C TYR A 819 4.104 -25.102 5.765 1.00 51.23 C ATOM 442 O TYR A 819 5.034 -25.734 6.264 1.00 73.14 O ATOM 443 CB TYR A 819 4.976 -23.322 4.256 1.00 54.35 C ATOM 444 CG TYR A 819 5.069 -21.841 3.884 1.00 54.43 C ATOM 445 CD1 TYR A 819 6.109 -21.072 4.366 1.00 75.02 C ATOM 446 CD2 TYR A 819 4.112 -21.273 3.066 1.00 45.01 C ATOM 447 CE1 TYR A 819 6.196 -19.678 4.016 1.00 41.02 C ATOM 448 CE2 TYR A 819 4.200 -19.879 2.716 1.00 40.11 C ATOM 449 CZ TYR A 819 5.237 -19.150 3.208 1.00 25.22 C ATOM 450 OH TYR A 819 5.320 -17.834 2.878 1.00 41.44 O ATOM 0 H TYR A 819 5.942 -23.356 6.721 1.00 42.11 H new ATOM 0 HA TYR A 819 3.206 -23.181 5.541 1.00 23.23 H new ATOM 0 HB2 TYR A 819 5.984 -23.727 4.346 1.00 54.35 H new ATOM 0 HB3 TYR A 819 4.487 -23.860 3.444 1.00 54.35 H new ATOM 0 HD1 TYR A 819 6.857 -21.516 5.006 1.00 75.02 H new ATOM 0 HD2 TYR A 819 3.298 -21.874 2.689 1.00 45.01 H new ATOM 0 HE1 TYR A 819 7.004 -19.065 4.387 1.00 41.02 H new ATOM 0 HE2 TYR A 819 3.459 -19.423 2.077 1.00 40.11 H new ATOM 0 HH TYR A 819 4.569 -17.595 2.295 1.00 41.44 H new ATOM 460 N THR A 820 2.958 -25.637 5.372 1.00 35.50 N ATOM 461 CA THR A 820 2.712 -27.063 5.509 1.00 14.15 C ATOM 462 C THR A 820 3.536 -27.847 4.487 1.00 72.33 C ATOM 463 O THR A 820 3.526 -29.077 4.488 1.00 21.33 O ATOM 464 CB THR A 820 1.205 -27.297 5.384 1.00 71.02 C ATOM 465 OG1 THR A 820 0.954 -28.409 6.238 1.00 31.43 O ATOM 466 CG2 THR A 820 0.804 -27.797 3.994 1.00 12.43 C ATOM 0 H THR A 820 2.189 -25.109 4.959 1.00 35.50 H new ATOM 0 HA THR A 820 3.032 -27.428 6.485 1.00 14.15 H new ATOM 0 HB THR A 820 0.674 -26.371 5.604 1.00 71.02 H new ATOM 0 HG1 THR A 820 0.047 -28.745 6.080 1.00 31.43 H new ATOM 0 HG21 THR A 820 -0.275 -27.947 3.959 1.00 12.43 H new ATOM 0 HG22 THR A 820 1.093 -27.060 3.245 1.00 12.43 H new ATOM 0 HG23 THR A 820 1.309 -28.741 3.787 1.00 12.43 H new ATOM 474 N ALA A 821 4.229 -27.103 3.638 1.00 64.43 N ATOM 475 CA ALA A 821 5.058 -27.714 2.612 1.00 54.24 C ATOM 476 C ALA A 821 6.283 -28.355 3.266 1.00 42.32 C ATOM 477 O ALA A 821 6.913 -29.236 2.683 1.00 72.10 O ATOM 478 CB ALA A 821 5.437 -26.661 1.568 1.00 1.25 C ATOM 0 H ALA A 821 4.234 -26.083 3.639 1.00 64.43 H new ATOM 0 HA ALA A 821 4.511 -28.503 2.096 1.00 54.24 H new ATOM 0 HB1 ALA A 821 6.059 -27.119 0.799 1.00 1.25 H new ATOM 0 HB2 ALA A 821 4.532 -26.259 1.112 1.00 1.25 H new ATOM 0 HB3 ALA A 821 5.990 -25.854 2.049 1.00 1.25 H new ATOM 484 N ASP A 822 6.585 -27.887 4.468 1.00 10.11 N ATOM 485 CA ASP A 822 7.724 -28.403 5.208 1.00 60.32 C ATOM 486 C ASP A 822 7.224 -29.195 6.418 1.00 62.22 C ATOM 487 O ASP A 822 7.922 -30.076 6.919 1.00 13.30 O ATOM 488 CB ASP A 822 8.609 -27.266 5.720 1.00 5.23 C ATOM 489 CG ASP A 822 9.266 -26.416 4.630 1.00 22.24 C ATOM 490 OD1 ASP A 822 8.611 -26.000 3.664 1.00 52.33 O ATOM 491 OD2 ASP A 822 10.523 -26.182 4.805 1.00 14.51 O ATOM 0 H ASP A 822 6.060 -27.156 4.948 1.00 10.11 H new ATOM 0 HA ASP A 822 8.304 -29.036 4.536 1.00 60.32 H new ATOM 0 HB2 ASP A 822 8.007 -26.615 6.354 1.00 5.23 H new ATOM 0 HB3 ASP A 822 9.391 -27.690 6.350 1.00 5.23 H new ATOM 497 N VAL A 823 6.020 -28.854 6.852 1.00 40.40 N ATOM 498 CA VAL A 823 5.419 -29.522 7.994 1.00 53.43 C ATOM 499 C VAL A 823 4.990 -30.933 7.586 1.00 43.31 C ATOM 500 O VAL A 823 4.089 -31.099 6.766 1.00 41.15 O ATOM 501 CB VAL A 823 4.264 -28.682 8.543 1.00 10.41 C ATOM 502 CG1 VAL A 823 3.798 -29.211 9.901 1.00 61.43 C ATOM 503 CG2 VAL A 823 4.655 -27.205 8.635 1.00 24.44 C ATOM 0 H VAL A 823 5.444 -28.124 6.433 1.00 40.40 H new ATOM 0 HA VAL A 823 6.143 -29.623 8.802 1.00 53.43 H new ATOM 0 HB VAL A 823 3.429 -28.765 7.847 1.00 10.41 H new ATOM 0 HG11 VAL A 823 2.977 -28.596 10.269 1.00 61.43 H new ATOM 0 HG12 VAL A 823 3.460 -30.242 9.793 1.00 61.43 H new ATOM 0 HG13 VAL A 823 4.625 -29.173 10.610 1.00 61.43 H new ATOM 0 HG21 VAL A 823 3.816 -26.630 9.028 1.00 24.44 H new ATOM 0 HG22 VAL A 823 5.512 -27.096 9.299 1.00 24.44 H new ATOM 0 HG23 VAL A 823 4.915 -26.835 7.643 1.00 24.44 H new ATOM 513 N ARG A 824 5.657 -31.913 8.178 1.00 74.12 N ATOM 514 CA ARG A 824 5.356 -33.305 7.886 1.00 1.44 C ATOM 515 C ARG A 824 5.162 -34.089 9.186 1.00 65.14 C ATOM 516 O ARG A 824 6.048 -34.112 10.039 1.00 10.41 O ATOM 517 CB ARG A 824 6.477 -33.951 7.071 1.00 64.04 C ATOM 518 CG ARG A 824 6.196 -33.844 5.570 1.00 34.35 C ATOM 519 CD ARG A 824 6.424 -32.417 5.070 1.00 51.41 C ATOM 520 NE ARG A 824 6.709 -32.429 3.618 1.00 41.12 N ATOM 521 CZ ARG A 824 7.833 -32.940 3.071 1.00 11.15 C ATOM 522 NH1 ARG A 824 8.788 -33.486 3.854 1.00 42.41 N ATOM 523 NH2 ARG A 824 7.984 -32.898 1.761 1.00 53.12 N ATOM 0 H ARG A 824 6.404 -31.771 8.858 1.00 74.12 H new ATOM 0 HA ARG A 824 4.436 -33.331 7.301 1.00 1.44 H new ATOM 0 HB2 ARG A 824 7.425 -33.466 7.302 1.00 64.04 H new ATOM 0 HB3 ARG A 824 6.578 -34.999 7.352 1.00 64.04 H new ATOM 0 HG2 ARG A 824 6.843 -34.532 5.025 1.00 34.35 H new ATOM 0 HG3 ARG A 824 5.168 -34.145 5.366 1.00 34.35 H new ATOM 0 HD2 ARG A 824 5.543 -31.807 5.271 1.00 51.41 H new ATOM 0 HD3 ARG A 824 7.256 -31.963 5.608 1.00 51.41 H new ATOM 0 HE ARG A 824 6.013 -32.026 2.991 1.00 41.12 H new ATOM 0 HH11 ARG A 824 8.663 -33.514 4.866 1.00 42.41 H new ATOM 0 HH12 ARG A 824 9.634 -33.870 3.434 1.00 42.41 H new ATOM 0 HH21 ARG A 824 7.258 -32.484 1.177 1.00 53.12 H new ATOM 0 HH22 ARG A 824 8.827 -33.280 1.332 1.00 53.12 H new ATOM 536 N VAL A 825 3.999 -34.713 9.295 1.00 70.42 N ATOM 537 CA VAL A 825 3.678 -35.497 10.476 1.00 70.05 C ATOM 538 C VAL A 825 4.433 -36.827 10.421 1.00 51.34 C ATOM 539 O VAL A 825 4.587 -37.413 9.351 1.00 73.55 O ATOM 540 CB VAL A 825 2.163 -35.674 10.590 1.00 75.20 C ATOM 541 CG1 VAL A 825 1.498 -34.395 11.102 1.00 2.14 C ATOM 542 CG2 VAL A 825 1.559 -36.108 9.253 1.00 52.03 C ATOM 0 H VAL A 825 3.267 -34.692 8.585 1.00 70.42 H new ATOM 0 HA VAL A 825 4.000 -34.978 11.379 1.00 70.05 H new ATOM 0 HB VAL A 825 1.973 -36.464 11.316 1.00 75.20 H new ATOM 0 HG11 VAL A 825 0.421 -34.548 11.174 1.00 2.14 H new ATOM 0 HG12 VAL A 825 1.895 -34.147 12.086 1.00 2.14 H new ATOM 0 HG13 VAL A 825 1.703 -33.577 10.411 1.00 2.14 H new ATOM 0 HG21 VAL A 825 0.481 -36.227 9.362 1.00 52.03 H new ATOM 0 HG22 VAL A 825 1.766 -35.350 8.497 1.00 52.03 H new ATOM 0 HG23 VAL A 825 1.999 -37.057 8.946 1.00 52.03 H new ATOM 552 N ILE A 826 4.884 -37.263 11.587 1.00 32.24 N ATOM 553 CA ILE A 826 5.619 -38.513 11.686 1.00 52.23 C ATOM 554 C ILE A 826 4.644 -39.650 11.999 1.00 50.33 C ATOM 555 O ILE A 826 4.486 -40.036 13.156 1.00 64.23 O ATOM 556 CB ILE A 826 6.760 -38.385 12.697 1.00 32.10 C ATOM 557 CG1 ILE A 826 7.957 -37.655 12.084 1.00 72.51 C ATOM 558 CG2 ILE A 826 7.149 -39.753 13.260 1.00 64.53 C ATOM 559 CD1 ILE A 826 8.532 -36.629 13.061 1.00 3.52 C ATOM 0 H ILE A 826 4.755 -36.773 12.472 1.00 32.24 H new ATOM 0 HA ILE A 826 6.093 -38.753 10.734 1.00 52.23 H new ATOM 0 HB ILE A 826 6.409 -37.781 13.534 1.00 32.10 H new ATOM 0 HG12 ILE A 826 8.728 -38.377 11.813 1.00 72.51 H new ATOM 0 HG13 ILE A 826 7.651 -37.155 11.165 1.00 72.51 H new ATOM 0 HG21 ILE A 826 7.962 -39.634 13.976 1.00 64.53 H new ATOM 0 HG22 ILE A 826 6.289 -40.199 13.759 1.00 64.53 H new ATOM 0 HG23 ILE A 826 7.474 -40.402 12.447 1.00 64.53 H new ATOM 0 HD11 ILE A 826 9.381 -36.124 12.601 1.00 3.52 H new ATOM 0 HD12 ILE A 826 7.766 -35.895 13.311 1.00 3.52 H new ATOM 0 HD13 ILE A 826 8.859 -37.135 13.969 1.00 3.52 H new ATOM 571 N GLU A 827 4.015 -40.153 10.947 1.00 70.40 N ATOM 572 CA GLU A 827 3.060 -41.238 11.095 1.00 32.31 C ATOM 573 C GLU A 827 1.819 -40.754 11.848 1.00 22.14 C ATOM 574 O GLU A 827 1.260 -41.485 12.665 1.00 53.15 O ATOM 575 CB GLU A 827 3.697 -42.437 11.801 1.00 73.12 C ATOM 576 CG GLU A 827 5.050 -42.785 11.177 1.00 73.20 C ATOM 577 CD GLU A 827 4.931 -42.935 9.659 1.00 62.21 C ATOM 578 OE1 GLU A 827 4.083 -43.700 9.176 1.00 64.42 O ATOM 579 OE2 GLU A 827 5.759 -42.221 8.974 1.00 11.13 O ATOM 0 H GLU A 827 4.148 -39.829 9.989 1.00 70.40 H new ATOM 0 HA GLU A 827 2.754 -41.564 10.101 1.00 32.31 H new ATOM 0 HB2 GLU A 827 3.828 -42.213 12.860 1.00 73.12 H new ATOM 0 HB3 GLU A 827 3.031 -43.297 11.737 1.00 73.12 H new ATOM 0 HG2 GLU A 827 5.775 -42.006 11.413 1.00 73.20 H new ATOM 0 HG3 GLU A 827 5.426 -43.712 11.609 1.00 73.20 H new ATOM 587 N GLU A 828 1.426 -39.525 11.548 1.00 74.32 N ATOM 588 CA GLU A 828 0.262 -38.935 12.187 1.00 74.05 C ATOM 589 C GLU A 828 0.360 -39.078 13.707 1.00 63.34 C ATOM 590 O GLU A 828 -0.624 -39.405 14.368 1.00 22.40 O ATOM 591 CB GLU A 828 -1.030 -39.563 11.659 1.00 13.34 C ATOM 592 CG GLU A 828 -1.519 -38.839 10.403 1.00 65.22 C ATOM 593 CD GLU A 828 -3.008 -39.096 10.166 1.00 71.20 C ATOM 594 OE1 GLU A 828 -3.508 -38.868 9.054 1.00 5.02 O ATOM 595 OE2 GLU A 828 -3.652 -39.551 11.187 1.00 10.22 O ATOM 0 H GLU A 828 1.893 -38.922 10.871 1.00 74.32 H new ATOM 0 HA GLU A 828 0.238 -37.873 11.943 1.00 74.05 H new ATOM 0 HB2 GLU A 828 -0.861 -40.616 11.433 1.00 13.34 H new ATOM 0 HB3 GLU A 828 -1.800 -39.522 12.430 1.00 13.34 H new ATOM 0 HG2 GLU A 828 -1.343 -37.768 10.505 1.00 65.22 H new ATOM 0 HG3 GLU A 828 -0.946 -39.176 9.539 1.00 65.22 H new ATOM 603 N CYS A 829 1.557 -38.826 14.216 1.00 21.42 N ATOM 604 CA CYS A 829 1.797 -38.923 15.646 1.00 21.30 C ATOM 605 C CYS A 829 2.138 -37.527 16.172 1.00 72.44 C ATOM 606 O CYS A 829 1.707 -37.147 17.259 1.00 35.41 O ATOM 607 CB CYS A 829 2.896 -39.938 15.968 1.00 60.14 C ATOM 608 SG CYS A 829 2.196 -41.629 16.002 1.00 41.40 S ATOM 0 H CYS A 829 2.371 -38.555 13.664 1.00 21.42 H new ATOM 0 HA CYS A 829 0.899 -39.289 16.144 1.00 21.30 H new ATOM 0 HB2 CYS A 829 3.688 -39.878 15.221 1.00 60.14 H new ATOM 0 HB3 CYS A 829 3.348 -39.703 16.932 1.00 60.14 H new ATOM 0 HG CYS A 829 1.719 -41.925 14.829 1.00 41.40 H new ATOM 614 N HIS A 830 2.908 -36.802 15.375 1.00 44.22 N ATOM 615 CA HIS A 830 3.312 -35.456 15.746 1.00 31.11 C ATOM 616 C HIS A 830 3.781 -34.699 14.502 1.00 65.51 C ATOM 617 O HIS A 830 4.333 -35.297 13.579 1.00 4.31 O ATOM 618 CB HIS A 830 4.368 -35.492 16.852 1.00 1.54 C ATOM 619 CG HIS A 830 3.798 -35.418 18.249 1.00 74.03 C ATOM 620 ND1 HIS A 830 3.741 -36.512 19.094 1.00 71.41 N ATOM 621 CD2 HIS A 830 3.261 -34.371 18.938 1.00 13.31 C ATOM 622 CE1 HIS A 830 3.192 -36.130 20.237 1.00 10.24 C ATOM 623 NE2 HIS A 830 2.895 -34.802 20.139 1.00 75.33 N ATOM 0 H HIS A 830 3.263 -37.121 14.474 1.00 44.22 H new ATOM 0 HA HIS A 830 2.458 -34.916 16.156 1.00 31.11 H new ATOM 0 HB2 HIS A 830 4.949 -36.409 16.756 1.00 1.54 H new ATOM 0 HB3 HIS A 830 5.059 -34.661 16.708 1.00 1.54 H new ATOM 0 HD2 HIS A 830 3.152 -33.362 18.569 1.00 13.31 H new ATOM 0 HE1 HIS A 830 3.011 -36.759 21.096 1.00 10.24 H new ATOM 0 HE2 HIS A 830 2.463 -34.234 20.868 1.00 75.33 H new ATOM 631 N TYR A 831 3.545 -33.396 14.517 1.00 10.01 N ATOM 632 CA TYR A 831 3.937 -32.551 13.402 1.00 72.23 C ATOM 633 C TYR A 831 5.373 -32.052 13.570 1.00 64.32 C ATOM 634 O TYR A 831 5.805 -31.755 14.683 1.00 53.24 O ATOM 635 CB TYR A 831 2.987 -31.352 13.427 1.00 71.11 C ATOM 636 CG TYR A 831 1.668 -31.588 12.689 1.00 53.33 C ATOM 637 CD1 TYR A 831 1.585 -31.352 11.331 1.00 13.23 C ATOM 638 CD2 TYR A 831 0.561 -32.036 13.380 1.00 34.10 C ATOM 639 CE1 TYR A 831 0.343 -31.574 10.637 1.00 40.55 C ATOM 640 CE2 TYR A 831 -0.681 -32.258 12.685 1.00 10.12 C ATOM 641 CZ TYR A 831 -0.729 -32.016 11.348 1.00 45.32 C ATOM 642 OH TYR A 831 -1.901 -32.225 10.692 1.00 72.14 O ATOM 0 H TYR A 831 3.087 -32.904 15.284 1.00 10.01 H new ATOM 0 HA TYR A 831 3.887 -33.105 12.465 1.00 72.23 H new ATOM 0 HB2 TYR A 831 2.770 -31.095 14.464 1.00 71.11 H new ATOM 0 HB3 TYR A 831 3.491 -30.493 12.984 1.00 71.11 H new ATOM 0 HD1 TYR A 831 2.451 -31.001 10.790 1.00 13.23 H new ATOM 0 HD2 TYR A 831 0.626 -32.220 14.442 1.00 34.10 H new ATOM 0 HE1 TYR A 831 0.264 -31.393 9.575 1.00 40.55 H new ATOM 0 HE2 TYR A 831 -1.555 -32.609 13.214 1.00 10.12 H new ATOM 0 HH TYR A 831 -2.579 -32.541 11.326 1.00 72.14 H new ATOM 652 N THR A 832 6.075 -31.976 12.448 1.00 35.22 N ATOM 653 CA THR A 832 7.454 -31.518 12.457 1.00 34.53 C ATOM 654 C THR A 832 7.847 -30.984 11.079 1.00 50.41 C ATOM 655 O THR A 832 7.694 -31.676 10.074 1.00 51.33 O ATOM 656 CB THR A 832 8.333 -32.676 12.933 1.00 31.44 C ATOM 657 OG1 THR A 832 7.921 -33.779 12.130 1.00 52.53 O ATOM 658 CG2 THR A 832 8.003 -33.113 14.362 1.00 30.22 C ATOM 0 H THR A 832 5.714 -32.224 11.527 1.00 35.22 H new ATOM 0 HA THR A 832 7.590 -30.684 13.145 1.00 34.53 H new ATOM 0 HB THR A 832 9.381 -32.382 12.876 1.00 31.44 H new ATOM 0 HG1 THR A 832 8.677 -34.091 11.590 1.00 52.53 H new ATOM 0 HG21 THR A 832 8.655 -33.937 14.650 1.00 30.22 H new ATOM 0 HG22 THR A 832 8.154 -32.275 15.043 1.00 30.22 H new ATOM 0 HG23 THR A 832 6.964 -33.438 14.412 1.00 30.22 H new ATOM 666 N VAL A 833 8.346 -29.756 11.076 1.00 23.43 N ATOM 667 CA VAL A 833 8.763 -29.121 9.838 1.00 51.41 C ATOM 668 C VAL A 833 10.286 -28.972 9.833 1.00 73.41 C ATOM 669 O VAL A 833 10.916 -28.968 10.889 1.00 10.21 O ATOM 670 CB VAL A 833 8.032 -27.788 9.662 1.00 10.12 C ATOM 671 CG1 VAL A 833 7.360 -27.355 10.967 1.00 61.03 C ATOM 672 CG2 VAL A 833 8.983 -26.705 9.149 1.00 11.42 C ATOM 0 H VAL A 833 8.471 -29.184 11.912 1.00 23.43 H new ATOM 0 HA VAL A 833 8.494 -29.740 8.982 1.00 51.41 H new ATOM 0 HB VAL A 833 7.252 -27.930 8.914 1.00 10.12 H new ATOM 0 HG11 VAL A 833 6.848 -26.405 10.815 1.00 61.03 H new ATOM 0 HG12 VAL A 833 6.638 -28.112 11.273 1.00 61.03 H new ATOM 0 HG13 VAL A 833 8.115 -27.239 11.744 1.00 61.03 H new ATOM 0 HG21 VAL A 833 8.438 -25.768 9.033 1.00 11.42 H new ATOM 0 HG22 VAL A 833 9.795 -26.566 9.862 1.00 11.42 H new ATOM 0 HG23 VAL A 833 9.394 -27.008 8.186 1.00 11.42 H new ATOM 682 N LEU A 834 10.833 -28.855 8.632 1.00 72.10 N ATOM 683 CA LEU A 834 12.270 -28.707 8.475 1.00 31.25 C ATOM 684 C LEU A 834 12.556 -27.692 7.367 1.00 60.20 C ATOM 685 O LEU A 834 11.657 -27.319 6.615 1.00 10.32 O ATOM 686 CB LEU A 834 12.927 -30.070 8.246 1.00 11.23 C ATOM 687 CG LEU A 834 12.179 -31.027 7.315 1.00 5.34 C ATOM 688 CD1 LEU A 834 13.039 -32.247 6.978 1.00 11.42 C ATOM 689 CD2 LEU A 834 10.827 -31.425 7.910 1.00 70.04 C ATOM 0 H LEU A 834 10.307 -28.860 7.758 1.00 72.10 H new ATOM 0 HA LEU A 834 12.715 -28.314 9.389 1.00 31.25 H new ATOM 0 HB2 LEU A 834 13.925 -29.906 7.840 1.00 11.23 H new ATOM 0 HB3 LEU A 834 13.052 -30.558 9.213 1.00 11.23 H new ATOM 0 HG LEU A 834 11.978 -30.506 6.379 1.00 5.34 H new ATOM 0 HD11 LEU A 834 12.484 -32.911 6.315 1.00 11.42 H new ATOM 0 HD12 LEU A 834 13.954 -31.922 6.483 1.00 11.42 H new ATOM 0 HD13 LEU A 834 13.292 -32.778 7.895 1.00 11.42 H new ATOM 0 HD21 LEU A 834 10.316 -32.105 7.229 1.00 70.04 H new ATOM 0 HD22 LEU A 834 10.983 -31.920 8.868 1.00 70.04 H new ATOM 0 HD23 LEU A 834 10.218 -30.533 8.057 1.00 70.04 H new ATOM 701 N GLY A 835 13.812 -27.275 7.301 1.00 54.43 N ATOM 702 CA GLY A 835 14.228 -26.310 6.297 1.00 75.03 C ATOM 703 C GLY A 835 15.073 -25.198 6.921 1.00 32.14 C ATOM 704 O GLY A 835 14.655 -24.566 7.891 1.00 62.25 O ATOM 0 H GLY A 835 14.555 -27.588 7.926 1.00 54.43 H new ATOM 0 HA2 GLY A 835 14.801 -26.814 5.519 1.00 75.03 H new ATOM 0 HA3 GLY A 835 13.350 -25.878 5.817 1.00 75.03 H new ATOM 708 N ASP A 836 16.246 -24.993 6.341 1.00 71.23 N ATOM 709 CA ASP A 836 17.153 -23.969 6.828 1.00 5.43 C ATOM 710 C ASP A 836 16.433 -22.619 6.839 1.00 2.25 C ATOM 711 O ASP A 836 16.731 -21.759 7.667 1.00 32.25 O ATOM 712 CB ASP A 836 18.380 -23.843 5.922 1.00 12.43 C ATOM 713 CG ASP A 836 18.123 -24.133 4.442 1.00 31.23 C ATOM 714 OD1 ASP A 836 18.124 -25.295 4.010 1.00 22.40 O ATOM 715 OD2 ASP A 836 17.912 -23.092 3.711 1.00 50.32 O ATOM 0 H ASP A 836 16.589 -25.519 5.538 1.00 71.23 H new ATOM 0 HA ASP A 836 17.473 -24.252 7.831 1.00 5.43 H new ATOM 0 HB2 ASP A 836 18.779 -22.833 6.015 1.00 12.43 H new ATOM 0 HB3 ASP A 836 19.150 -24.525 6.282 1.00 12.43 H new ATOM 721 N ALA A 837 15.499 -22.475 5.911 1.00 45.33 N ATOM 722 CA ALA A 837 14.734 -21.244 5.803 1.00 24.02 C ATOM 723 C ALA A 837 13.852 -21.087 7.043 1.00 5.15 C ATOM 724 O ALA A 837 13.531 -19.969 7.443 1.00 30.04 O ATOM 725 CB ALA A 837 13.921 -21.260 4.507 1.00 32.15 C ATOM 0 H ALA A 837 15.254 -23.191 5.227 1.00 45.33 H new ATOM 0 HA ALA A 837 15.399 -20.381 5.760 1.00 24.02 H new ATOM 0 HB1 ALA A 837 13.347 -20.337 4.426 1.00 32.15 H new ATOM 0 HB2 ALA A 837 14.596 -21.344 3.655 1.00 32.15 H new ATOM 0 HB3 ALA A 837 13.240 -22.111 4.515 1.00 32.15 H new ATOM 731 N PHE A 838 13.486 -22.223 7.618 1.00 62.33 N ATOM 732 CA PHE A 838 12.648 -22.226 8.804 1.00 12.05 C ATOM 733 C PHE A 838 13.493 -22.099 10.073 1.00 1.34 C ATOM 734 O PHE A 838 12.997 -21.670 11.114 1.00 74.20 O ATOM 735 CB PHE A 838 11.911 -23.567 8.829 1.00 44.12 C ATOM 736 CG PHE A 838 10.835 -23.705 7.750 1.00 22.41 C ATOM 737 CD1 PHE A 838 11.172 -23.606 6.436 1.00 3.54 C ATOM 738 CD2 PHE A 838 9.541 -23.929 8.105 1.00 4.51 C ATOM 739 CE1 PHE A 838 10.173 -23.734 5.435 1.00 25.23 C ATOM 740 CE2 PHE A 838 8.543 -24.057 7.104 1.00 34.11 C ATOM 741 CZ PHE A 838 8.880 -23.957 5.790 1.00 33.33 C ATOM 0 H PHE A 838 13.755 -23.148 7.284 1.00 62.33 H new ATOM 0 HA PHE A 838 11.958 -21.383 8.773 1.00 12.05 H new ATOM 0 HB2 PHE A 838 12.637 -24.371 8.709 1.00 44.12 H new ATOM 0 HB3 PHE A 838 11.449 -23.698 9.807 1.00 44.12 H new ATOM 0 HD1 PHE A 838 12.200 -23.430 6.154 1.00 3.54 H new ATOM 0 HD2 PHE A 838 9.273 -24.009 9.148 1.00 4.51 H new ATOM 0 HE1 PHE A 838 10.441 -23.654 4.392 1.00 25.23 H new ATOM 0 HE2 PHE A 838 7.516 -24.234 7.386 1.00 34.11 H new ATOM 0 HZ PHE A 838 8.120 -24.055 5.029 1.00 33.33 H new ATOM 751 N LYS A 839 14.756 -22.479 9.945 1.00 12.15 N ATOM 752 CA LYS A 839 15.675 -22.413 11.069 1.00 11.30 C ATOM 753 C LYS A 839 15.819 -20.958 11.519 1.00 12.45 C ATOM 754 O LYS A 839 16.071 -20.689 12.693 1.00 22.41 O ATOM 755 CB LYS A 839 17.005 -23.081 10.714 1.00 54.14 C ATOM 756 CG LYS A 839 16.803 -24.560 10.379 1.00 33.21 C ATOM 757 CD LYS A 839 18.136 -25.234 10.048 1.00 73.30 C ATOM 758 CE LYS A 839 17.912 -26.609 9.414 1.00 44.44 C ATOM 759 NZ LYS A 839 17.080 -27.457 10.296 1.00 63.45 N ATOM 0 H LYS A 839 15.165 -22.834 9.080 1.00 12.15 H new ATOM 0 HA LYS A 839 15.280 -22.972 11.917 1.00 11.30 H new ATOM 0 HB2 LYS A 839 17.457 -22.570 9.864 1.00 54.14 H new ATOM 0 HB3 LYS A 839 17.699 -22.985 11.549 1.00 54.14 H new ATOM 0 HG2 LYS A 839 16.335 -25.067 11.223 1.00 33.21 H new ATOM 0 HG3 LYS A 839 16.123 -24.655 9.532 1.00 33.21 H new ATOM 0 HD2 LYS A 839 18.707 -24.604 9.366 1.00 73.30 H new ATOM 0 HD3 LYS A 839 18.729 -25.340 10.956 1.00 73.30 H new ATOM 0 HE2 LYS A 839 17.426 -26.494 8.445 1.00 44.44 H new ATOM 0 HE3 LYS A 839 18.872 -27.093 9.233 1.00 44.44 H new ATOM 0 HZ1 LYS A 839 17.347 -28.454 10.171 1.00 63.45 H new ATOM 0 HZ2 LYS A 839 17.231 -27.180 11.287 1.00 63.45 H new ATOM 0 HZ3 LYS A 839 16.077 -27.334 10.051 1.00 63.45 H new ATOM 772 N GLU A 840 15.652 -20.056 10.563 1.00 62.21 N ATOM 773 CA GLU A 840 15.760 -18.635 10.846 1.00 24.24 C ATOM 774 C GLU A 840 14.375 -18.038 11.100 1.00 0.43 C ATOM 775 O GLU A 840 14.258 -16.879 11.497 1.00 21.21 O ATOM 776 CB GLU A 840 16.474 -17.902 9.709 1.00 52.11 C ATOM 777 CG GLU A 840 15.794 -18.179 8.366 1.00 22.24 C ATOM 778 CD GLU A 840 15.924 -16.978 7.428 1.00 54.22 C ATOM 779 OE1 GLU A 840 16.913 -16.873 6.688 1.00 41.01 O ATOM 780 OE2 GLU A 840 14.949 -16.135 7.484 1.00 10.41 O ATOM 0 H GLU A 840 15.442 -20.282 9.591 1.00 62.21 H new ATOM 0 HA GLU A 840 16.359 -18.508 11.748 1.00 24.24 H new ATOM 0 HB2 GLU A 840 16.474 -16.830 9.906 1.00 52.11 H new ATOM 0 HB3 GLU A 840 17.516 -18.218 9.665 1.00 52.11 H new ATOM 0 HG2 GLU A 840 16.242 -19.058 7.902 1.00 22.24 H new ATOM 0 HG3 GLU A 840 14.740 -18.406 8.528 1.00 22.24 H new ATOM 788 N CYS A 841 13.360 -18.855 10.861 1.00 2.01 N ATOM 789 CA CYS A 841 11.987 -18.422 11.059 1.00 44.42 C ATOM 790 C CYS A 841 11.604 -18.690 12.515 1.00 30.34 C ATOM 791 O CYS A 841 10.556 -18.242 12.978 1.00 70.22 O ATOM 792 CB CYS A 841 11.031 -19.108 10.081 1.00 3.50 C ATOM 793 SG CYS A 841 11.337 -18.506 8.380 1.00 5.32 S ATOM 0 H CYS A 841 13.461 -19.815 10.532 1.00 2.01 H new ATOM 0 HA CYS A 841 11.906 -17.354 10.854 1.00 44.42 H new ATOM 0 HB2 CYS A 841 11.168 -20.189 10.123 1.00 3.50 H new ATOM 0 HB3 CYS A 841 9.999 -18.906 10.367 1.00 3.50 H new ATOM 0 HG CYS A 841 12.478 -18.962 7.957 1.00 5.32 H new ATOM 799 N PHE A 842 12.474 -19.420 13.198 1.00 73.52 N ATOM 800 CA PHE A 842 12.239 -19.754 14.592 1.00 23.25 C ATOM 801 C PHE A 842 13.519 -19.599 15.416 1.00 24.40 C ATOM 802 O PHE A 842 14.523 -19.091 14.920 1.00 44.14 O ATOM 803 CB PHE A 842 11.794 -21.217 14.634 1.00 64.45 C ATOM 804 CG PHE A 842 12.931 -22.206 14.904 1.00 14.11 C ATOM 805 CD1 PHE A 842 14.037 -22.204 14.112 1.00 14.25 C ATOM 806 CD2 PHE A 842 12.835 -23.086 15.936 1.00 74.40 C ATOM 807 CE1 PHE A 842 15.091 -23.121 14.364 1.00 70.15 C ATOM 808 CE2 PHE A 842 13.889 -24.004 16.187 1.00 40.20 C ATOM 809 CZ PHE A 842 14.995 -24.002 15.395 1.00 10.24 C ATOM 0 H PHE A 842 13.343 -19.789 12.812 1.00 73.52 H new ATOM 0 HA PHE A 842 11.485 -19.088 15.012 1.00 23.25 H new ATOM 0 HB2 PHE A 842 11.034 -21.333 15.407 1.00 64.45 H new ATOM 0 HB3 PHE A 842 11.324 -21.470 13.684 1.00 64.45 H new ATOM 0 HD1 PHE A 842 14.113 -21.505 13.292 1.00 14.25 H new ATOM 0 HD2 PHE A 842 11.957 -23.087 16.565 1.00 74.40 H new ATOM 0 HE1 PHE A 842 15.970 -23.119 13.736 1.00 70.15 H new ATOM 0 HE2 PHE A 842 13.813 -24.703 17.006 1.00 40.20 H new ATOM 0 HZ PHE A 842 15.797 -24.700 15.585 1.00 10.24 H new ATOM 819 N VAL A 843 13.442 -20.047 16.661 1.00 62.25 N ATOM 820 CA VAL A 843 14.582 -19.965 17.558 1.00 42.23 C ATOM 821 C VAL A 843 14.623 -21.215 18.439 1.00 3.43 C ATOM 822 O VAL A 843 13.668 -21.989 18.469 1.00 23.31 O ATOM 823 CB VAL A 843 14.521 -18.666 18.364 1.00 33.01 C ATOM 824 CG1 VAL A 843 14.443 -17.450 17.439 1.00 4.34 C ATOM 825 CG2 VAL A 843 13.347 -18.685 19.345 1.00 54.10 C ATOM 0 H VAL A 843 12.607 -20.468 17.069 1.00 62.25 H new ATOM 0 HA VAL A 843 15.513 -19.936 16.992 1.00 42.23 H new ATOM 0 HB VAL A 843 15.441 -18.587 18.943 1.00 33.01 H new ATOM 0 HG11 VAL A 843 14.401 -16.540 18.037 1.00 4.34 H new ATOM 0 HG12 VAL A 843 15.325 -17.423 16.799 1.00 4.34 H new ATOM 0 HG13 VAL A 843 13.548 -17.520 16.821 1.00 4.34 H new ATOM 0 HG21 VAL A 843 13.326 -17.750 19.906 1.00 54.10 H new ATOM 0 HG22 VAL A 843 12.414 -18.798 18.793 1.00 54.10 H new ATOM 0 HG23 VAL A 843 13.464 -19.520 20.036 1.00 54.10 H new ATOM 835 N SER A 844 15.739 -21.372 19.136 1.00 63.12 N ATOM 836 CA SER A 844 15.917 -22.515 20.016 1.00 43.51 C ATOM 837 C SER A 844 16.474 -22.054 21.365 1.00 71.33 C ATOM 838 O SER A 844 17.554 -21.470 21.428 1.00 43.34 O ATOM 839 CB SER A 844 16.845 -23.555 19.386 1.00 20.41 C ATOM 840 OG SER A 844 18.201 -23.118 19.364 1.00 41.02 O ATOM 0 H SER A 844 16.529 -20.727 19.109 1.00 63.12 H new ATOM 0 HA SER A 844 14.945 -22.982 20.172 1.00 43.51 H new ATOM 0 HB2 SER A 844 16.774 -24.489 19.944 1.00 20.41 H new ATOM 0 HB3 SER A 844 16.516 -23.766 18.369 1.00 20.41 H new ATOM 0 HG SER A 844 18.323 -22.396 20.016 1.00 41.02 H new ATOM 846 N ARG A 845 15.711 -22.336 22.411 1.00 52.54 N ATOM 847 CA ARG A 845 16.114 -21.958 23.754 1.00 1.25 C ATOM 848 C ARG A 845 16.582 -23.188 24.534 1.00 72.50 C ATOM 849 O ARG A 845 15.920 -24.225 24.519 1.00 23.32 O ATOM 850 CB ARG A 845 14.961 -21.293 24.509 1.00 42.51 C ATOM 851 CG ARG A 845 14.179 -20.349 23.593 1.00 0.33 C ATOM 852 CD ARG A 845 14.804 -18.952 23.582 1.00 24.33 C ATOM 853 NE ARG A 845 16.280 -19.059 23.585 1.00 5.21 N ATOM 854 CZ ARG A 845 17.035 -19.146 22.469 1.00 2.22 C ATOM 855 NH1 ARG A 845 16.457 -19.140 21.249 1.00 4.41 N ATOM 856 NH2 ARG A 845 18.347 -19.237 22.589 1.00 74.11 N ATOM 0 H ARG A 845 14.816 -22.822 22.355 1.00 52.54 H new ATOM 0 HA ARG A 845 16.934 -21.246 23.665 1.00 1.25 H new ATOM 0 HB2 ARG A 845 14.293 -22.057 24.906 1.00 42.51 H new ATOM 0 HB3 ARG A 845 15.352 -20.738 25.361 1.00 42.51 H new ATOM 0 HG2 ARG A 845 14.161 -20.751 22.580 1.00 0.33 H new ATOM 0 HG3 ARG A 845 13.144 -20.285 23.929 1.00 0.33 H new ATOM 0 HD2 ARG A 845 14.473 -18.403 22.701 1.00 24.33 H new ATOM 0 HD3 ARG A 845 14.470 -18.388 24.453 1.00 24.33 H new ATOM 0 HE ARG A 845 16.757 -19.068 24.487 1.00 5.21 H new ATOM 0 HH11 ARG A 845 15.443 -19.069 21.165 1.00 4.41 H new ATOM 0 HH12 ARG A 845 17.034 -19.206 20.411 1.00 4.41 H new ATOM 0 HH21 ARG A 845 18.775 -19.241 23.515 1.00 74.11 H new ATOM 0 HH22 ARG A 845 18.932 -19.304 21.756 1.00 74.11 H new ATOM 869 N PRO A 846 17.749 -23.029 25.214 1.00 52.11 N ATOM 870 CA PRO A 846 18.313 -24.115 25.998 1.00 53.42 C ATOM 871 C PRO A 846 17.538 -24.308 27.303 1.00 24.12 C ATOM 872 O PRO A 846 16.550 -25.039 27.340 1.00 22.53 O ATOM 873 CB PRO A 846 19.765 -23.726 26.221 1.00 41.24 C ATOM 874 CG PRO A 846 19.842 -22.231 25.957 1.00 54.23 C ATOM 875 CD PRO A 846 18.559 -21.815 25.254 1.00 24.33 C ATOM 0 HA PRO A 846 18.246 -25.078 25.492 1.00 53.42 H new ATOM 0 HB2 PRO A 846 20.080 -23.960 27.238 1.00 41.24 H new ATOM 0 HB3 PRO A 846 20.424 -24.276 25.549 1.00 41.24 H new ATOM 0 HG2 PRO A 846 19.960 -21.684 26.892 1.00 54.23 H new ATOM 0 HG3 PRO A 846 20.709 -21.997 25.339 1.00 54.23 H new ATOM 0 HD2 PRO A 846 18.051 -21.017 25.796 1.00 24.33 H new ATOM 0 HD3 PRO A 846 18.761 -21.440 24.251 1.00 24.33 H new ATOM 1029 N PHE A 856 6.742 -35.723 24.652 1.00 44.44 N ATOM 1030 CA PHE A 856 7.962 -36.303 24.116 1.00 71.30 C ATOM 1031 C PHE A 856 9.183 -35.853 24.920 1.00 1.13 C ATOM 1032 O PHE A 856 9.046 -35.169 25.934 1.00 73.34 O ATOM 1033 CB PHE A 856 8.101 -35.803 22.677 1.00 40.11 C ATOM 1034 CG PHE A 856 7.576 -36.782 21.624 1.00 2.43 C ATOM 1035 CD1 PHE A 856 6.463 -37.520 21.878 1.00 55.13 C ATOM 1036 CD2 PHE A 856 8.223 -36.913 20.436 1.00 65.25 C ATOM 1037 CE1 PHE A 856 5.976 -38.428 20.901 1.00 75.21 C ATOM 1038 CE2 PHE A 856 7.736 -37.822 19.459 1.00 45.53 C ATOM 1039 CZ PHE A 856 6.623 -38.560 19.712 1.00 13.10 C ATOM 0 HA PHE A 856 7.909 -37.391 24.165 1.00 71.30 H new ATOM 0 HB2 PHE A 856 7.566 -34.858 22.578 1.00 40.11 H new ATOM 0 HB3 PHE A 856 9.152 -35.597 22.475 1.00 40.11 H new ATOM 0 HD1 PHE A 856 5.949 -37.416 22.822 1.00 55.13 H new ATOM 0 HD2 PHE A 856 9.107 -36.326 20.235 1.00 65.25 H new ATOM 0 HE1 PHE A 856 5.091 -39.014 21.102 1.00 75.21 H new ATOM 0 HE2 PHE A 856 8.250 -37.927 18.515 1.00 45.53 H new ATOM 0 HZ PHE A 856 6.253 -39.251 18.969 1.00 13.10 H new ATOM 1049 N GLU A 857 10.350 -36.254 24.438 1.00 21.44 N ATOM 1050 CA GLU A 857 11.595 -35.901 25.100 1.00 54.41 C ATOM 1051 C GLU A 857 12.132 -34.578 24.548 1.00 33.43 C ATOM 1052 O GLU A 857 12.824 -34.561 23.532 1.00 61.32 O ATOM 1053 CB GLU A 857 12.630 -37.017 24.953 1.00 63.12 C ATOM 1054 CG GLU A 857 12.013 -38.382 25.262 1.00 34.32 C ATOM 1055 CD GLU A 857 13.096 -39.415 25.580 1.00 40.11 C ATOM 1056 OE1 GLU A 857 14.172 -39.051 26.077 1.00 22.41 O ATOM 1057 OE2 GLU A 857 12.788 -40.634 25.293 1.00 71.30 O ATOM 0 H GLU A 857 10.460 -36.820 23.597 1.00 21.44 H new ATOM 0 HA GLU A 857 11.395 -35.775 26.164 1.00 54.41 H new ATOM 0 HB2 GLU A 857 13.030 -37.016 23.939 1.00 63.12 H new ATOM 0 HB3 GLU A 857 13.467 -36.832 25.626 1.00 63.12 H new ATOM 0 HG2 GLU A 857 11.331 -38.293 26.107 1.00 34.32 H new ATOM 0 HG3 GLU A 857 11.423 -38.719 24.410 1.00 34.32 H new ATOM 1065 N LYS A 858 11.792 -33.503 25.243 1.00 0.32 N ATOM 1066 CA LYS A 858 12.231 -32.179 24.836 1.00 45.04 C ATOM 1067 C LYS A 858 13.451 -31.773 25.665 1.00 23.44 C ATOM 1068 O LYS A 858 13.399 -31.776 26.894 1.00 2.33 O ATOM 1069 CB LYS A 858 11.074 -31.182 24.916 1.00 51.20 C ATOM 1070 CG LYS A 858 10.463 -31.163 26.319 1.00 51.14 C ATOM 1071 CD LYS A 858 9.670 -29.875 26.554 1.00 25.41 C ATOM 1072 CE LYS A 858 8.888 -29.946 27.867 1.00 51.30 C ATOM 1073 NZ LYS A 858 8.187 -31.244 27.984 1.00 62.12 N ATOM 0 H LYS A 858 11.217 -33.522 26.086 1.00 0.32 H new ATOM 0 HA LYS A 858 12.543 -32.186 23.792 1.00 45.04 H new ATOM 0 HB2 LYS A 858 11.430 -30.185 24.657 1.00 51.20 H new ATOM 0 HB3 LYS A 858 10.309 -31.447 24.186 1.00 51.20 H new ATOM 0 HG2 LYS A 858 9.809 -32.026 26.446 1.00 51.14 H new ATOM 0 HG3 LYS A 858 11.253 -31.249 27.065 1.00 51.14 H new ATOM 0 HD2 LYS A 858 10.350 -29.024 26.577 1.00 25.41 H new ATOM 0 HD3 LYS A 858 8.982 -29.711 25.725 1.00 25.41 H new ATOM 0 HE2 LYS A 858 9.568 -29.816 28.709 1.00 51.30 H new ATOM 0 HE3 LYS A 858 8.166 -29.131 27.911 1.00 51.30 H new ATOM 0 HZ1 LYS A 858 7.364 -31.139 28.611 1.00 62.12 H new ATOM 0 HZ2 LYS A 858 7.869 -31.553 27.043 1.00 62.12 H new ATOM 0 HZ3 LYS A 858 8.835 -31.954 28.380 1.00 62.12 H new ATOM 1086 N ARG A 859 14.521 -31.435 24.960 1.00 13.23 N ATOM 1087 CA ARG A 859 15.752 -31.028 25.616 1.00 14.33 C ATOM 1088 C ARG A 859 16.076 -29.571 25.279 1.00 10.13 C ATOM 1089 O ARG A 859 17.075 -29.029 25.750 1.00 14.32 O ATOM 1090 CB ARG A 859 16.922 -31.915 25.190 1.00 25.42 C ATOM 1091 CG ARG A 859 16.964 -33.203 26.016 1.00 15.32 C ATOM 1092 CD ARG A 859 15.786 -34.115 25.668 1.00 35.14 C ATOM 1093 NE ARG A 859 16.145 -35.527 25.929 1.00 52.12 N ATOM 1094 CZ ARG A 859 16.134 -36.097 27.152 1.00 25.34 C ATOM 1095 NH1 ARG A 859 15.782 -35.379 28.240 1.00 22.30 N ATOM 1096 NH2 ARG A 859 16.474 -37.367 27.269 1.00 21.54 N ATOM 0 H ARG A 859 14.561 -31.435 23.941 1.00 13.23 H new ATOM 0 HA ARG A 859 15.605 -31.132 26.691 1.00 14.33 H new ATOM 0 HB2 ARG A 859 16.830 -32.160 24.132 1.00 25.42 H new ATOM 0 HB3 ARG A 859 17.858 -31.371 25.311 1.00 25.42 H new ATOM 0 HG2 ARG A 859 17.902 -33.727 25.831 1.00 15.32 H new ATOM 0 HG3 ARG A 859 16.939 -32.959 27.078 1.00 15.32 H new ATOM 0 HD2 ARG A 859 14.914 -33.838 26.260 1.00 35.14 H new ATOM 0 HD3 ARG A 859 15.514 -33.988 24.620 1.00 35.14 H new ATOM 0 HE ARG A 859 16.418 -36.106 25.134 1.00 52.12 H new ATOM 0 HH11 ARG A 859 15.522 -34.398 28.141 1.00 22.30 H new ATOM 0 HH12 ARG A 859 15.776 -35.818 29.161 1.00 22.30 H new ATOM 0 HH21 ARG A 859 16.740 -37.902 26.442 1.00 21.54 H new ATOM 0 HH22 ARG A 859 16.471 -37.813 28.186 1.00 21.54 H new ATOM 1109 N ALA A 860 15.213 -28.979 24.467 1.00 43.33 N ATOM 1110 CA ALA A 860 15.396 -27.595 24.061 1.00 35.32 C ATOM 1111 C ALA A 860 14.087 -27.065 23.472 1.00 42.43 C ATOM 1112 O ALA A 860 13.574 -27.612 22.497 1.00 63.10 O ATOM 1113 CB ALA A 860 16.560 -27.502 23.074 1.00 43.14 C ATOM 0 H ALA A 860 14.385 -29.432 24.079 1.00 43.33 H new ATOM 0 HA ALA A 860 15.648 -26.972 24.920 1.00 35.32 H new ATOM 0 HB1 ALA A 860 16.697 -26.464 22.770 1.00 43.14 H new ATOM 0 HB2 ALA A 860 17.471 -27.864 23.551 1.00 43.14 H new ATOM 0 HB3 ALA A 860 16.343 -28.112 22.197 1.00 43.14 H new ATOM 1119 N LYS A 861 13.585 -26.005 24.088 1.00 52.33 N ATOM 1120 CA LYS A 861 12.346 -25.394 23.636 1.00 1.12 C ATOM 1121 C LYS A 861 12.619 -24.569 22.377 1.00 52.30 C ATOM 1122 O LYS A 861 13.764 -24.451 21.944 1.00 71.14 O ATOM 1123 CB LYS A 861 11.700 -24.593 24.768 1.00 13.03 C ATOM 1124 CG LYS A 861 11.357 -25.498 25.954 1.00 43.32 C ATOM 1125 CD LYS A 861 12.615 -25.867 26.743 1.00 62.45 C ATOM 1126 CE LYS A 861 12.263 -26.290 28.170 1.00 13.52 C ATOM 1127 NZ LYS A 861 13.450 -26.850 28.853 1.00 21.11 N ATOM 0 H LYS A 861 14.013 -25.554 24.896 1.00 52.33 H new ATOM 0 HA LYS A 861 11.620 -26.160 23.364 1.00 1.12 H new ATOM 0 HB2 LYS A 861 12.378 -23.804 25.093 1.00 13.03 H new ATOM 0 HB3 LYS A 861 10.795 -24.106 24.404 1.00 13.03 H new ATOM 0 HG2 LYS A 861 10.648 -24.992 26.609 1.00 43.32 H new ATOM 0 HG3 LYS A 861 10.869 -26.404 25.595 1.00 43.32 H new ATOM 0 HD2 LYS A 861 13.140 -26.678 26.239 1.00 62.45 H new ATOM 0 HD3 LYS A 861 13.295 -25.015 26.770 1.00 62.45 H new ATOM 0 HE2 LYS A 861 11.887 -25.432 28.727 1.00 13.52 H new ATOM 0 HE3 LYS A 861 11.465 -27.032 28.149 1.00 13.52 H new ATOM 0 HZ1 LYS A 861 13.193 -27.132 29.820 1.00 21.11 H new ATOM 0 HZ2 LYS A 861 13.792 -27.681 28.329 1.00 21.11 H new ATOM 0 HZ3 LYS A 861 14.201 -26.131 28.890 1.00 21.11 H new ATOM 1140 N ILE A 862 11.547 -24.018 21.825 1.00 24.51 N ATOM 1141 CA ILE A 862 11.657 -23.208 20.624 1.00 12.43 C ATOM 1142 C ILE A 862 10.497 -22.211 20.580 1.00 73.14 C ATOM 1143 O ILE A 862 9.404 -22.503 21.062 1.00 33.41 O ATOM 1144 CB ILE A 862 11.751 -24.098 19.384 1.00 41.25 C ATOM 1145 CG1 ILE A 862 10.413 -24.782 19.097 1.00 61.50 C ATOM 1146 CG2 ILE A 862 12.894 -25.106 19.518 1.00 71.22 C ATOM 1147 CD1 ILE A 862 9.689 -24.106 17.931 1.00 3.53 C ATOM 0 H ILE A 862 10.599 -24.117 22.188 1.00 24.51 H new ATOM 0 HA ILE A 862 12.578 -22.626 20.639 1.00 12.43 H new ATOM 0 HB ILE A 862 11.979 -23.466 18.526 1.00 41.25 H new ATOM 0 HG12 ILE A 862 10.581 -25.834 18.865 1.00 61.50 H new ATOM 0 HG13 ILE A 862 9.785 -24.749 19.988 1.00 61.50 H new ATOM 0 HG21 ILE A 862 12.939 -25.726 18.623 1.00 71.22 H new ATOM 0 HG22 ILE A 862 13.837 -24.573 19.638 1.00 71.22 H new ATOM 0 HG23 ILE A 862 12.722 -25.738 20.389 1.00 71.22 H new ATOM 0 HD11 ILE A 862 8.741 -24.612 17.749 1.00 3.53 H new ATOM 0 HD12 ILE A 862 9.501 -23.061 18.176 1.00 3.53 H new ATOM 0 HD13 ILE A 862 10.309 -24.163 17.036 1.00 3.53 H new ATOM 1159 N PHE A 863 10.774 -21.055 19.996 1.00 42.42 N ATOM 1160 CA PHE A 863 9.767 -20.013 19.882 1.00 63.22 C ATOM 1161 C PHE A 863 9.919 -19.245 18.567 1.00 21.31 C ATOM 1162 O PHE A 863 10.835 -19.512 17.790 1.00 33.33 O ATOM 1163 CB PHE A 863 9.986 -19.049 21.050 1.00 64.53 C ATOM 1164 CG PHE A 863 9.988 -19.725 22.422 1.00 34.44 C ATOM 1165 CD1 PHE A 863 10.989 -20.582 22.757 1.00 31.44 C ATOM 1166 CD2 PHE A 863 8.987 -19.469 23.307 1.00 22.14 C ATOM 1167 CE1 PHE A 863 10.990 -21.210 24.031 1.00 1.34 C ATOM 1168 CE2 PHE A 863 8.988 -20.096 24.581 1.00 23.33 C ATOM 1169 CZ PHE A 863 9.990 -20.953 24.916 1.00 33.45 C ATOM 0 H PHE A 863 11.682 -20.816 19.596 1.00 42.42 H new ATOM 0 HA PHE A 863 8.771 -20.455 19.901 1.00 63.22 H new ATOM 0 HB2 PHE A 863 10.936 -18.533 20.909 1.00 64.53 H new ATOM 0 HB3 PHE A 863 9.205 -18.289 21.032 1.00 64.53 H new ATOM 0 HD1 PHE A 863 11.784 -20.785 22.054 1.00 31.44 H new ATOM 0 HD2 PHE A 863 8.192 -18.789 23.041 1.00 22.14 H new ATOM 0 HE1 PHE A 863 11.785 -21.891 24.297 1.00 1.34 H new ATOM 0 HE2 PHE A 863 8.194 -19.893 25.284 1.00 23.33 H new ATOM 0 HZ PHE A 863 9.991 -21.429 25.885 1.00 33.45 H new ATOM 1179 N CYS A 864 9.008 -18.307 18.358 1.00 15.24 N ATOM 1180 CA CYS A 864 9.029 -17.498 17.151 1.00 35.41 C ATOM 1181 C CYS A 864 10.337 -16.706 17.127 1.00 51.35 C ATOM 1182 O CYS A 864 10.834 -16.289 18.172 1.00 52.45 O ATOM 1183 CB CYS A 864 7.805 -16.584 17.062 1.00 43.35 C ATOM 1184 SG CYS A 864 6.298 -17.507 17.535 1.00 53.15 S ATOM 0 H CYS A 864 8.250 -18.089 19.004 1.00 15.24 H new ATOM 0 HA CYS A 864 8.982 -18.145 16.275 1.00 35.41 H new ATOM 0 HB2 CYS A 864 7.935 -15.723 17.718 1.00 43.35 H new ATOM 0 HB3 CYS A 864 7.702 -16.199 16.048 1.00 43.35 H new ATOM 0 HG CYS A 864 6.383 -18.729 17.101 1.00 53.15 H new ATOM 1190 N ALA A 865 10.858 -16.522 15.922 1.00 14.22 N ATOM 1191 CA ALA A 865 12.099 -15.786 15.748 1.00 73.53 C ATOM 1192 C ALA A 865 11.781 -14.313 15.485 1.00 31.05 C ATOM 1193 O ALA A 865 12.672 -13.466 15.521 1.00 63.21 O ATOM 1194 CB ALA A 865 12.912 -16.418 14.616 1.00 74.02 C ATOM 0 H ALA A 865 10.443 -16.870 15.057 1.00 14.22 H new ATOM 0 HA ALA A 865 12.705 -15.836 16.653 1.00 73.53 H new ATOM 0 HB1 ALA A 865 13.843 -15.866 14.485 1.00 74.02 H new ATOM 0 HB2 ALA A 865 13.137 -17.455 14.865 1.00 74.02 H new ATOM 0 HB3 ALA A 865 12.336 -16.383 13.691 1.00 74.02 H new ATOM 1200 N ARG A 866 10.508 -14.052 15.228 1.00 33.02 N ATOM 1201 CA ARG A 866 10.061 -12.695 14.960 1.00 22.51 C ATOM 1202 C ARG A 866 10.346 -11.795 16.164 1.00 35.31 C ATOM 1203 O ARG A 866 11.027 -12.205 17.103 1.00 74.12 O ATOM 1204 CB ARG A 866 8.564 -12.660 14.648 1.00 72.11 C ATOM 1205 CG ARG A 866 8.222 -13.604 13.493 1.00 41.30 C ATOM 1206 CD ARG A 866 8.278 -12.871 12.151 1.00 14.52 C ATOM 1207 NE ARG A 866 9.675 -12.502 11.834 1.00 42.45 N ATOM 1208 CZ ARG A 866 10.023 -11.475 11.028 1.00 33.41 C ATOM 1209 NH1 ARG A 866 9.075 -10.706 10.451 1.00 63.21 N ATOM 1210 NH2 ARG A 866 11.303 -11.236 10.813 1.00 12.42 N ATOM 0 H ARG A 866 9.771 -14.757 15.200 1.00 33.02 H new ATOM 0 HA ARG A 866 10.610 -12.330 14.092 1.00 22.51 H new ATOM 0 HB2 ARG A 866 7.997 -12.944 15.535 1.00 72.11 H new ATOM 0 HB3 ARG A 866 8.266 -11.643 14.392 1.00 72.11 H new ATOM 0 HG2 ARG A 866 8.920 -14.441 13.484 1.00 41.30 H new ATOM 0 HG3 ARG A 866 7.226 -14.021 13.642 1.00 41.30 H new ATOM 0 HD2 ARG A 866 7.873 -13.506 11.363 1.00 14.52 H new ATOM 0 HD3 ARG A 866 7.657 -11.976 12.190 1.00 14.52 H new ATOM 0 HE ARG A 866 10.422 -13.058 12.250 1.00 42.45 H new ATOM 0 HH11 ARG A 866 8.088 -10.899 10.622 1.00 63.21 H new ATOM 0 HH12 ARG A 866 9.346 -9.932 9.844 1.00 63.21 H new ATOM 0 HH21 ARG A 866 12.012 -11.823 11.253 1.00 12.42 H new ATOM 0 HH22 ARG A 866 11.583 -10.465 10.207 1.00 12.42 H new ATOM 1223 N GLN A 867 9.809 -10.586 16.098 1.00 44.52 N ATOM 1224 CA GLN A 867 9.997 -9.624 17.171 1.00 60.00 C ATOM 1225 C GLN A 867 9.296 -10.105 18.443 1.00 3.02 C ATOM 1226 O GLN A 867 9.482 -9.529 19.514 1.00 50.10 O ATOM 1227 CB GLN A 867 9.496 -8.238 16.759 1.00 32.34 C ATOM 1228 CG GLN A 867 10.589 -7.454 16.030 1.00 34.21 C ATOM 1229 CD GLN A 867 10.125 -6.031 15.716 1.00 52.54 C ATOM 1230 OE1 GLN A 867 9.017 -5.627 16.029 1.00 32.44 O ATOM 1231 NE2 GLN A 867 11.032 -5.294 15.080 1.00 74.12 N ATOM 0 H GLN A 867 9.244 -10.250 15.318 1.00 44.52 H new ATOM 0 HA GLN A 867 11.064 -9.542 17.376 1.00 60.00 H new ATOM 0 HB2 GLN A 867 8.624 -8.340 16.113 1.00 32.34 H new ATOM 0 HB3 GLN A 867 9.175 -7.686 17.642 1.00 32.34 H new ATOM 0 HG2 GLN A 867 11.489 -7.420 16.645 1.00 34.21 H new ATOM 0 HG3 GLN A 867 10.854 -7.966 15.105 1.00 34.21 H new ATOM 0 HE21 GLN A 867 11.941 -5.693 14.847 1.00 74.12 H new ATOM 0 HE22 GLN A 867 10.818 -4.330 14.825 1.00 74.12 H new ATOM 1240 N ASN A 868 8.506 -11.156 18.284 1.00 55.03 N ATOM 1241 CA ASN A 868 7.776 -11.721 19.406 1.00 1.13 C ATOM 1242 C ASN A 868 8.532 -12.940 19.938 1.00 30.14 C ATOM 1243 O ASN A 868 8.901 -13.829 19.172 1.00 2.15 O ATOM 1244 CB ASN A 868 6.380 -12.179 18.981 1.00 14.12 C ATOM 1245 CG ASN A 868 5.628 -11.055 18.265 1.00 63.02 C ATOM 1246 OD1 ASN A 868 4.860 -10.312 18.854 1.00 24.42 O ATOM 1247 ND2 ASN A 868 5.892 -10.972 16.964 1.00 54.11 N ATOM 0 H ASN A 868 8.355 -11.632 17.394 1.00 55.03 H new ATOM 0 HA ASN A 868 7.685 -10.950 20.171 1.00 1.13 H new ATOM 0 HB2 ASN A 868 6.462 -13.044 18.322 1.00 14.12 H new ATOM 0 HB3 ASN A 868 5.816 -12.498 19.857 1.00 14.12 H new ATOM 0 HD21 ASN A 868 5.441 -10.254 16.397 1.00 54.11 H new ATOM 0 HD22 ASN A 868 6.546 -11.626 16.534 1.00 54.11 H new ATOM 1254 N CYS A 869 8.740 -12.943 21.247 1.00 54.11 N ATOM 1255 CA CYS A 869 9.445 -14.038 21.890 1.00 32.35 C ATOM 1256 C CYS A 869 8.442 -14.824 22.737 1.00 14.35 C ATOM 1257 O CYS A 869 8.551 -16.042 22.865 1.00 22.20 O ATOM 1258 CB CYS A 869 10.627 -13.538 22.723 1.00 31.42 C ATOM 1259 SG CYS A 869 11.626 -14.957 23.306 1.00 12.54 S ATOM 0 H CYS A 869 8.432 -12.204 21.879 1.00 54.11 H new ATOM 0 HA CYS A 869 9.871 -14.694 21.131 1.00 32.35 H new ATOM 0 HB2 CYS A 869 11.246 -12.868 22.126 1.00 31.42 H new ATOM 0 HB3 CYS A 869 10.265 -12.963 23.575 1.00 31.42 H new ATOM 0 HG CYS A 869 10.867 -16.006 23.416 1.00 12.54 H new ATOM 1265 N SER A 870 7.486 -14.094 23.295 1.00 45.24 N ATOM 1266 CA SER A 870 6.465 -14.707 24.126 1.00 54.01 C ATOM 1267 C SER A 870 5.686 -15.746 23.317 1.00 60.32 C ATOM 1268 O SER A 870 4.979 -16.578 23.884 1.00 2.23 O ATOM 1269 CB SER A 870 5.511 -13.654 24.694 1.00 43.44 C ATOM 1270 OG SER A 870 5.267 -12.600 23.766 1.00 11.52 O ATOM 0 H SER A 870 7.398 -13.084 23.187 1.00 45.24 H new ATOM 0 HA SER A 870 6.958 -15.202 24.963 1.00 54.01 H new ATOM 0 HB2 SER A 870 4.566 -14.127 24.962 1.00 43.44 H new ATOM 0 HB3 SER A 870 5.932 -13.240 25.611 1.00 43.44 H new ATOM 0 HG SER A 870 4.652 -11.949 24.165 1.00 11.52 H new ATOM 1276 N HIS A 871 5.842 -15.665 22.004 1.00 60.14 N ATOM 1277 CA HIS A 871 5.163 -16.588 21.111 1.00 75.33 C ATOM 1278 C HIS A 871 5.994 -17.864 20.962 1.00 41.13 C ATOM 1279 O HIS A 871 6.992 -17.879 20.242 1.00 14.41 O ATOM 1280 CB HIS A 871 4.856 -15.920 19.769 1.00 62.10 C ATOM 1281 CG HIS A 871 3.997 -14.684 19.881 1.00 55.42 C ATOM 1282 ND1 HIS A 871 3.378 -14.304 21.060 1.00 65.34 N ATOM 1283 CD2 HIS A 871 3.660 -13.745 18.950 1.00 12.02 C ATOM 1284 CE1 HIS A 871 2.702 -13.187 20.837 1.00 61.24 C ATOM 1285 NE2 HIS A 871 2.877 -12.842 19.529 1.00 63.44 N ATOM 0 H HIS A 871 6.429 -14.974 21.537 1.00 60.14 H new ATOM 0 HA HIS A 871 4.201 -16.871 21.538 1.00 75.33 H new ATOM 0 HB2 HIS A 871 5.795 -15.655 19.284 1.00 62.10 H new ATOM 0 HB3 HIS A 871 4.355 -16.641 19.122 1.00 62.10 H new ATOM 0 HD2 HIS A 871 3.976 -13.737 17.917 1.00 12.02 H new ATOM 0 HE1 HIS A 871 2.115 -12.645 21.563 1.00 61.24 H new ATOM 0 HE2 HIS A 871 2.473 -12.025 19.071 1.00 63.44 H new ATOM 1293 N ASP A 872 5.553 -18.904 21.654 1.00 54.04 N ATOM 1294 CA ASP A 872 6.244 -20.181 21.607 1.00 35.45 C ATOM 1295 C ASP A 872 5.457 -21.150 20.722 1.00 40.00 C ATOM 1296 O ASP A 872 4.239 -21.267 20.852 1.00 5.52 O ATOM 1297 CB ASP A 872 6.353 -20.799 23.003 1.00 71.12 C ATOM 1298 CG ASP A 872 5.105 -21.545 23.480 1.00 52.53 C ATOM 1299 OD1 ASP A 872 4.995 -22.770 23.327 1.00 65.22 O ATOM 1300 OD2 ASP A 872 4.207 -20.804 24.037 1.00 62.22 O ATOM 0 H ASP A 872 4.726 -18.888 22.250 1.00 54.04 H new ATOM 0 HA ASP A 872 7.244 -20.009 21.209 1.00 35.45 H new ATOM 0 HB2 ASP A 872 7.196 -21.489 23.013 1.00 71.12 H new ATOM 0 HB3 ASP A 872 6.580 -20.008 23.717 1.00 71.12 H new ATOM 1306 N TRP A 873 6.185 -21.820 19.841 1.00 60.20 N ATOM 1307 CA TRP A 873 5.571 -22.775 18.934 1.00 33.02 C ATOM 1308 C TRP A 873 5.300 -24.062 19.715 1.00 31.44 C ATOM 1309 O TRP A 873 4.150 -24.473 19.863 1.00 11.22 O ATOM 1310 CB TRP A 873 6.445 -22.998 17.699 1.00 72.24 C ATOM 1311 CG TRP A 873 6.361 -21.873 16.665 1.00 1.24 C ATOM 1312 CD1 TRP A 873 5.844 -20.646 16.822 1.00 65.34 C ATOM 1313 CD2 TRP A 873 6.832 -21.921 15.302 1.00 53.41 C ATOM 1314 NE1 TRP A 873 5.947 -19.903 15.663 1.00 1.03 N ATOM 1315 CE2 TRP A 873 6.567 -20.703 14.710 1.00 54.41 C ATOM 1316 CE3 TRP A 873 7.461 -22.959 14.592 1.00 13.34 C ATOM 1317 CZ2 TRP A 873 6.896 -20.408 13.381 1.00 31.24 C ATOM 1318 CZ3 TRP A 873 7.783 -22.649 13.266 1.00 43.42 C ATOM 1319 CH2 TRP A 873 7.523 -21.427 12.655 1.00 21.40 C ATOM 0 H TRP A 873 7.195 -21.720 19.736 1.00 60.20 H new ATOM 0 HA TRP A 873 4.624 -22.392 18.555 1.00 33.02 H new ATOM 0 HB2 TRP A 873 7.482 -23.110 18.016 1.00 72.24 H new ATOM 0 HB3 TRP A 873 6.154 -23.935 17.225 1.00 72.24 H new ATOM 0 HD1 TRP A 873 5.403 -20.285 17.739 1.00 65.34 H new ATOM 0 HE1 TRP A 873 5.627 -18.944 15.530 1.00 1.03 H new ATOM 0 HE3 TRP A 873 7.678 -23.920 15.035 1.00 13.34 H new ATOM 0 HZ2 TRP A 873 6.678 -19.446 12.940 1.00 31.24 H new ATOM 0 HZ3 TRP A 873 8.268 -23.412 12.675 1.00 43.42 H new ATOM 0 HH2 TRP A 873 7.804 -21.265 11.625 1.00 21.40 H new ATOM 1330 N GLY A 874 6.379 -24.664 20.195 1.00 13.52 N ATOM 1331 CA GLY A 874 6.272 -25.896 20.958 1.00 41.14 C ATOM 1332 C GLY A 874 7.571 -26.189 21.711 1.00 1.43 C ATOM 1333 O GLY A 874 7.848 -25.574 22.740 1.00 42.41 O ATOM 0 H GLY A 874 7.332 -24.321 20.070 1.00 13.52 H new ATOM 0 HA2 GLY A 874 5.447 -25.819 21.666 1.00 41.14 H new ATOM 0 HA3 GLY A 874 6.041 -26.724 20.288 1.00 41.14 H new ATOM 1337 N ILE A 875 8.333 -27.128 21.170 1.00 0.31 N ATOM 1338 CA ILE A 875 9.596 -27.509 21.779 1.00 61.45 C ATOM 1339 C ILE A 875 10.431 -28.290 20.762 1.00 25.30 C ATOM 1340 O ILE A 875 9.969 -28.569 19.657 1.00 45.34 O ATOM 1341 CB ILE A 875 9.354 -28.266 23.086 1.00 10.33 C ATOM 1342 CG1 ILE A 875 8.232 -29.293 22.926 1.00 75.02 C ATOM 1343 CG2 ILE A 875 9.083 -27.296 24.238 1.00 1.03 C ATOM 1344 CD1 ILE A 875 8.433 -30.132 21.662 1.00 14.21 C ATOM 0 H ILE A 875 8.100 -27.636 20.317 1.00 0.31 H new ATOM 0 HA ILE A 875 10.170 -26.624 22.052 1.00 61.45 H new ATOM 0 HB ILE A 875 10.261 -28.817 23.335 1.00 10.33 H new ATOM 0 HG12 ILE A 875 8.204 -29.945 23.799 1.00 75.02 H new ATOM 0 HG13 ILE A 875 7.270 -28.782 22.879 1.00 75.02 H new ATOM 0 HG21 ILE A 875 8.914 -27.859 25.156 1.00 1.03 H new ATOM 0 HG22 ILE A 875 9.942 -26.638 24.369 1.00 1.03 H new ATOM 0 HG23 ILE A 875 8.200 -26.699 24.011 1.00 1.03 H new ATOM 0 HD11 ILE A 875 7.622 -30.854 21.572 1.00 14.21 H new ATOM 0 HD12 ILE A 875 8.436 -29.479 20.789 1.00 14.21 H new ATOM 0 HD13 ILE A 875 9.384 -30.661 21.724 1.00 14.21 H new ATOM 1356 N HIS A 876 11.647 -28.622 21.173 1.00 52.34 N ATOM 1357 CA HIS A 876 12.551 -29.365 20.312 1.00 71.14 C ATOM 1358 C HIS A 876 12.756 -30.772 20.876 1.00 71.42 C ATOM 1359 O HIS A 876 13.371 -30.940 21.928 1.00 52.12 O ATOM 1360 CB HIS A 876 13.865 -28.606 20.120 1.00 43.14 C ATOM 1361 CG HIS A 876 14.533 -28.861 18.789 1.00 21.04 C ATOM 1362 ND1 HIS A 876 14.745 -27.864 17.854 1.00 42.25 N ATOM 1363 CD2 HIS A 876 15.034 -30.009 18.249 1.00 2.14 C ATOM 1364 CE1 HIS A 876 15.347 -28.399 16.801 1.00 15.22 C ATOM 1365 NE2 HIS A 876 15.524 -29.728 17.048 1.00 23.42 N ATOM 0 H HIS A 876 12.027 -28.390 22.091 1.00 52.34 H new ATOM 0 HA HIS A 876 12.111 -29.469 19.320 1.00 71.14 H new ATOM 0 HB2 HIS A 876 13.674 -27.538 20.220 1.00 43.14 H new ATOM 0 HB3 HIS A 876 14.553 -28.883 20.919 1.00 43.14 H new ATOM 0 HD1 HIS A 876 14.483 -26.884 17.957 1.00 42.25 H new ATOM 0 HD2 HIS A 876 15.032 -30.981 18.719 1.00 2.14 H new ATOM 0 HE1 HIS A 876 15.645 -27.874 15.905 1.00 15.22 H new ATOM 1373 N VAL A 877 12.229 -31.748 20.151 1.00 32.21 N ATOM 1374 CA VAL A 877 12.346 -33.136 20.566 1.00 41.20 C ATOM 1375 C VAL A 877 13.337 -33.856 19.649 1.00 5.45 C ATOM 1376 O VAL A 877 14.025 -33.220 18.852 1.00 72.04 O ATOM 1377 CB VAL A 877 10.965 -33.794 20.587 1.00 21.23 C ATOM 1378 CG1 VAL A 877 10.067 -33.149 21.644 1.00 34.23 C ATOM 1379 CG2 VAL A 877 10.311 -33.741 19.205 1.00 22.31 C ATOM 0 H VAL A 877 11.720 -31.605 19.279 1.00 32.21 H new ATOM 0 HA VAL A 877 12.737 -33.199 21.581 1.00 41.20 H new ATOM 0 HB VAL A 877 11.097 -34.842 20.854 1.00 21.23 H new ATOM 0 HG11 VAL A 877 9.091 -33.635 21.638 1.00 34.23 H new ATOM 0 HG12 VAL A 877 10.523 -33.263 22.627 1.00 34.23 H new ATOM 0 HG13 VAL A 877 9.946 -32.089 21.421 1.00 34.23 H new ATOM 0 HG21 VAL A 877 9.331 -34.215 19.248 1.00 22.31 H new ATOM 0 HG22 VAL A 877 10.198 -32.702 18.896 1.00 22.31 H new ATOM 0 HG23 VAL A 877 10.938 -34.268 18.485 1.00 22.31 H new ATOM 1389 N LYS A 878 13.380 -35.172 19.794 1.00 11.13 N ATOM 1390 CA LYS A 878 14.276 -35.985 18.989 1.00 13.14 C ATOM 1391 C LYS A 878 13.571 -37.288 18.608 1.00 33.35 C ATOM 1392 O LYS A 878 12.687 -37.753 19.327 1.00 71.03 O ATOM 1393 CB LYS A 878 15.606 -36.195 19.715 1.00 3.30 C ATOM 1394 CG LYS A 878 16.572 -37.020 18.862 1.00 40.53 C ATOM 1395 CD LYS A 878 17.922 -37.182 19.564 1.00 73.54 C ATOM 1396 CE LYS A 878 18.727 -38.326 18.944 1.00 21.54 C ATOM 1397 NZ LYS A 878 18.825 -38.157 17.477 1.00 2.54 N ATOM 0 H LYS A 878 12.809 -35.696 20.457 1.00 11.13 H new ATOM 0 HA LYS A 878 14.524 -35.473 18.059 1.00 13.14 H new ATOM 0 HB2 LYS A 878 16.054 -35.229 19.947 1.00 3.30 H new ATOM 0 HB3 LYS A 878 15.430 -36.701 20.664 1.00 3.30 H new ATOM 0 HG2 LYS A 878 16.141 -38.001 18.664 1.00 40.53 H new ATOM 0 HG3 LYS A 878 16.716 -36.535 17.897 1.00 40.53 H new ATOM 0 HD2 LYS A 878 18.488 -36.253 19.491 1.00 73.54 H new ATOM 0 HD3 LYS A 878 17.764 -37.377 20.625 1.00 73.54 H new ATOM 0 HE2 LYS A 878 19.726 -38.354 19.380 1.00 21.54 H new ATOM 0 HE3 LYS A 878 18.252 -39.279 19.175 1.00 21.54 H new ATOM 0 HZ1 LYS A 878 19.581 -38.767 17.107 1.00 2.54 H new ATOM 0 HZ2 LYS A 878 17.921 -38.420 17.036 1.00 2.54 H new ATOM 0 HZ3 LYS A 878 19.042 -37.164 17.256 1.00 2.54 H new ATOM 1410 N TYR A 879 13.988 -37.841 17.479 1.00 22.32 N ATOM 1411 CA TYR A 879 13.408 -39.082 16.994 1.00 12.02 C ATOM 1412 C TYR A 879 14.496 -40.051 16.529 1.00 62.43 C ATOM 1413 O TYR A 879 15.636 -39.649 16.304 1.00 44.53 O ATOM 1414 CB TYR A 879 12.536 -38.700 15.797 1.00 52.35 C ATOM 1415 CG TYR A 879 11.465 -39.736 15.450 1.00 31.15 C ATOM 1416 CD1 TYR A 879 10.759 -40.361 16.458 1.00 73.41 C ATOM 1417 CD2 TYR A 879 11.205 -40.046 14.131 1.00 41.32 C ATOM 1418 CE1 TYR A 879 9.751 -41.337 16.132 1.00 12.11 C ATOM 1419 CE2 TYR A 879 10.197 -41.021 13.805 1.00 22.21 C ATOM 1420 CZ TYR A 879 9.520 -41.619 14.822 1.00 52.32 C ATOM 1421 OH TYR A 879 8.568 -42.540 14.514 1.00 11.02 O ATOM 0 H TYR A 879 14.721 -37.452 16.886 1.00 22.32 H new ATOM 0 HA TYR A 879 12.841 -39.575 17.784 1.00 12.02 H new ATOM 0 HB2 TYR A 879 12.050 -37.746 16.004 1.00 52.35 H new ATOM 0 HB3 TYR A 879 13.176 -38.550 14.928 1.00 52.35 H new ATOM 0 HD1 TYR A 879 10.962 -40.118 17.491 1.00 73.41 H new ATOM 0 HD2 TYR A 879 11.758 -39.557 13.343 1.00 41.32 H new ATOM 0 HE1 TYR A 879 9.191 -41.834 16.911 1.00 12.11 H new ATOM 0 HE2 TYR A 879 9.983 -41.272 12.776 1.00 22.21 H new ATOM 0 HH TYR A 879 8.511 -42.639 13.541 1.00 11.02 H new ATOM 1431 N LYS A 880 14.106 -41.311 16.398 1.00 12.31 N ATOM 1432 CA LYS A 880 15.034 -42.341 15.963 1.00 10.34 C ATOM 1433 C LYS A 880 15.571 -41.984 14.576 1.00 62.51 C ATOM 1434 O LYS A 880 16.577 -42.539 14.135 1.00 52.54 O ATOM 1435 CB LYS A 880 14.375 -43.720 16.032 1.00 13.33 C ATOM 1436 CG LYS A 880 14.590 -44.362 17.404 1.00 32.41 C ATOM 1437 CD LYS A 880 13.738 -43.673 18.472 1.00 5.21 C ATOM 1438 CE LYS A 880 12.310 -44.222 18.473 1.00 3.43 C ATOM 1439 NZ LYS A 880 11.452 -43.434 17.561 1.00 53.04 N ATOM 0 H LYS A 880 13.160 -41.642 16.586 1.00 12.31 H new ATOM 0 HA LYS A 880 15.891 -42.390 16.634 1.00 10.34 H new ATOM 0 HB2 LYS A 880 13.307 -43.627 15.833 1.00 13.33 H new ATOM 0 HB3 LYS A 880 14.789 -44.364 15.256 1.00 13.33 H new ATOM 0 HG2 LYS A 880 14.335 -45.421 17.358 1.00 32.41 H new ATOM 0 HG3 LYS A 880 15.643 -44.299 17.678 1.00 32.41 H new ATOM 0 HD2 LYS A 880 14.189 -43.821 19.453 1.00 5.21 H new ATOM 0 HD3 LYS A 880 13.718 -42.599 18.289 1.00 5.21 H new ATOM 0 HE2 LYS A 880 12.316 -45.267 18.164 1.00 3.43 H new ATOM 0 HE3 LYS A 880 11.902 -44.190 19.483 1.00 3.43 H new ATOM 0 HZ1 LYS A 880 10.476 -43.428 17.921 1.00 53.04 H new ATOM 0 HZ2 LYS A 880 11.807 -42.458 17.507 1.00 53.04 H new ATOM 0 HZ3 LYS A 880 11.468 -43.862 16.613 1.00 53.04 H new ATOM 1452 N THR A 881 14.877 -41.062 13.927 1.00 52.44 N ATOM 1453 CA THR A 881 15.272 -40.625 12.598 1.00 15.11 C ATOM 1454 C THR A 881 16.141 -39.369 12.686 1.00 72.00 C ATOM 1455 O THR A 881 17.331 -39.411 12.379 1.00 41.25 O ATOM 1456 CB THR A 881 14.001 -40.428 11.768 1.00 3.24 C ATOM 1457 OG1 THR A 881 13.150 -41.494 12.179 1.00 54.01 O ATOM 1458 CG2 THR A 881 14.230 -40.686 10.278 1.00 75.23 C ATOM 0 H THR A 881 14.043 -40.605 14.296 1.00 52.44 H new ATOM 0 HA THR A 881 15.889 -41.375 12.102 1.00 15.11 H new ATOM 0 HB THR A 881 13.629 -39.413 11.907 1.00 3.24 H new ATOM 0 HG1 THR A 881 12.453 -41.146 12.773 1.00 54.01 H new ATOM 0 HG21 THR A 881 13.298 -40.533 9.735 1.00 75.23 H new ATOM 0 HG22 THR A 881 14.987 -39.998 9.902 1.00 75.23 H new ATOM 0 HG23 THR A 881 14.569 -41.712 10.134 1.00 75.23 H new ATOM 1466 N PHE A 882 15.512 -38.281 13.107 1.00 23.41 N ATOM 1467 CA PHE A 882 16.214 -37.016 13.239 1.00 15.34 C ATOM 1468 C PHE A 882 15.629 -36.182 14.381 1.00 11.41 C ATOM 1469 O PHE A 882 14.609 -36.548 14.963 1.00 51.31 O ATOM 1470 CB PHE A 882 16.024 -36.260 11.923 1.00 43.23 C ATOM 1471 CG PHE A 882 16.588 -36.988 10.701 1.00 44.32 C ATOM 1472 CD1 PHE A 882 15.973 -38.106 10.231 1.00 13.21 C ATOM 1473 CD2 PHE A 882 17.705 -36.517 10.084 1.00 4.34 C ATOM 1474 CE1 PHE A 882 16.496 -38.781 9.097 1.00 22.32 C ATOM 1475 CE2 PHE A 882 18.229 -37.192 8.950 1.00 31.34 C ATOM 1476 CZ PHE A 882 17.613 -38.310 8.481 1.00 63.43 C ATOM 0 H PHE A 882 14.525 -38.250 13.361 1.00 23.41 H new ATOM 0 HA PHE A 882 17.267 -37.195 13.457 1.00 15.34 H new ATOM 0 HB2 PHE A 882 14.960 -36.082 11.768 1.00 43.23 H new ATOM 0 HB3 PHE A 882 16.502 -35.284 12.004 1.00 43.23 H new ATOM 0 HD1 PHE A 882 15.086 -38.481 10.721 1.00 13.21 H new ATOM 0 HD2 PHE A 882 18.194 -35.629 10.457 1.00 4.34 H new ATOM 0 HE1 PHE A 882 16.007 -39.668 8.724 1.00 22.32 H new ATOM 0 HE2 PHE A 882 19.116 -36.818 8.460 1.00 31.34 H new ATOM 0 HZ PHE A 882 18.011 -38.824 7.619 1.00 63.43 H new ATOM 1486 N GLU A 883 16.300 -35.076 14.668 1.00 44.14 N ATOM 1487 CA GLU A 883 15.860 -34.187 15.729 1.00 2.13 C ATOM 1488 C GLU A 883 15.159 -32.962 15.139 1.00 14.02 C ATOM 1489 O GLU A 883 15.790 -32.140 14.477 1.00 53.12 O ATOM 1490 CB GLU A 883 17.034 -33.771 16.618 1.00 20.11 C ATOM 1491 CG GLU A 883 17.906 -32.725 15.921 1.00 11.31 C ATOM 1492 CD GLU A 883 19.322 -32.717 16.501 1.00 52.33 C ATOM 1493 OE1 GLU A 883 20.264 -32.269 15.830 1.00 52.00 O ATOM 1494 OE2 GLU A 883 19.425 -33.197 17.694 1.00 44.34 O ATOM 0 H GLU A 883 17.146 -34.775 14.184 1.00 44.14 H new ATOM 0 HA GLU A 883 15.146 -34.724 16.353 1.00 2.13 H new ATOM 0 HB2 GLU A 883 16.658 -33.368 17.558 1.00 20.11 H new ATOM 0 HB3 GLU A 883 17.636 -34.646 16.864 1.00 20.11 H new ATOM 0 HG2 GLU A 883 17.948 -32.935 14.852 1.00 11.31 H new ATOM 0 HG3 GLU A 883 17.457 -31.738 16.034 1.00 11.31 H new ATOM 1502 N ILE A 884 13.862 -32.879 15.401 1.00 44.11 N ATOM 1503 CA ILE A 884 13.068 -31.768 14.904 1.00 63.21 C ATOM 1504 C ILE A 884 12.087 -31.322 15.990 1.00 60.41 C ATOM 1505 O ILE A 884 11.795 -32.077 16.916 1.00 63.51 O ATOM 1506 CB ILE A 884 12.395 -32.141 13.582 1.00 54.54 C ATOM 1507 CG1 ILE A 884 11.812 -33.554 13.642 1.00 63.21 C ATOM 1508 CG2 ILE A 884 13.360 -31.968 12.407 1.00 54.30 C ATOM 1509 CD1 ILE A 884 12.922 -34.607 13.594 1.00 52.45 C ATOM 0 H ILE A 884 13.342 -33.563 15.951 1.00 44.11 H new ATOM 0 HA ILE A 884 13.706 -30.913 14.680 1.00 63.21 H new ATOM 0 HB ILE A 884 11.563 -31.457 13.418 1.00 54.54 H new ATOM 0 HG12 ILE A 884 11.232 -33.673 14.557 1.00 63.21 H new ATOM 0 HG13 ILE A 884 11.127 -33.704 12.808 1.00 63.21 H new ATOM 0 HG21 ILE A 884 12.856 -32.240 11.479 1.00 54.30 H new ATOM 0 HG22 ILE A 884 13.684 -30.929 12.353 1.00 54.30 H new ATOM 0 HG23 ILE A 884 14.228 -32.612 12.551 1.00 54.30 H new ATOM 0 HD11 ILE A 884 12.481 -35.603 13.638 1.00 52.45 H new ATOM 0 HD12 ILE A 884 13.485 -34.500 12.667 1.00 52.45 H new ATOM 0 HD13 ILE A 884 13.592 -34.469 14.443 1.00 52.45 H new ATOM 1521 N PRO A 885 11.592 -30.065 15.836 1.00 20.02 N ATOM 1522 CA PRO A 885 10.650 -29.510 16.793 1.00 53.44 C ATOM 1523 C PRO A 885 9.258 -30.117 16.607 1.00 31.54 C ATOM 1524 O PRO A 885 8.778 -30.248 15.482 1.00 24.22 O ATOM 1525 CB PRO A 885 10.680 -28.010 16.549 1.00 40.40 C ATOM 1526 CG PRO A 885 11.281 -27.824 15.165 1.00 21.12 C ATOM 1527 CD PRO A 885 11.915 -29.142 14.752 1.00 61.21 C ATOM 0 HA PRO A 885 10.915 -29.738 17.825 1.00 53.44 H new ATOM 0 HB2 PRO A 885 9.677 -27.586 16.599 1.00 40.40 H new ATOM 0 HB3 PRO A 885 11.279 -27.503 17.306 1.00 40.40 H new ATOM 0 HG2 PRO A 885 10.512 -27.530 14.451 1.00 21.12 H new ATOM 0 HG3 PRO A 885 12.026 -27.029 15.176 1.00 21.12 H new ATOM 0 HD2 PRO A 885 11.515 -29.493 13.801 1.00 61.21 H new ATOM 0 HD3 PRO A 885 12.993 -29.041 14.626 1.00 61.21 H new ATOM 1535 N VAL A 886 8.648 -30.473 17.729 1.00 43.32 N ATOM 1536 CA VAL A 886 7.321 -31.063 17.704 1.00 20.53 C ATOM 1537 C VAL A 886 6.316 -30.075 18.300 1.00 45.13 C ATOM 1538 O VAL A 886 6.310 -29.843 19.508 1.00 40.34 O ATOM 1539 CB VAL A 886 7.335 -32.411 18.429 1.00 74.23 C ATOM 1540 CG1 VAL A 886 5.947 -32.754 18.975 1.00 4.34 C ATOM 1541 CG2 VAL A 886 7.852 -33.521 17.512 1.00 62.23 C ATOM 0 H VAL A 886 9.049 -30.364 18.661 1.00 43.32 H new ATOM 0 HA VAL A 886 7.011 -31.263 16.678 1.00 20.53 H new ATOM 0 HB VAL A 886 8.018 -32.329 19.275 1.00 74.23 H new ATOM 0 HG11 VAL A 886 5.984 -33.716 19.485 1.00 4.34 H new ATOM 0 HG12 VAL A 886 5.632 -31.983 19.678 1.00 4.34 H new ATOM 0 HG13 VAL A 886 5.235 -32.808 18.151 1.00 4.34 H new ATOM 0 HG21 VAL A 886 7.852 -34.468 18.051 1.00 62.23 H new ATOM 0 HG22 VAL A 886 7.206 -33.601 16.638 1.00 62.23 H new ATOM 0 HG23 VAL A 886 8.867 -33.286 17.192 1.00 62.23 H new ATOM 1551 N ILE A 887 5.492 -29.519 17.424 1.00 33.23 N ATOM 1552 CA ILE A 887 4.485 -28.561 17.848 1.00 1.03 C ATOM 1553 C ILE A 887 3.111 -29.234 17.839 1.00 52.54 C ATOM 1554 O ILE A 887 2.973 -30.365 17.376 1.00 53.22 O ATOM 1555 CB ILE A 887 4.556 -27.295 16.992 1.00 2.11 C ATOM 1556 CG1 ILE A 887 5.990 -27.026 16.530 1.00 54.35 C ATOM 1557 CG2 ILE A 887 3.959 -26.097 17.734 1.00 73.44 C ATOM 1558 CD1 ILE A 887 6.926 -26.839 17.725 1.00 33.33 C ATOM 0 H ILE A 887 5.501 -29.714 16.423 1.00 33.23 H new ATOM 0 HA ILE A 887 4.674 -28.237 18.871 1.00 1.03 H new ATOM 0 HB ILE A 887 3.953 -27.453 16.098 1.00 2.11 H new ATOM 0 HG12 ILE A 887 6.340 -27.856 15.916 1.00 54.35 H new ATOM 0 HG13 ILE A 887 6.013 -26.135 15.903 1.00 54.35 H new ATOM 0 HG21 ILE A 887 4.022 -25.210 17.103 1.00 73.44 H new ATOM 0 HG22 ILE A 887 2.915 -26.300 17.972 1.00 73.44 H new ATOM 0 HG23 ILE A 887 4.514 -25.927 18.656 1.00 73.44 H new ATOM 0 HD11 ILE A 887 7.938 -26.649 17.368 1.00 33.33 H new ATOM 0 HD12 ILE A 887 6.588 -25.993 18.323 1.00 33.33 H new ATOM 0 HD13 ILE A 887 6.920 -27.741 18.337 1.00 33.33 H new ATOM 1570 N LYS A 888 2.129 -28.509 18.355 1.00 42.10 N ATOM 1571 CA LYS A 888 0.771 -29.021 18.412 1.00 73.34 C ATOM 1572 C LYS A 888 0.001 -28.550 17.176 1.00 15.15 C ATOM 1573 O LYS A 888 0.557 -27.870 16.316 1.00 60.14 O ATOM 1574 CB LYS A 888 0.107 -28.635 19.735 1.00 51.42 C ATOM 1575 CG LYS A 888 0.154 -27.120 19.950 1.00 75.52 C ATOM 1576 CD LYS A 888 -0.777 -26.699 21.089 1.00 74.54 C ATOM 1577 CE LYS A 888 -0.056 -26.758 22.437 1.00 42.25 C ATOM 1578 NZ LYS A 888 1.037 -25.761 22.483 1.00 13.51 N ATOM 0 H LYS A 888 2.247 -27.571 18.737 1.00 42.10 H new ATOM 0 HA LYS A 888 0.774 -30.111 18.390 1.00 73.34 H new ATOM 0 HB2 LYS A 888 -0.929 -28.975 19.739 1.00 51.42 H new ATOM 0 HB3 LYS A 888 0.611 -29.139 20.560 1.00 51.42 H new ATOM 0 HG2 LYS A 888 1.175 -26.813 20.177 1.00 75.52 H new ATOM 0 HG3 LYS A 888 -0.135 -26.610 19.031 1.00 75.52 H new ATOM 0 HD2 LYS A 888 -1.140 -25.687 20.911 1.00 74.54 H new ATOM 0 HD3 LYS A 888 -1.650 -27.352 21.110 1.00 74.54 H new ATOM 0 HE2 LYS A 888 -0.764 -26.568 23.244 1.00 42.25 H new ATOM 0 HE3 LYS A 888 0.348 -27.758 22.597 1.00 42.25 H new ATOM 0 HZ1 LYS A 888 1.946 -26.248 22.619 1.00 13.51 H new ATOM 0 HZ2 LYS A 888 1.059 -25.229 21.590 1.00 13.51 H new ATOM 0 HZ3 LYS A 888 0.875 -25.104 23.273 1.00 13.51 H new ATOM 1591 N ILE A 889 -1.268 -28.930 17.129 1.00 41.32 N ATOM 1592 CA ILE A 889 -2.120 -28.554 16.013 1.00 31.34 C ATOM 1593 C ILE A 889 -2.921 -27.305 16.387 1.00 63.03 C ATOM 1594 O ILE A 889 -3.314 -26.532 15.515 1.00 73.14 O ATOM 1595 CB ILE A 889 -2.991 -29.737 15.583 1.00 44.53 C ATOM 1596 CG1 ILE A 889 -3.243 -29.710 14.074 1.00 74.31 C ATOM 1597 CG2 ILE A 889 -4.295 -29.777 16.382 1.00 63.02 C ATOM 1598 CD1 ILE A 889 -3.920 -28.404 13.654 1.00 44.41 C ATOM 0 H ILE A 889 -1.726 -29.494 17.845 1.00 41.32 H new ATOM 0 HA ILE A 889 -1.517 -28.298 15.142 1.00 31.34 H new ATOM 0 HB ILE A 889 -2.451 -30.658 15.803 1.00 44.53 H new ATOM 0 HG12 ILE A 889 -2.298 -29.821 13.542 1.00 74.31 H new ATOM 0 HG13 ILE A 889 -3.870 -30.556 13.791 1.00 74.31 H new ATOM 0 HG21 ILE A 889 -4.895 -30.627 16.057 1.00 63.02 H new ATOM 0 HG22 ILE A 889 -4.068 -29.878 17.443 1.00 63.02 H new ATOM 0 HG23 ILE A 889 -4.852 -28.855 16.216 1.00 63.02 H new ATOM 0 HD11 ILE A 889 -4.088 -28.411 12.577 1.00 44.41 H new ATOM 0 HD12 ILE A 889 -4.876 -28.307 14.169 1.00 44.41 H new ATOM 0 HD13 ILE A 889 -3.280 -27.562 13.916 1.00 44.41 H new ATOM 1610 N GLU A 890 -3.138 -27.146 17.684 1.00 62.10 N ATOM 1611 CA GLU A 890 -3.884 -26.004 18.183 1.00 13.14 C ATOM 1612 C GLU A 890 -2.927 -24.889 18.608 1.00 2.42 C ATOM 1613 O GLU A 890 -3.202 -24.158 19.559 1.00 22.31 O ATOM 1614 CB GLU A 890 -4.800 -26.410 19.340 1.00 61.42 C ATOM 1615 CG GLU A 890 -3.984 -26.826 20.565 1.00 23.52 C ATOM 1616 CD GLU A 890 -4.870 -26.919 21.809 1.00 73.53 C ATOM 1617 OE1 GLU A 890 -5.177 -25.891 22.429 1.00 15.14 O ATOM 1618 OE2 GLU A 890 -5.244 -28.113 22.124 1.00 60.31 O ATOM 0 H GLU A 890 -2.810 -27.789 18.405 1.00 62.10 H new ATOM 0 HA GLU A 890 -4.515 -25.628 17.378 1.00 13.14 H new ATOM 0 HB2 GLU A 890 -5.454 -25.578 19.600 1.00 61.42 H new ATOM 0 HB3 GLU A 890 -5.441 -27.235 19.029 1.00 61.42 H new ATOM 0 HG2 GLU A 890 -3.509 -27.789 20.380 1.00 23.52 H new ATOM 0 HG3 GLU A 890 -3.185 -26.104 20.736 1.00 23.52 H new ATOM 1626 N SER A 891 -1.822 -24.792 17.883 1.00 74.23 N ATOM 1627 CA SER A 891 -0.823 -23.778 18.173 1.00 63.35 C ATOM 1628 C SER A 891 -0.966 -22.608 17.197 1.00 32.21 C ATOM 1629 O SER A 891 -1.219 -21.478 17.611 1.00 51.21 O ATOM 1630 CB SER A 891 0.590 -24.361 18.099 1.00 40.24 C ATOM 1631 OG SER A 891 1.075 -24.750 19.381 1.00 51.30 O ATOM 0 H SER A 891 -1.597 -25.399 17.095 1.00 74.23 H new ATOM 0 HA SER A 891 -0.986 -23.417 19.189 1.00 63.35 H new ATOM 0 HB2 SER A 891 0.592 -25.224 17.434 1.00 40.24 H new ATOM 0 HB3 SER A 891 1.264 -23.623 17.665 1.00 40.24 H new ATOM 0 HG SER A 891 2.046 -24.622 19.416 1.00 51.30 H new ATOM 1637 N PHE A 892 -0.798 -22.920 15.920 1.00 13.14 N ATOM 1638 CA PHE A 892 -0.906 -21.908 14.883 1.00 61.53 C ATOM 1639 C PHE A 892 -2.058 -22.224 13.926 1.00 23.43 C ATOM 1640 O PHE A 892 -2.628 -23.313 13.974 1.00 20.20 O ATOM 1641 CB PHE A 892 0.410 -21.927 14.102 1.00 75.33 C ATOM 1642 CG PHE A 892 1.043 -23.315 13.983 1.00 73.13 C ATOM 1643 CD1 PHE A 892 0.454 -24.267 13.210 1.00 44.24 C ATOM 1644 CD2 PHE A 892 2.194 -23.597 14.650 1.00 52.10 C ATOM 1645 CE1 PHE A 892 1.042 -25.555 13.099 1.00 41.20 C ATOM 1646 CE2 PHE A 892 2.781 -24.885 14.539 1.00 4.24 C ATOM 1647 CZ PHE A 892 2.193 -25.837 13.766 1.00 2.43 C ATOM 0 H PHE A 892 -0.588 -23.859 15.580 1.00 13.14 H new ATOM 0 HA PHE A 892 -1.099 -20.934 15.332 1.00 61.53 H new ATOM 0 HB2 PHE A 892 0.232 -21.533 13.101 1.00 75.33 H new ATOM 0 HB3 PHE A 892 1.119 -21.256 14.588 1.00 75.33 H new ATOM 0 HD1 PHE A 892 -0.461 -24.043 12.681 1.00 44.24 H new ATOM 0 HD2 PHE A 892 2.661 -22.841 15.264 1.00 52.10 H new ATOM 0 HE1 PHE A 892 0.575 -26.311 12.485 1.00 41.20 H new ATOM 0 HE2 PHE A 892 3.695 -25.109 15.069 1.00 4.24 H new ATOM 0 HZ PHE A 892 2.640 -26.817 13.682 1.00 2.43 H new ATOM 1657 N VAL A 893 -2.365 -21.252 13.080 1.00 35.52 N ATOM 1658 CA VAL A 893 -3.439 -21.413 12.114 1.00 21.31 C ATOM 1659 C VAL A 893 -2.852 -21.872 10.778 1.00 41.24 C ATOM 1660 O VAL A 893 -1.636 -21.865 10.595 1.00 44.12 O ATOM 1661 CB VAL A 893 -4.240 -20.115 12.001 1.00 12.21 C ATOM 1662 CG1 VAL A 893 -4.369 -19.430 13.363 1.00 11.11 C ATOM 1663 CG2 VAL A 893 -3.615 -19.173 10.970 1.00 1.45 C ATOM 0 H VAL A 893 -1.889 -20.350 13.043 1.00 35.52 H new ATOM 0 HA VAL A 893 -4.138 -22.182 12.444 1.00 21.31 H new ATOM 0 HB VAL A 893 -5.243 -20.369 11.658 1.00 12.21 H new ATOM 0 HG11 VAL A 893 -4.943 -18.510 13.254 1.00 11.11 H new ATOM 0 HG12 VAL A 893 -4.880 -20.096 14.058 1.00 11.11 H new ATOM 0 HG13 VAL A 893 -3.377 -19.196 13.748 1.00 11.11 H new ATOM 0 HG21 VAL A 893 -4.204 -18.258 10.909 1.00 1.45 H new ATOM 0 HG22 VAL A 893 -2.596 -18.929 11.270 1.00 1.45 H new ATOM 0 HG23 VAL A 893 -3.599 -19.660 9.995 1.00 1.45 H new ATOM 1673 N VAL A 894 -3.744 -22.259 9.878 1.00 61.22 N ATOM 1674 CA VAL A 894 -3.330 -22.720 8.564 1.00 65.15 C ATOM 1675 C VAL A 894 -4.033 -21.886 7.490 1.00 24.35 C ATOM 1676 O VAL A 894 -5.244 -21.998 7.307 1.00 63.10 O ATOM 1677 CB VAL A 894 -3.598 -24.220 8.426 1.00 21.13 C ATOM 1678 CG1 VAL A 894 -2.516 -24.896 7.581 1.00 0.44 C ATOM 1679 CG2 VAL A 894 -3.715 -24.884 9.800 1.00 53.12 C ATOM 0 H VAL A 894 -4.752 -22.263 10.033 1.00 61.22 H new ATOM 0 HA VAL A 894 -2.257 -22.582 8.432 1.00 65.15 H new ATOM 0 HB VAL A 894 -4.551 -24.344 7.911 1.00 21.13 H new ATOM 0 HG11 VAL A 894 -2.731 -25.961 7.499 1.00 0.44 H new ATOM 0 HG12 VAL A 894 -2.501 -24.451 6.586 1.00 0.44 H new ATOM 0 HG13 VAL A 894 -1.544 -24.757 8.055 1.00 0.44 H new ATOM 0 HG21 VAL A 894 -3.905 -25.950 9.674 1.00 53.12 H new ATOM 0 HG22 VAL A 894 -2.786 -24.744 10.352 1.00 53.12 H new ATOM 0 HG23 VAL A 894 -4.537 -24.431 10.354 1.00 53.12 H new ATOM 1689 N GLU A 895 -3.243 -21.069 6.810 1.00 63.14 N ATOM 1690 CA GLU A 895 -3.774 -20.217 5.760 1.00 53.24 C ATOM 1691 C GLU A 895 -3.236 -20.655 4.396 1.00 24.34 C ATOM 1692 O GLU A 895 -2.025 -20.665 4.177 1.00 13.01 O ATOM 1693 CB GLU A 895 -3.450 -18.746 6.030 1.00 22.42 C ATOM 1694 CG GLU A 895 -4.291 -17.827 5.143 1.00 51.14 C ATOM 1695 CD GLU A 895 -3.995 -16.356 5.441 1.00 13.32 C ATOM 1696 OE1 GLU A 895 -2.872 -15.888 5.201 1.00 53.01 O ATOM 1697 OE2 GLU A 895 -4.982 -15.691 5.940 1.00 74.41 O ATOM 0 H GLU A 895 -2.239 -20.979 6.966 1.00 63.14 H new ATOM 0 HA GLU A 895 -4.859 -20.320 5.751 1.00 53.24 H new ATOM 0 HB2 GLU A 895 -3.637 -18.516 7.079 1.00 22.42 H new ATOM 0 HB3 GLU A 895 -2.391 -18.564 5.847 1.00 22.42 H new ATOM 0 HG2 GLU A 895 -4.083 -18.038 4.094 1.00 51.14 H new ATOM 0 HG3 GLU A 895 -5.350 -18.029 5.305 1.00 51.14 H new ATOM 1705 N ASP A 896 -4.161 -21.008 3.516 1.00 44.43 N ATOM 1706 CA ASP A 896 -3.794 -21.446 2.180 1.00 43.02 C ATOM 1707 C ASP A 896 -3.277 -20.249 1.379 1.00 74.12 C ATOM 1708 O ASP A 896 -3.800 -19.143 1.502 1.00 15.34 O ATOM 1709 CB ASP A 896 -5.001 -22.025 1.439 1.00 23.24 C ATOM 1710 CG ASP A 896 -4.945 -23.534 1.194 1.00 74.44 C ATOM 1711 OD1 ASP A 896 -5.825 -24.287 1.638 1.00 11.55 O ATOM 1712 OD2 ASP A 896 -3.933 -23.938 0.504 1.00 45.40 O ATOM 0 H ASP A 896 -5.164 -21.000 3.702 1.00 44.43 H new ATOM 0 HA ASP A 896 -3.027 -22.215 2.276 1.00 43.02 H new ATOM 0 HB2 ASP A 896 -5.902 -21.798 2.009 1.00 23.24 H new ATOM 0 HB3 ASP A 896 -5.096 -21.519 0.478 1.00 23.24 H new ATOM 1718 N ILE A 897 -2.257 -20.511 0.575 1.00 32.22 N ATOM 1719 CA ILE A 897 -1.664 -19.469 -0.246 1.00 74.30 C ATOM 1720 C ILE A 897 -2.404 -19.398 -1.584 1.00 2.44 C ATOM 1721 O ILE A 897 -2.124 -18.526 -2.406 1.00 33.35 O ATOM 1722 CB ILE A 897 -0.157 -19.691 -0.388 1.00 32.24 C ATOM 1723 CG1 ILE A 897 0.407 -20.419 0.834 1.00 1.35 C ATOM 1724 CG2 ILE A 897 0.569 -18.371 -0.655 1.00 33.15 C ATOM 1725 CD1 ILE A 897 0.723 -21.879 0.506 1.00 63.14 C ATOM 0 H ILE A 897 -1.826 -21.430 0.475 1.00 32.22 H new ATOM 0 HA ILE A 897 -1.775 -18.496 0.233 1.00 74.30 H new ATOM 0 HB ILE A 897 0.014 -20.333 -1.252 1.00 32.24 H new ATOM 0 HG12 ILE A 897 1.311 -19.916 1.176 1.00 1.35 H new ATOM 0 HG13 ILE A 897 -0.312 -20.374 1.652 1.00 1.35 H new ATOM 0 HG21 ILE A 897 1.639 -18.557 -0.752 1.00 33.15 H new ATOM 0 HG22 ILE A 897 0.193 -17.929 -1.578 1.00 33.15 H new ATOM 0 HG23 ILE A 897 0.394 -17.685 0.174 1.00 33.15 H new ATOM 0 HD11 ILE A 897 1.122 -22.373 1.392 1.00 63.14 H new ATOM 0 HD12 ILE A 897 -0.188 -22.386 0.188 1.00 63.14 H new ATOM 0 HD13 ILE A 897 1.460 -21.920 -0.296 1.00 63.14 H new ATOM 1737 N ALA A 898 -3.333 -20.326 -1.760 1.00 42.52 N ATOM 1738 CA ALA A 898 -4.114 -20.379 -2.984 1.00 15.40 C ATOM 1739 C ALA A 898 -5.463 -19.694 -2.753 1.00 0.23 C ATOM 1740 O ALA A 898 -6.199 -19.428 -3.702 1.00 33.54 O ATOM 1741 CB ALA A 898 -4.268 -21.834 -3.429 1.00 35.32 C ATOM 0 H ALA A 898 -3.562 -21.047 -1.076 1.00 42.52 H new ATOM 0 HA ALA A 898 -3.606 -19.845 -3.787 1.00 15.40 H new ATOM 0 HB1 ALA A 898 -4.854 -21.874 -4.347 1.00 35.32 H new ATOM 0 HB2 ALA A 898 -3.283 -22.266 -3.608 1.00 35.32 H new ATOM 0 HB3 ALA A 898 -4.777 -22.401 -2.649 1.00 35.32 H new ATOM 1747 N THR A 899 -5.746 -19.427 -1.486 1.00 63.21 N ATOM 1748 CA THR A 899 -6.993 -18.778 -1.118 1.00 63.41 C ATOM 1749 C THR A 899 -6.739 -17.687 -0.077 1.00 2.23 C ATOM 1750 O THR A 899 -7.265 -16.581 -0.190 1.00 41.24 O ATOM 1751 CB THR A 899 -7.965 -19.859 -0.641 1.00 30.00 C ATOM 1752 OG1 THR A 899 -7.644 -20.031 0.737 1.00 54.32 O ATOM 1753 CG2 THR A 899 -7.674 -21.226 -1.264 1.00 44.44 C ATOM 0 H THR A 899 -5.133 -19.648 -0.702 1.00 63.21 H new ATOM 0 HA THR A 899 -7.442 -18.270 -1.972 1.00 63.41 H new ATOM 0 HB THR A 899 -8.985 -19.560 -0.882 1.00 30.00 H new ATOM 0 HG1 THR A 899 -8.137 -20.799 1.094 1.00 54.32 H new ATOM 0 HG21 THR A 899 -8.393 -21.956 -0.892 1.00 44.44 H new ATOM 0 HG22 THR A 899 -7.756 -21.156 -2.349 1.00 44.44 H new ATOM 0 HG23 THR A 899 -6.665 -21.541 -0.996 1.00 44.44 H new ATOM 1761 N GLY A 900 -5.932 -18.036 0.915 1.00 53.31 N ATOM 1762 CA GLY A 900 -5.602 -17.099 1.976 1.00 71.41 C ATOM 1763 C GLY A 900 -6.560 -17.252 3.159 1.00 2.24 C ATOM 1764 O GLY A 900 -6.653 -16.364 4.005 1.00 13.32 O ATOM 0 H GLY A 900 -5.497 -18.954 1.006 1.00 53.31 H new ATOM 0 HA2 GLY A 900 -4.578 -17.267 2.309 1.00 71.41 H new ATOM 0 HA3 GLY A 900 -5.650 -16.079 1.594 1.00 71.41 H new ATOM 1768 N VAL A 901 -7.247 -18.384 3.181 1.00 30.33 N ATOM 1769 CA VAL A 901 -8.194 -18.665 4.247 1.00 11.51 C ATOM 1770 C VAL A 901 -7.461 -19.330 5.413 1.00 4.24 C ATOM 1771 O VAL A 901 -6.988 -20.459 5.291 1.00 3.31 O ATOM 1772 CB VAL A 901 -9.352 -19.508 3.710 1.00 70.12 C ATOM 1773 CG1 VAL A 901 -10.515 -19.540 4.704 1.00 45.11 C ATOM 1774 CG2 VAL A 901 -9.813 -18.999 2.343 1.00 51.12 C ATOM 0 H VAL A 901 -7.167 -19.118 2.477 1.00 30.33 H new ATOM 0 HA VAL A 901 -8.630 -17.740 4.623 1.00 11.51 H new ATOM 0 HB VAL A 901 -8.992 -20.529 3.583 1.00 70.12 H new ATOM 0 HG11 VAL A 901 -11.325 -20.146 4.297 1.00 45.11 H new ATOM 0 HG12 VAL A 901 -10.177 -19.972 5.646 1.00 45.11 H new ATOM 0 HG13 VAL A 901 -10.873 -18.525 4.878 1.00 45.11 H new ATOM 0 HG21 VAL A 901 -10.637 -19.616 1.984 1.00 51.12 H new ATOM 0 HG22 VAL A 901 -10.146 -17.965 2.433 1.00 51.12 H new ATOM 0 HG23 VAL A 901 -8.985 -19.053 1.636 1.00 51.12 H new ATOM 1784 N GLN A 902 -7.389 -18.602 6.518 1.00 0.21 N ATOM 1785 CA GLN A 902 -6.721 -19.107 7.705 1.00 31.35 C ATOM 1786 C GLN A 902 -7.736 -19.753 8.651 1.00 0.42 C ATOM 1787 O GLN A 902 -8.881 -19.310 8.734 1.00 22.53 O ATOM 1788 CB GLN A 902 -5.943 -17.995 8.412 1.00 31.41 C ATOM 1789 CG GLN A 902 -6.892 -16.942 8.988 1.00 73.44 C ATOM 1790 CD GLN A 902 -6.354 -16.380 10.304 1.00 4.15 C ATOM 1791 OE1 GLN A 902 -7.081 -16.160 11.259 1.00 23.32 O ATOM 1792 NE2 GLN A 902 -5.042 -16.160 10.302 1.00 1.24 N ATOM 0 H GLN A 902 -7.783 -17.666 6.616 1.00 0.21 H new ATOM 0 HA GLN A 902 -6.004 -19.868 7.398 1.00 31.35 H new ATOM 0 HB2 GLN A 902 -5.339 -18.422 9.213 1.00 31.41 H new ATOM 0 HB3 GLN A 902 -5.255 -17.524 7.709 1.00 31.41 H new ATOM 0 HG2 GLN A 902 -7.022 -16.133 8.269 1.00 73.44 H new ATOM 0 HG3 GLN A 902 -7.875 -17.384 9.152 1.00 73.44 H new ATOM 0 HE21 GLN A 902 -4.492 -16.366 9.468 1.00 1.24 H new ATOM 0 HE22 GLN A 902 -4.586 -15.785 11.134 1.00 1.24 H new ATOM 1801 N THR A 903 -7.280 -20.788 9.340 1.00 24.13 N ATOM 1802 CA THR A 903 -8.133 -21.499 10.277 1.00 54.31 C ATOM 1803 C THR A 903 -7.291 -22.164 11.367 1.00 32.11 C ATOM 1804 O THR A 903 -6.103 -22.414 11.173 1.00 44.14 O ATOM 1805 CB THR A 903 -8.988 -22.487 9.481 1.00 32.22 C ATOM 1806 OG1 THR A 903 -9.900 -21.659 8.765 1.00 71.23 O ATOM 1807 CG2 THR A 903 -9.886 -23.340 10.380 1.00 72.25 C ATOM 0 H THR A 903 -6.330 -21.152 9.268 1.00 24.13 H new ATOM 0 HA THR A 903 -8.802 -20.816 10.800 1.00 54.31 H new ATOM 0 HB THR A 903 -8.340 -23.137 8.894 1.00 32.22 H new ATOM 0 HG1 THR A 903 -9.778 -20.726 9.038 1.00 71.23 H new ATOM 0 HG21 THR A 903 -10.472 -24.024 9.766 1.00 72.25 H new ATOM 0 HG22 THR A 903 -9.269 -23.912 11.073 1.00 72.25 H new ATOM 0 HG23 THR A 903 -10.558 -22.692 10.943 1.00 72.25 H new ATOM 1815 N LEU A 904 -7.940 -22.432 12.491 1.00 73.24 N ATOM 1816 CA LEU A 904 -7.266 -23.064 13.612 1.00 0.11 C ATOM 1817 C LEU A 904 -8.126 -24.216 14.136 1.00 40.15 C ATOM 1818 O LEU A 904 -9.223 -23.994 14.646 1.00 60.21 O ATOM 1819 CB LEU A 904 -6.913 -22.026 14.679 1.00 14.50 C ATOM 1820 CG LEU A 904 -7.768 -20.756 14.688 1.00 20.42 C ATOM 1821 CD1 LEU A 904 -9.133 -21.019 15.327 1.00 21.12 C ATOM 1822 CD2 LEU A 904 -7.029 -19.603 15.369 1.00 41.40 C ATOM 0 H LEU A 904 -8.926 -22.223 12.649 1.00 73.24 H new ATOM 0 HA LEU A 904 -6.317 -23.494 13.292 1.00 0.11 H new ATOM 0 HB2 LEU A 904 -6.990 -22.499 15.658 1.00 14.50 H new ATOM 0 HB3 LEU A 904 -5.870 -21.737 14.546 1.00 14.50 H new ATOM 0 HG LEU A 904 -7.948 -20.458 13.655 1.00 20.42 H new ATOM 0 HD11 LEU A 904 -9.721 -20.101 15.321 1.00 21.12 H new ATOM 0 HD12 LEU A 904 -9.657 -21.789 14.761 1.00 21.12 H new ATOM 0 HD13 LEU A 904 -8.995 -21.355 16.355 1.00 21.12 H new ATOM 0 HD21 LEU A 904 -7.658 -18.713 15.362 1.00 41.40 H new ATOM 0 HD22 LEU A 904 -6.798 -19.876 16.399 1.00 41.40 H new ATOM 0 HD23 LEU A 904 -6.103 -19.397 14.832 1.00 41.40 H new ATOM 1834 N TYR A 905 -7.595 -25.421 13.991 1.00 75.32 N ATOM 1835 CA TYR A 905 -8.301 -26.609 14.443 1.00 42.43 C ATOM 1836 C TYR A 905 -8.308 -26.694 15.970 1.00 10.03 C ATOM 1837 O TYR A 905 -7.939 -25.738 16.651 1.00 72.02 O ATOM 1838 CB TYR A 905 -7.523 -27.800 13.881 1.00 72.42 C ATOM 1839 CG TYR A 905 -7.470 -27.844 12.352 1.00 31.15 C ATOM 1840 CD1 TYR A 905 -8.148 -26.898 11.611 1.00 1.40 C ATOM 1841 CD2 TYR A 905 -6.744 -28.830 11.715 1.00 15.20 C ATOM 1842 CE1 TYR A 905 -8.098 -26.939 10.173 1.00 40.35 C ATOM 1843 CE2 TYR A 905 -6.694 -28.871 10.276 1.00 15.15 C ATOM 1844 CZ TYR A 905 -7.374 -27.923 9.576 1.00 23.32 C ATOM 1845 OH TYR A 905 -7.327 -27.962 8.218 1.00 65.14 O ATOM 0 H TYR A 905 -6.685 -25.601 13.567 1.00 75.32 H new ATOM 0 HA TYR A 905 -9.338 -26.591 14.108 1.00 42.43 H new ATOM 0 HB2 TYR A 905 -6.505 -27.771 14.269 1.00 72.42 H new ATOM 0 HB3 TYR A 905 -7.977 -28.722 14.245 1.00 72.42 H new ATOM 0 HD1 TYR A 905 -8.716 -26.127 12.110 1.00 1.40 H new ATOM 0 HD2 TYR A 905 -6.214 -29.571 12.295 1.00 15.20 H new ATOM 0 HE1 TYR A 905 -8.624 -26.204 9.581 1.00 40.35 H new ATOM 0 HE2 TYR A 905 -6.130 -29.637 9.764 1.00 15.15 H new ATOM 0 HH TYR A 905 -6.395 -28.034 7.925 1.00 65.14 H new ATOM 1855 N SER A 906 -8.732 -27.848 16.465 1.00 41.24 N ATOM 1856 CA SER A 906 -8.792 -28.070 17.899 1.00 31.52 C ATOM 1857 C SER A 906 -7.924 -29.272 18.279 1.00 12.11 C ATOM 1858 O SER A 906 -7.094 -29.182 19.182 1.00 11.24 O ATOM 1859 CB SER A 906 -10.234 -28.289 18.363 1.00 64.44 C ATOM 1860 OG SER A 906 -10.875 -29.335 17.637 1.00 42.22 O ATOM 0 H SER A 906 -9.037 -28.639 15.898 1.00 41.24 H new ATOM 0 HA SER A 906 -8.409 -27.180 18.399 1.00 31.52 H new ATOM 0 HB2 SER A 906 -10.240 -28.529 19.426 1.00 64.44 H new ATOM 0 HB3 SER A 906 -10.798 -27.364 18.241 1.00 64.44 H new ATOM 0 HG SER A 906 -11.792 -29.445 17.963 1.00 42.22 H new ATOM 1866 N LYS A 907 -8.146 -30.369 17.570 1.00 22.14 N ATOM 1867 CA LYS A 907 -7.394 -31.587 17.822 1.00 74.12 C ATOM 1868 C LYS A 907 -6.734 -32.051 16.522 1.00 23.12 C ATOM 1869 O LYS A 907 -7.231 -31.768 15.433 1.00 20.14 O ATOM 1870 CB LYS A 907 -8.290 -32.646 18.468 1.00 13.42 C ATOM 1871 CG LYS A 907 -7.477 -33.576 19.370 1.00 63.20 C ATOM 1872 CD LYS A 907 -7.457 -33.064 20.811 1.00 1.44 C ATOM 1873 CE LYS A 907 -6.448 -31.925 20.975 1.00 52.25 C ATOM 1874 NZ LYS A 907 -5.920 -31.895 22.357 1.00 44.34 N ATOM 0 H LYS A 907 -8.835 -30.440 16.822 1.00 22.14 H new ATOM 0 HA LYS A 907 -6.594 -31.400 18.538 1.00 74.12 H new ATOM 0 HB2 LYS A 907 -9.072 -32.159 19.052 1.00 13.42 H new ATOM 0 HB3 LYS A 907 -8.787 -33.229 17.693 1.00 13.42 H new ATOM 0 HG2 LYS A 907 -7.903 -34.579 19.343 1.00 63.20 H new ATOM 0 HG3 LYS A 907 -6.457 -33.653 18.994 1.00 63.20 H new ATOM 0 HD2 LYS A 907 -8.451 -32.717 21.091 1.00 1.44 H new ATOM 0 HD3 LYS A 907 -7.202 -33.880 21.487 1.00 1.44 H new ATOM 0 HE2 LYS A 907 -5.628 -32.054 20.269 1.00 52.25 H new ATOM 0 HE3 LYS A 907 -6.924 -30.973 20.741 1.00 52.25 H new ATOM 0 HZ1 LYS A 907 -5.850 -30.909 22.681 1.00 44.34 H new ATOM 0 HZ2 LYS A 907 -6.561 -32.421 22.985 1.00 44.34 H new ATOM 0 HZ3 LYS A 907 -4.977 -32.334 22.378 1.00 44.34 H new ATOM 1887 N TRP A 908 -5.623 -32.756 16.679 1.00 1.14 N ATOM 1888 CA TRP A 908 -4.889 -33.262 15.532 1.00 41.10 C ATOM 1889 C TRP A 908 -5.855 -34.086 14.678 1.00 11.24 C ATOM 1890 O TRP A 908 -5.859 -33.972 13.454 1.00 63.13 O ATOM 1891 CB TRP A 908 -3.658 -34.055 15.975 1.00 44.41 C ATOM 1892 CG TRP A 908 -2.866 -33.394 17.106 1.00 70.34 C ATOM 1893 CD1 TRP A 908 -1.799 -32.590 17.005 1.00 25.53 C ATOM 1894 CD2 TRP A 908 -3.124 -33.515 18.520 1.00 15.24 C ATOM 1895 NE1 TRP A 908 -1.352 -32.186 18.247 1.00 42.33 N ATOM 1896 CE2 TRP A 908 -2.184 -32.766 19.197 1.00 1.43 C ATOM 1897 CE3 TRP A 908 -4.120 -34.233 19.205 1.00 14.14 C ATOM 1898 CZ2 TRP A 908 -2.146 -32.662 20.593 1.00 62.30 C ATOM 1899 CZ3 TRP A 908 -4.069 -34.119 20.600 1.00 64.41 C ATOM 1900 CH2 TRP A 908 -3.128 -33.369 21.296 1.00 32.44 C ATOM 0 H TRP A 908 -5.213 -32.989 17.584 1.00 1.14 H new ATOM 0 HA TRP A 908 -4.504 -32.440 14.928 1.00 41.10 H new ATOM 0 HB2 TRP A 908 -3.974 -35.047 16.298 1.00 44.41 H new ATOM 0 HB3 TRP A 908 -3.000 -34.194 15.117 1.00 44.41 H new ATOM 0 HD1 TRP A 908 -1.346 -32.295 16.070 1.00 25.53 H new ATOM 0 HE1 TRP A 908 -0.557 -31.574 18.433 1.00 42.33 H new ATOM 0 HE3 TRP A 908 -4.866 -34.826 18.696 1.00 14.14 H new ATOM 0 HZ2 TRP A 908 -1.399 -32.068 21.100 1.00 62.30 H new ATOM 0 HZ3 TRP A 908 -4.813 -34.651 21.175 1.00 64.41 H new ATOM 0 HH2 TRP A 908 -3.155 -33.332 22.375 1.00 32.44 H new ATOM 1911 N LYS A 909 -6.651 -34.897 15.359 1.00 13.01 N ATOM 1912 CA LYS A 909 -7.620 -35.740 14.679 1.00 41.34 C ATOM 1913 C LYS A 909 -8.329 -34.923 13.596 1.00 5.12 C ATOM 1914 O LYS A 909 -8.796 -35.476 12.602 1.00 21.41 O ATOM 1915 CB LYS A 909 -8.574 -36.382 15.688 1.00 42.02 C ATOM 1916 CG LYS A 909 -9.196 -35.326 16.603 1.00 13.40 C ATOM 1917 CD LYS A 909 -10.622 -35.715 17.000 1.00 63.13 C ATOM 1918 CE LYS A 909 -10.647 -37.086 17.679 1.00 44.21 C ATOM 1919 NZ LYS A 909 -9.504 -37.224 18.609 1.00 64.31 N ATOM 0 H LYS A 909 -6.645 -34.988 16.375 1.00 13.01 H new ATOM 0 HA LYS A 909 -7.119 -36.568 14.178 1.00 41.34 H new ATOM 0 HB2 LYS A 909 -9.361 -36.919 15.159 1.00 42.02 H new ATOM 0 HB3 LYS A 909 -8.035 -37.116 16.287 1.00 42.02 H new ATOM 0 HG2 LYS A 909 -8.585 -35.210 17.498 1.00 13.40 H new ATOM 0 HG3 LYS A 909 -9.206 -34.361 16.096 1.00 13.40 H new ATOM 0 HD2 LYS A 909 -11.033 -34.964 17.674 1.00 63.13 H new ATOM 0 HD3 LYS A 909 -11.258 -35.732 16.115 1.00 63.13 H new ATOM 0 HE2 LYS A 909 -11.583 -37.212 18.223 1.00 44.21 H new ATOM 0 HE3 LYS A 909 -10.607 -37.873 16.925 1.00 44.21 H new ATOM 0 HZ1 LYS A 909 -9.757 -37.881 19.375 1.00 64.31 H new ATOM 0 HZ2 LYS A 909 -8.680 -37.594 18.094 1.00 64.31 H new ATOM 0 HZ3 LYS A 909 -9.271 -36.294 19.013 1.00 64.31 H new ATOM 1932 N ASP A 910 -8.386 -33.619 13.826 1.00 70.40 N ATOM 1933 CA ASP A 910 -9.030 -32.721 12.883 1.00 42.12 C ATOM 1934 C ASP A 910 -7.991 -32.206 11.885 1.00 64.12 C ATOM 1935 O ASP A 910 -8.016 -31.037 11.505 1.00 41.54 O ATOM 1936 CB ASP A 910 -9.636 -31.513 13.599 1.00 13.22 C ATOM 1937 CG ASP A 910 -10.602 -30.678 12.755 1.00 33.55 C ATOM 1938 OD1 ASP A 910 -10.635 -29.443 12.856 1.00 20.04 O ATOM 1939 OD2 ASP A 910 -11.354 -31.357 11.956 1.00 30.14 O ATOM 0 H ASP A 910 -7.997 -33.163 14.651 1.00 70.40 H new ATOM 0 HA ASP A 910 -9.821 -33.275 12.377 1.00 42.12 H new ATOM 0 HB2 ASP A 910 -10.162 -31.863 14.487 1.00 13.22 H new ATOM 0 HB3 ASP A 910 -8.826 -30.869 13.941 1.00 13.22 H new ATOM 1945 N PHE A 911 -7.101 -33.105 11.489 1.00 11.31 N ATOM 1946 CA PHE A 911 -6.055 -32.756 10.543 1.00 72.04 C ATOM 1947 C PHE A 911 -6.573 -32.823 9.104 1.00 3.33 C ATOM 1948 O PHE A 911 -7.552 -33.512 8.825 1.00 54.14 O ATOM 1949 CB PHE A 911 -4.934 -33.782 10.717 1.00 71.52 C ATOM 1950 CG PHE A 911 -5.366 -35.226 10.453 1.00 31.54 C ATOM 1951 CD1 PHE A 911 -5.697 -35.618 9.194 1.00 74.11 C ATOM 1952 CD2 PHE A 911 -5.419 -36.118 11.479 1.00 64.31 C ATOM 1953 CE1 PHE A 911 -6.098 -36.958 8.949 1.00 32.34 C ATOM 1954 CE2 PHE A 911 -5.819 -37.458 11.234 1.00 34.44 C ATOM 1955 CZ PHE A 911 -6.151 -37.850 9.975 1.00 63.11 C ATOM 0 H PHE A 911 -7.083 -34.074 11.806 1.00 11.31 H new ATOM 0 HA PHE A 911 -5.709 -31.739 10.729 1.00 72.04 H new ATOM 0 HB2 PHE A 911 -4.116 -33.529 10.042 1.00 71.52 H new ATOM 0 HB3 PHE A 911 -4.544 -33.710 11.732 1.00 71.52 H new ATOM 0 HD1 PHE A 911 -5.655 -34.910 8.380 1.00 74.11 H new ATOM 0 HD2 PHE A 911 -5.157 -35.807 12.479 1.00 64.31 H new ATOM 0 HE1 PHE A 911 -6.361 -37.269 7.949 1.00 32.34 H new ATOM 0 HE2 PHE A 911 -5.860 -38.166 12.048 1.00 34.44 H new ATOM 0 HZ PHE A 911 -6.457 -38.869 9.790 1.00 63.11 H new ATOM 1965 N HIS A 912 -5.891 -32.097 8.230 1.00 72.21 N ATOM 1966 CA HIS A 912 -6.270 -32.065 6.827 1.00 22.33 C ATOM 1967 C HIS A 912 -5.096 -32.538 5.968 1.00 63.40 C ATOM 1968 O HIS A 912 -5.134 -32.429 4.743 1.00 32.14 O ATOM 1969 CB HIS A 912 -6.772 -30.675 6.432 1.00 70.43 C ATOM 1970 CG HIS A 912 -5.800 -29.889 5.584 1.00 31.52 C ATOM 1971 ND1 HIS A 912 -6.064 -29.538 4.272 1.00 41.11 N ATOM 1972 CD2 HIS A 912 -4.565 -29.391 5.876 1.00 45.43 C ATOM 1973 CE1 HIS A 912 -5.027 -28.859 3.804 1.00 24.22 C ATOM 1974 NE2 HIS A 912 -4.098 -28.769 4.799 1.00 32.45 N ATOM 0 H HIS A 912 -5.079 -31.527 8.466 1.00 72.21 H new ATOM 0 HA HIS A 912 -7.100 -32.750 6.655 1.00 22.33 H new ATOM 0 HB2 HIS A 912 -7.711 -30.780 5.888 1.00 70.43 H new ATOM 0 HB3 HIS A 912 -6.990 -30.108 7.337 1.00 70.43 H new ATOM 0 HD2 HIS A 912 -4.053 -29.486 6.822 1.00 45.43 H new ATOM 0 HE1 HIS A 912 -4.934 -28.449 2.809 1.00 24.22 H new ATOM 0 HE2 HIS A 912 -3.194 -28.301 4.728 1.00 32.45 H new ATOM 1982 N PHE A 913 -4.079 -33.054 6.644 1.00 74.12 N ATOM 1983 CA PHE A 913 -2.896 -33.544 5.958 1.00 71.34 C ATOM 1984 C PHE A 913 -2.788 -35.066 6.070 1.00 31.32 C ATOM 1985 O PHE A 913 -3.685 -35.718 6.603 1.00 23.13 O ATOM 1986 CB PHE A 913 -1.686 -32.907 6.643 1.00 43.14 C ATOM 1987 CG PHE A 913 -1.675 -31.378 6.590 1.00 4.21 C ATOM 1988 CD1 PHE A 913 -1.570 -30.739 5.394 1.00 70.22 C ATOM 1989 CD2 PHE A 913 -1.769 -30.657 7.740 1.00 74.24 C ATOM 1990 CE1 PHE A 913 -1.560 -29.320 5.345 1.00 23.21 C ATOM 1991 CE2 PHE A 913 -1.759 -29.238 7.691 1.00 70.12 C ATOM 1992 CZ PHE A 913 -1.654 -28.599 6.495 1.00 74.54 C ATOM 0 H PHE A 913 -4.051 -33.143 7.660 1.00 74.12 H new ATOM 0 HA PHE A 913 -2.946 -33.287 4.900 1.00 71.34 H new ATOM 0 HB2 PHE A 913 -1.663 -33.224 7.685 1.00 43.14 H new ATOM 0 HB3 PHE A 913 -0.776 -33.283 6.175 1.00 43.14 H new ATOM 0 HD1 PHE A 913 -1.494 -31.311 4.481 1.00 70.22 H new ATOM 0 HD2 PHE A 913 -1.851 -31.164 8.690 1.00 74.24 H new ATOM 0 HE1 PHE A 913 -1.478 -28.813 4.395 1.00 23.21 H new ATOM 0 HE2 PHE A 913 -1.835 -28.666 8.604 1.00 70.12 H new ATOM 0 HZ PHE A 913 -1.645 -27.520 6.458 1.00 74.54 H new ATOM 2002 N GLU A 914 -1.683 -35.588 5.559 1.00 23.54 N ATOM 2003 CA GLU A 914 -1.446 -37.022 5.596 1.00 42.42 C ATOM 2004 C GLU A 914 -0.054 -37.315 6.160 1.00 35.55 C ATOM 2005 O GLU A 914 0.833 -36.465 6.108 1.00 70.44 O ATOM 2006 CB GLU A 914 -1.616 -37.641 4.207 1.00 30.03 C ATOM 2007 CG GLU A 914 -0.373 -37.407 3.346 1.00 21.35 C ATOM 2008 CD GLU A 914 -0.730 -37.400 1.859 1.00 63.44 C ATOM 2009 OE1 GLU A 914 0.093 -36.992 1.026 1.00 64.53 O ATOM 2010 OE2 GLU A 914 -1.910 -37.840 1.579 1.00 63.11 O ATOM 0 H GLU A 914 -0.942 -35.044 5.117 1.00 23.54 H new ATOM 0 HA GLU A 914 -2.187 -37.477 6.254 1.00 42.42 H new ATOM 0 HB2 GLU A 914 -1.801 -38.711 4.302 1.00 30.03 H new ATOM 0 HB3 GLU A 914 -2.489 -37.209 3.717 1.00 30.03 H new ATOM 0 HG2 GLU A 914 0.088 -36.457 3.617 1.00 21.35 H new ATOM 0 HG3 GLU A 914 0.363 -38.187 3.543 1.00 21.35 H new ATOM 2018 N LYS A 915 0.092 -38.522 6.688 1.00 44.10 N ATOM 2019 CA LYS A 915 1.361 -38.938 7.262 1.00 73.42 C ATOM 2020 C LYS A 915 2.416 -39.013 6.156 1.00 12.24 C ATOM 2021 O LYS A 915 2.259 -39.761 5.193 1.00 72.02 O ATOM 2022 CB LYS A 915 1.193 -40.245 8.041 1.00 42.51 C ATOM 2023 CG LYS A 915 1.597 -41.448 7.187 1.00 73.13 C ATOM 2024 CD LYS A 915 0.635 -41.633 6.011 1.00 31.33 C ATOM 2025 CE LYS A 915 1.303 -42.406 4.873 1.00 63.44 C ATOM 2026 NZ LYS A 915 0.283 -43.043 4.010 1.00 62.12 N ATOM 0 H LYS A 915 -0.647 -39.224 6.730 1.00 44.10 H new ATOM 0 HA LYS A 915 1.711 -38.203 7.987 1.00 73.42 H new ATOM 0 HB2 LYS A 915 1.802 -40.215 8.944 1.00 42.51 H new ATOM 0 HB3 LYS A 915 0.156 -40.352 8.359 1.00 42.51 H new ATOM 0 HG2 LYS A 915 2.611 -41.309 6.813 1.00 73.13 H new ATOM 0 HG3 LYS A 915 1.604 -42.349 7.801 1.00 73.13 H new ATOM 0 HD2 LYS A 915 -0.255 -42.167 6.345 1.00 31.33 H new ATOM 0 HD3 LYS A 915 0.305 -40.659 5.649 1.00 31.33 H new ATOM 0 HE2 LYS A 915 1.919 -41.731 4.280 1.00 63.44 H new ATOM 0 HE3 LYS A 915 1.967 -43.167 5.283 1.00 63.44 H new ATOM 0 HZ1 LYS A 915 0.754 -43.564 3.243 1.00 62.12 H new ATOM 0 HZ2 LYS A 915 -0.288 -43.702 4.576 1.00 62.12 H new ATOM 0 HZ3 LYS A 915 -0.334 -42.311 3.604 1.00 62.12 H new ATOM 2039 N ILE A 916 3.468 -38.227 6.332 1.00 14.44 N ATOM 2040 CA ILE A 916 4.548 -38.194 5.362 1.00 44.12 C ATOM 2041 C ILE A 916 5.863 -38.557 6.056 1.00 73.01 C ATOM 2042 O ILE A 916 6.103 -38.148 7.191 1.00 42.14 O ATOM 2043 CB ILE A 916 4.584 -36.843 4.645 1.00 3.41 C ATOM 2044 CG1 ILE A 916 3.307 -36.618 3.834 1.00 74.21 C ATOM 2045 CG2 ILE A 916 5.841 -36.713 3.782 1.00 2.35 C ATOM 2046 CD1 ILE A 916 2.887 -35.147 3.868 1.00 72.21 C ATOM 0 H ILE A 916 3.595 -37.608 7.133 1.00 14.44 H new ATOM 0 HA ILE A 916 4.382 -38.938 4.583 1.00 44.12 H new ATOM 0 HB ILE A 916 4.629 -36.058 5.400 1.00 3.41 H new ATOM 0 HG12 ILE A 916 3.468 -36.930 2.802 1.00 74.21 H new ATOM 0 HG13 ILE A 916 2.504 -37.238 4.233 1.00 74.21 H new ATOM 0 HG21 ILE A 916 5.841 -35.744 3.284 1.00 2.35 H new ATOM 0 HG22 ILE A 916 6.726 -36.797 4.413 1.00 2.35 H new ATOM 0 HG23 ILE A 916 5.852 -37.506 3.034 1.00 2.35 H new ATOM 0 HD11 ILE A 916 1.976 -35.015 3.284 1.00 72.21 H new ATOM 0 HD12 ILE A 916 2.703 -34.845 4.899 1.00 72.21 H new ATOM 0 HD13 ILE A 916 3.682 -34.532 3.446 1.00 72.21 H new ATOM 2058 N PRO A 917 6.700 -39.342 5.326 1.00 4.53 N ATOM 2059 CA PRO A 917 7.984 -39.764 5.860 1.00 61.33 C ATOM 2060 C PRO A 917 8.991 -38.613 5.842 1.00 3.33 C ATOM 2061 O PRO A 917 9.433 -38.185 4.777 1.00 74.33 O ATOM 2062 CB PRO A 917 8.406 -40.936 4.988 1.00 51.31 C ATOM 2063 CG PRO A 917 7.576 -40.831 3.719 1.00 51.23 C ATOM 2064 CD PRO A 917 6.449 -39.845 3.979 1.00 13.01 C ATOM 0 HA PRO A 917 7.926 -40.063 6.907 1.00 61.33 H new ATOM 0 HB2 PRO A 917 9.472 -40.891 4.763 1.00 51.31 H new ATOM 0 HB3 PRO A 917 8.227 -41.884 5.495 1.00 51.31 H new ATOM 0 HG2 PRO A 917 8.193 -40.494 2.886 1.00 51.23 H new ATOM 0 HG3 PRO A 917 7.174 -41.806 3.444 1.00 51.23 H new ATOM 0 HD2 PRO A 917 6.453 -39.037 3.247 1.00 13.01 H new ATOM 0 HD3 PRO A 917 5.475 -40.330 3.913 1.00 13.01 H new ATOM 2072 N PHE A 918 9.326 -38.143 7.035 1.00 33.32 N ATOM 2073 CA PHE A 918 10.273 -37.050 7.171 1.00 51.34 C ATOM 2074 C PHE A 918 11.474 -37.247 6.244 1.00 43.11 C ATOM 2075 O PHE A 918 12.232 -38.203 6.399 1.00 21.32 O ATOM 2076 CB PHE A 918 10.757 -37.054 8.622 1.00 61.42 C ATOM 2077 CG PHE A 918 11.008 -35.660 9.199 1.00 51.54 C ATOM 2078 CD1 PHE A 918 9.973 -34.937 9.705 1.00 0.10 C ATOM 2079 CD2 PHE A 918 12.266 -35.142 9.205 1.00 73.41 C ATOM 2080 CE1 PHE A 918 10.206 -33.642 10.240 1.00 32.52 C ATOM 2081 CE2 PHE A 918 12.499 -33.848 9.740 1.00 15.11 C ATOM 2082 CZ PHE A 918 11.464 -33.125 10.246 1.00 34.25 C ATOM 0 H PHE A 918 8.958 -38.500 7.917 1.00 33.32 H new ATOM 0 HA PHE A 918 9.794 -36.108 6.905 1.00 51.34 H new ATOM 0 HB2 PHE A 918 10.017 -37.564 9.239 1.00 61.42 H new ATOM 0 HB3 PHE A 918 11.678 -37.633 8.685 1.00 61.42 H new ATOM 0 HD1 PHE A 918 8.974 -35.348 9.700 1.00 0.10 H new ATOM 0 HD2 PHE A 918 13.088 -35.716 8.803 1.00 73.41 H new ATOM 0 HE1 PHE A 918 9.384 -33.068 10.642 1.00 32.52 H new ATOM 0 HE2 PHE A 918 13.498 -33.438 9.745 1.00 15.11 H new ATOM 0 HZ PHE A 918 11.641 -32.140 10.653 1.00 34.25 H new ATOM 2092 N ASP A 919 11.611 -36.327 5.300 1.00 13.24 N ATOM 2093 CA ASP A 919 12.707 -36.388 4.349 1.00 40.43 C ATOM 2094 C ASP A 919 13.871 -35.539 4.864 1.00 65.21 C ATOM 2095 O ASP A 919 13.687 -34.377 5.221 1.00 11.12 O ATOM 2096 CB ASP A 919 12.285 -35.834 2.986 1.00 1.34 C ATOM 2097 CG ASP A 919 11.678 -36.862 2.030 1.00 64.30 C ATOM 2098 OD1 ASP A 919 12.392 -37.501 1.242 1.00 1.40 O ATOM 2099 OD2 ASP A 919 10.399 -36.999 2.117 1.00 54.03 O ATOM 0 H ASP A 919 10.981 -35.535 5.174 1.00 13.24 H new ATOM 0 HA ASP A 919 13.000 -37.432 4.239 1.00 40.43 H new ATOM 0 HB2 ASP A 919 11.561 -35.035 3.144 1.00 1.34 H new ATOM 0 HB3 ASP A 919 13.156 -35.385 2.508 1.00 1.34 H new ATOM 2105 N PRO A 920 15.076 -36.170 4.886 1.00 2.13 N ATOM 2106 CA PRO A 920 16.271 -35.486 5.352 1.00 55.23 C ATOM 2107 C PRO A 920 16.773 -34.488 4.307 1.00 44.15 C ATOM 2108 O PRO A 920 17.655 -33.679 4.590 1.00 43.54 O ATOM 2109 CB PRO A 920 17.269 -36.593 5.644 1.00 25.35 C ATOM 2110 CG PRO A 920 16.766 -37.817 4.897 1.00 72.22 C ATOM 2111 CD PRO A 920 15.332 -37.546 4.471 1.00 43.24 C ATOM 0 HA PRO A 920 16.092 -34.885 6.244 1.00 55.23 H new ATOM 0 HB2 PRO A 920 18.269 -36.315 5.310 1.00 25.35 H new ATOM 0 HB3 PRO A 920 17.333 -36.788 6.714 1.00 25.35 H new ATOM 0 HG2 PRO A 920 17.391 -38.017 4.027 1.00 72.22 H new ATOM 0 HG3 PRO A 920 16.815 -38.700 5.534 1.00 72.22 H new ATOM 0 HD2 PRO A 920 15.210 -37.664 3.394 1.00 43.24 H new ATOM 0 HD3 PRO A 920 14.639 -38.239 4.948 1.00 43.24 H new ATOM 2119 N ALA A 921 16.191 -34.578 3.120 1.00 35.42 N ATOM 2120 CA ALA A 921 16.568 -33.693 2.031 1.00 23.43 C ATOM 2121 C ALA A 921 16.046 -32.285 2.320 1.00 4.45 C ATOM 2122 O ALA A 921 16.643 -31.298 1.893 1.00 41.35 O ATOM 2123 CB ALA A 921 16.036 -34.253 0.711 1.00 51.25 C ATOM 0 H ALA A 921 15.460 -35.251 2.888 1.00 35.42 H new ATOM 0 HA ALA A 921 17.653 -33.631 1.945 1.00 23.43 H new ATOM 0 HB1 ALA A 921 16.319 -33.589 -0.106 1.00 51.25 H new ATOM 0 HB2 ALA A 921 16.460 -35.242 0.538 1.00 51.25 H new ATOM 0 HB3 ALA A 921 14.950 -34.327 0.759 1.00 51.25 H new ATOM 2129 N GLU A 922 14.938 -32.236 3.045 1.00 41.32 N ATOM 2130 CA GLU A 922 14.329 -30.964 3.396 1.00 22.12 C ATOM 2131 C GLU A 922 15.073 -30.326 4.571 1.00 31.02 C ATOM 2132 O GLU A 922 15.008 -29.113 4.767 1.00 74.41 O ATOM 2133 CB GLU A 922 12.843 -31.138 3.717 1.00 4.30 C ATOM 2134 CG GLU A 922 12.214 -32.217 2.834 1.00 41.14 C ATOM 2135 CD GLU A 922 10.758 -31.878 2.507 1.00 44.23 C ATOM 2136 OE1 GLU A 922 10.314 -32.087 1.368 1.00 13.02 O ATOM 2137 OE2 GLU A 922 10.081 -31.381 3.486 1.00 43.43 O ATOM 0 H GLU A 922 14.446 -33.057 3.399 1.00 41.32 H new ATOM 0 HA GLU A 922 14.406 -30.297 2.537 1.00 22.12 H new ATOM 0 HB2 GLU A 922 12.723 -31.407 4.767 1.00 4.30 H new ATOM 0 HB3 GLU A 922 12.322 -30.192 3.568 1.00 4.30 H new ATOM 0 HG2 GLU A 922 12.785 -32.314 1.910 1.00 41.14 H new ATOM 0 HG3 GLU A 922 12.262 -33.181 3.341 1.00 41.14 H new ATOM 2145 N MET A 923 15.763 -31.171 5.323 1.00 72.43 N ATOM 2146 CA MET A 923 16.518 -30.705 6.473 1.00 20.22 C ATOM 2147 C MET A 923 18.012 -30.623 6.152 1.00 33.40 C ATOM 2148 O MET A 923 18.580 -29.534 6.100 1.00 4.00 O ATOM 2149 CB MET A 923 16.300 -31.660 7.648 1.00 31.43 C ATOM 2150 CG MET A 923 17.034 -31.169 8.898 1.00 54.22 C ATOM 2151 SD MET A 923 16.017 -31.425 10.343 1.00 45.12 S ATOM 2152 CE MET A 923 16.178 -33.193 10.525 1.00 74.31 C ATOM 0 H MET A 923 15.815 -32.176 5.158 1.00 72.43 H new ATOM 0 HA MET A 923 16.166 -29.707 6.734 1.00 20.22 H new ATOM 0 HB2 MET A 923 15.234 -31.746 7.858 1.00 31.43 H new ATOM 0 HB3 MET A 923 16.654 -32.656 7.382 1.00 31.43 H new ATOM 0 HG2 MET A 923 17.978 -31.702 9.008 1.00 54.22 H new ATOM 0 HG3 MET A 923 17.276 -30.111 8.796 1.00 54.22 H new ATOM 0 HE1 MET A 923 15.220 -33.617 10.825 1.00 74.31 H new ATOM 0 HE2 MET A 923 16.487 -33.630 9.575 1.00 74.31 H new ATOM 0 HE3 MET A 923 16.926 -33.414 11.286 1.00 74.31 H new ATOM 2162 N SER A 924 18.605 -31.790 5.945 1.00 74.01 N ATOM 2163 CA SER A 924 20.021 -31.864 5.630 1.00 23.22 C ATOM 2164 C SER A 924 20.409 -30.721 4.690 1.00 10.11 C ATOM 2165 O SER A 924 19.574 -30.221 3.938 1.00 63.14 O ATOM 2166 CB SER A 924 20.376 -33.213 5.000 1.00 13.44 C ATOM 2167 OG SER A 924 19.748 -34.299 5.676 1.00 4.05 O ATOM 0 H SER A 924 18.130 -32.692 5.989 1.00 74.01 H new ATOM 0 HA SER A 924 20.583 -31.768 6.559 1.00 23.22 H new ATOM 0 HB2 SER A 924 20.074 -33.215 3.953 1.00 13.44 H new ATOM 0 HB3 SER A 924 21.457 -33.350 5.021 1.00 13.44 H new ATOM 0 HG SER A 924 18.787 -34.293 5.483 1.00 4.05 H new ATOM 2173 N LYS A 925 21.676 -30.340 4.764 1.00 31.42 N ATOM 2174 CA LYS A 925 22.185 -29.265 3.929 1.00 35.53 C ATOM 2175 C LYS A 925 21.773 -29.515 2.477 1.00 64.51 C ATOM 2176 O LYS A 925 21.879 -30.637 1.982 1.00 11.24 O ATOM 2177 CB LYS A 925 23.694 -29.105 4.122 1.00 32.43 C ATOM 2178 CG LYS A 925 24.181 -27.771 3.553 1.00 70.41 C ATOM 2179 CD LYS A 925 25.710 -27.710 3.531 1.00 34.04 C ATOM 2180 CE LYS A 925 26.269 -27.474 4.936 1.00 54.01 C ATOM 2181 NZ LYS A 925 25.847 -26.150 5.446 1.00 42.13 N ATOM 0 H LYS A 925 22.365 -30.757 5.390 1.00 31.42 H new ATOM 0 HA LYS A 925 21.747 -28.312 4.225 1.00 35.53 H new ATOM 0 HB2 LYS A 925 23.937 -29.162 5.183 1.00 32.43 H new ATOM 0 HB3 LYS A 925 24.216 -29.926 3.631 1.00 32.43 H new ATOM 0 HG2 LYS A 925 23.794 -27.639 2.543 1.00 70.41 H new ATOM 0 HG3 LYS A 925 23.789 -26.950 4.154 1.00 70.41 H new ATOM 0 HD2 LYS A 925 26.109 -28.641 3.128 1.00 34.04 H new ATOM 0 HD3 LYS A 925 26.036 -26.910 2.867 1.00 34.04 H new ATOM 0 HE2 LYS A 925 25.920 -28.257 5.609 1.00 54.01 H new ATOM 0 HE3 LYS A 925 27.357 -27.532 4.915 1.00 54.01 H new ATOM 0 HZ1 LYS A 925 26.520 -25.826 6.170 1.00 42.13 H new ATOM 0 HZ2 LYS A 925 25.827 -25.467 4.662 1.00 42.13 H new ATOM 0 HZ3 LYS A 925 24.898 -26.226 5.864 1.00 42.13 H new