USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 830 HIS : no HE2:sc= -17.9! C(o=-22!,f=-28!) USER MOD Set 1.2: A 832 THR OG1 : rot -52:sc= -1.75! USER MOD Set 1.3: A 879 TYR OH : rot -120:sc= -2.51! USER MOD Set 2.1: A 810 CYS SG : rot 167:sc= -0.844 USER MOD Set 2.2: A 864 CYS SG : rot 29:sc= 1.46 USER MOD Single : A 805 ASN : amide:sc= -9.91! C(o=-9.9!,f=-18!) USER MOD Single : A 806 LYS NZ :NH3+ -128:sc= -1.04 (180deg=-3.09!) USER MOD Single : A 807 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 814 LYS NZ :NH3+ -163:sc= -0.0199 (180deg=-0.258) USER MOD Single : A 818 CYS SG : rot 122:sc= -7.58! USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot 180:sc= -0.586 USER MOD Single : A 829 CYS SG : rot 180:sc= 0 USER MOD Single : A 831 TYR OH : rot 73:sc= 1.49 USER MOD Single : A 839 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 841 CYS SG : rot -167:sc= -0.139! USER MOD Single : A 844 SER OG : rot 172:sc= 0 USER MOD Single : A 858 LYS NZ :NH3+ 149:sc= -0.138 (180deg=-1.25!) USER MOD Single : A 861 LYS NZ :NH3+ -151:sc= -0.482 (180deg=-1.63!) USER MOD Single : A 867 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 868 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 869 CYS SG : rot 40:sc= 0.444 USER MOD Single : A 870 SER OG : rot 180:sc= 0 USER MOD Single : A 871 HIS : no HD1:sc= -0.19 X(o=-0.19,f=-0.071) USER MOD Single : A 876 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-5.1!) USER MOD Single : A 878 LYS NZ :NH3+ -161:sc= 1.17 (180deg=0.7) USER MOD Single : A 880 LYS NZ :NH3+ 143:sc= -0.911 (180deg=-2.75!) USER MOD Single : A 881 THR OG1 : rot 180:sc= -0.572! USER MOD Single : A 888 LYS NZ :NH3+ -162:sc=-0.00849 (180deg=-0.182) USER MOD Single : A 891 SER OG : rot 112:sc= -5.24! USER MOD Single : A 899 THR OG1 : rot -172:sc= -8.28! USER MOD Single : A 902 GLN : amide:sc= -7.53! C(o=-7.5!,f=-4.8!) USER MOD Single : A 903 THR OG1 : rot -44:sc= 0.0125! USER MOD Single : A 905 TYR OH : rot 180:sc= -0.631 USER MOD Single : A 906 SER OG : rot 180:sc= 0 USER MOD Single : A 907 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 909 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 912 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 915 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00466) USER MOD Single : A 923 MET CE :methyl 138:sc= -3.88! (180deg=-4.99!) USER MOD Single : A 924 SER OG : rot 180:sc= -0.0165 USER MOD Single : A 925 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 -2.909 -28.758 -1.504 1.00 33.14 N ATOM 209 CA ASN A 805 -2.186 -28.399 -0.296 1.00 11.14 C ATOM 210 C ASN A 805 -2.937 -27.281 0.430 1.00 52.42 C ATOM 211 O ASN A 805 -3.800 -26.627 -0.154 1.00 72.24 O ATOM 212 CB ASN A 805 -0.782 -27.889 -0.625 1.00 40.35 C ATOM 213 CG ASN A 805 -0.154 -27.191 0.583 1.00 53.43 C ATOM 214 OD1 ASN A 805 0.319 -27.816 1.517 1.00 34.33 O ATOM 215 ND2 ASN A 805 -0.176 -25.863 0.512 1.00 53.20 N ATOM 0 HA ASN A 805 -2.109 -29.290 0.328 1.00 11.14 H new ATOM 0 HB2 ASN A 805 -0.152 -28.723 -0.936 1.00 40.35 H new ATOM 0 HB3 ASN A 805 -0.831 -27.196 -1.465 1.00 40.35 H new ATOM 0 HD21 ASN A 805 0.219 -25.305 1.269 1.00 53.20 H new ATOM 0 HD22 ASN A 805 -0.588 -25.402 -0.300 1.00 53.20 H new ATOM 222 N LYS A 806 -2.581 -27.095 1.692 1.00 14.44 N ATOM 223 CA LYS A 806 -3.211 -26.067 2.504 1.00 50.43 C ATOM 224 C LYS A 806 -2.132 -25.284 3.255 1.00 51.00 C ATOM 225 O LYS A 806 -1.074 -25.825 3.570 1.00 24.32 O ATOM 226 CB LYS A 806 -4.274 -26.681 3.417 1.00 4.11 C ATOM 227 CG LYS A 806 -4.536 -25.787 4.631 1.00 31.41 C ATOM 228 CD LYS A 806 -5.944 -26.015 5.185 1.00 22.35 C ATOM 229 CE LYS A 806 -6.232 -27.508 5.354 1.00 62.54 C ATOM 230 NZ LYS A 806 -6.849 -28.059 4.126 1.00 14.52 N ATOM 0 H LYS A 806 -1.864 -27.639 2.173 1.00 14.44 H new ATOM 0 HA LYS A 806 -3.741 -25.354 1.872 1.00 50.43 H new ATOM 0 HB2 LYS A 806 -5.200 -26.823 2.859 1.00 4.11 H new ATOM 0 HB3 LYS A 806 -3.948 -27.666 3.750 1.00 4.11 H new ATOM 0 HG2 LYS A 806 -3.798 -25.994 5.406 1.00 31.41 H new ATOM 0 HG3 LYS A 806 -4.417 -24.741 4.349 1.00 31.41 H new ATOM 0 HD2 LYS A 806 -6.047 -25.510 6.146 1.00 22.35 H new ATOM 0 HD3 LYS A 806 -6.679 -25.573 4.512 1.00 22.35 H new ATOM 0 HE2 LYS A 806 -5.307 -28.040 5.574 1.00 62.54 H new ATOM 0 HE3 LYS A 806 -6.898 -27.662 6.203 1.00 62.54 H new ATOM 0 HZ1 LYS A 806 -7.722 -28.566 4.374 1.00 14.52 H new ATOM 0 HZ2 LYS A 806 -7.073 -27.282 3.472 1.00 14.52 H new ATOM 0 HZ3 LYS A 806 -6.185 -28.716 3.669 1.00 14.52 H new ATOM 243 N LYS A 807 -2.438 -24.022 3.520 1.00 21.41 N ATOM 244 CA LYS A 807 -1.508 -23.160 4.228 1.00 5.25 C ATOM 245 C LYS A 807 -1.878 -23.127 5.713 1.00 71.04 C ATOM 246 O LYS A 807 -3.028 -23.370 6.074 1.00 34.03 O ATOM 247 CB LYS A 807 -1.457 -21.777 3.577 1.00 42.44 C ATOM 248 CG LYS A 807 -0.663 -20.793 4.439 1.00 52.22 C ATOM 249 CD LYS A 807 -0.735 -19.377 3.863 1.00 71.21 C ATOM 250 CE LYS A 807 -0.559 -19.394 2.343 1.00 3.02 C ATOM 251 NZ LYS A 807 -0.488 -18.013 1.814 1.00 35.44 N ATOM 0 H LYS A 807 -3.317 -23.576 3.257 1.00 21.41 H new ATOM 0 HA LYS A 807 -0.495 -23.557 4.160 1.00 5.25 H new ATOM 0 HB2 LYS A 807 -1.000 -21.852 2.590 1.00 42.44 H new ATOM 0 HB3 LYS A 807 -2.470 -21.402 3.431 1.00 42.44 H new ATOM 0 HG2 LYS A 807 -1.055 -20.796 5.456 1.00 52.22 H new ATOM 0 HG3 LYS A 807 0.377 -21.113 4.498 1.00 52.22 H new ATOM 0 HD2 LYS A 807 -1.694 -18.926 4.117 1.00 71.21 H new ATOM 0 HD3 LYS A 807 0.039 -18.757 4.315 1.00 71.21 H new ATOM 0 HE2 LYS A 807 0.350 -19.937 2.082 1.00 3.02 H new ATOM 0 HE3 LYS A 807 -1.391 -19.925 1.880 1.00 3.02 H new ATOM 0 HZ1 LYS A 807 -0.369 -18.043 0.781 1.00 35.44 H new ATOM 0 HZ2 LYS A 807 -1.366 -17.507 2.047 1.00 35.44 H new ATOM 0 HZ3 LYS A 807 0.321 -17.518 2.242 1.00 35.44 H new ATOM 264 N LEU A 808 -0.882 -22.825 6.532 1.00 42.41 N ATOM 265 CA LEU A 808 -1.089 -22.757 7.969 1.00 44.14 C ATOM 266 C LEU A 808 -0.679 -21.372 8.474 1.00 61.03 C ATOM 267 O LEU A 808 0.217 -20.743 7.913 1.00 0.20 O ATOM 268 CB LEU A 808 -0.362 -23.907 8.669 1.00 12.22 C ATOM 269 CG LEU A 808 -0.988 -25.294 8.507 1.00 13.50 C ATOM 270 CD1 LEU A 808 -0.493 -25.972 7.228 1.00 32.45 C ATOM 271 CD2 LEU A 808 -0.740 -26.155 9.747 1.00 72.44 C ATOM 0 H LEU A 808 0.071 -22.625 6.228 1.00 42.41 H new ATOM 0 HA LEU A 808 -2.145 -22.884 8.209 1.00 44.14 H new ATOM 0 HB2 LEU A 808 0.661 -23.946 8.294 1.00 12.22 H new ATOM 0 HB3 LEU A 808 -0.303 -23.679 9.733 1.00 12.22 H new ATOM 0 HG LEU A 808 -2.067 -25.174 8.410 1.00 13.50 H new ATOM 0 HD11 LEU A 808 -0.953 -26.956 7.137 1.00 32.45 H new ATOM 0 HD12 LEU A 808 -0.764 -25.363 6.365 1.00 32.45 H new ATOM 0 HD13 LEU A 808 0.591 -26.080 7.270 1.00 32.45 H new ATOM 0 HD21 LEU A 808 -1.195 -27.135 9.606 1.00 72.44 H new ATOM 0 HD22 LEU A 808 0.333 -26.272 9.900 1.00 72.44 H new ATOM 0 HD23 LEU A 808 -1.181 -25.672 10.619 1.00 72.44 H new ATOM 283 N LEU A 809 -1.355 -20.938 9.527 1.00 3.14 N ATOM 284 CA LEU A 809 -1.072 -19.639 10.114 1.00 31.15 C ATOM 285 C LEU A 809 -0.880 -19.797 11.624 1.00 34.41 C ATOM 286 O LEU A 809 -1.145 -20.863 12.179 1.00 54.13 O ATOM 287 CB LEU A 809 -2.159 -18.632 9.735 1.00 53.41 C ATOM 288 CG LEU A 809 -1.907 -17.820 8.462 1.00 31.35 C ATOM 289 CD1 LEU A 809 -2.185 -18.659 7.213 1.00 2.14 C ATOM 290 CD2 LEU A 809 -2.715 -16.521 8.472 1.00 42.13 C ATOM 0 H LEU A 809 -2.098 -21.462 9.989 1.00 3.14 H new ATOM 0 HA LEU A 809 -0.142 -19.235 9.714 1.00 31.15 H new ATOM 0 HB2 LEU A 809 -3.100 -19.170 9.619 1.00 53.41 H new ATOM 0 HB3 LEU A 809 -2.289 -17.938 10.565 1.00 53.41 H new ATOM 0 HG LEU A 809 -0.853 -17.543 8.436 1.00 31.35 H new ATOM 0 HD11 LEU A 809 -1.998 -18.059 6.323 1.00 2.14 H new ATOM 0 HD12 LEU A 809 -1.530 -19.530 7.207 1.00 2.14 H new ATOM 0 HD13 LEU A 809 -3.225 -18.986 7.219 1.00 2.14 H new ATOM 0 HD21 LEU A 809 -2.518 -15.963 7.557 1.00 42.13 H new ATOM 0 HD22 LEU A 809 -3.778 -16.754 8.533 1.00 42.13 H new ATOM 0 HD23 LEU A 809 -2.426 -15.919 9.333 1.00 42.13 H new ATOM 302 N CYS A 810 -0.421 -18.721 12.246 1.00 35.42 N ATOM 303 CA CYS A 810 -0.191 -18.727 13.681 1.00 72.52 C ATOM 304 C CYS A 810 -1.317 -17.938 14.351 1.00 32.14 C ATOM 305 O CYS A 810 -1.370 -16.714 14.246 1.00 3.32 O ATOM 306 CB CYS A 810 1.188 -18.167 14.035 1.00 72.23 C ATOM 307 SG CYS A 810 1.881 -19.070 15.468 1.00 41.03 S ATOM 0 H CYS A 810 -0.202 -17.839 11.783 1.00 35.42 H new ATOM 0 HA CYS A 810 -0.199 -19.753 14.049 1.00 72.52 H new ATOM 0 HB2 CYS A 810 1.857 -18.258 13.179 1.00 72.23 H new ATOM 0 HB3 CYS A 810 1.110 -17.105 14.267 1.00 72.23 H new ATOM 0 HG CYS A 810 3.145 -18.789 15.588 1.00 41.03 H new ATOM 313 N ARG A 811 -2.190 -18.671 15.026 1.00 34.41 N ATOM 314 CA ARG A 811 -3.312 -18.055 15.714 1.00 73.03 C ATOM 315 C ARG A 811 -2.867 -16.765 16.406 1.00 22.42 C ATOM 316 O ARG A 811 -3.666 -15.849 16.593 1.00 62.03 O ATOM 317 CB ARG A 811 -3.909 -19.004 16.754 1.00 34.53 C ATOM 318 CG ARG A 811 -5.048 -18.330 17.522 1.00 31.23 C ATOM 319 CD ARG A 811 -5.692 -19.302 18.513 1.00 75.34 C ATOM 320 NE ARG A 811 -6.740 -18.608 19.294 1.00 31.12 N ATOM 321 CZ ARG A 811 -7.238 -19.062 20.464 1.00 24.41 C ATOM 322 NH1 ARG A 811 -6.786 -20.217 20.999 1.00 42.15 N ATOM 323 NH2 ARG A 811 -8.172 -18.361 21.078 1.00 54.24 N ATOM 0 H ARG A 811 -2.143 -19.686 15.111 1.00 34.41 H new ATOM 0 HA ARG A 811 -4.073 -17.827 14.968 1.00 73.03 H new ATOM 0 HB2 ARG A 811 -4.280 -19.903 16.261 1.00 34.53 H new ATOM 0 HB3 ARG A 811 -3.133 -19.320 17.451 1.00 34.53 H new ATOM 0 HG2 ARG A 811 -4.666 -17.460 18.056 1.00 31.23 H new ATOM 0 HG3 ARG A 811 -5.800 -17.968 16.821 1.00 31.23 H new ATOM 0 HD2 ARG A 811 -6.125 -20.147 17.977 1.00 75.34 H new ATOM 0 HD3 ARG A 811 -4.934 -19.705 19.184 1.00 75.34 H new ATOM 0 HE ARG A 811 -7.109 -17.732 18.925 1.00 31.12 H new ATOM 0 HH11 ARG A 811 -6.063 -20.753 20.519 1.00 42.15 H new ATOM 0 HH12 ARG A 811 -7.167 -20.553 21.883 1.00 42.15 H new ATOM 0 HH21 ARG A 811 -8.508 -17.489 20.668 1.00 54.24 H new ATOM 0 HH22 ARG A 811 -8.558 -18.691 21.963 1.00 54.24 H new ATOM 336 N LYS A 812 -1.593 -16.736 16.768 1.00 3.44 N ATOM 337 CA LYS A 812 -1.032 -15.574 17.436 1.00 5.42 C ATOM 338 C LYS A 812 -1.524 -14.303 16.740 1.00 61.32 C ATOM 339 O LYS A 812 -2.439 -13.640 17.225 1.00 31.11 O ATOM 340 CB LYS A 812 0.493 -15.683 17.511 1.00 52.43 C ATOM 341 CG LYS A 812 0.917 -16.987 18.189 1.00 73.14 C ATOM 342 CD LYS A 812 0.077 -17.253 19.440 1.00 5.51 C ATOM 343 CE LYS A 812 -1.166 -18.078 19.102 1.00 45.02 C ATOM 344 NZ LYS A 812 -1.484 -19.011 20.206 1.00 53.13 N ATOM 0 H LYS A 812 -0.933 -17.498 16.611 1.00 3.44 H new ATOM 0 HA LYS A 812 -1.377 -15.526 18.469 1.00 5.42 H new ATOM 0 HB2 LYS A 812 0.914 -15.638 16.507 1.00 52.43 H new ATOM 0 HB3 LYS A 812 0.895 -14.834 18.064 1.00 52.43 H new ATOM 0 HG2 LYS A 812 0.808 -17.816 17.490 1.00 73.14 H new ATOM 0 HG3 LYS A 812 1.972 -16.934 18.459 1.00 73.14 H new ATOM 0 HD2 LYS A 812 0.678 -17.781 20.180 1.00 5.51 H new ATOM 0 HD3 LYS A 812 -0.222 -16.306 19.889 1.00 5.51 H new ATOM 0 HE2 LYS A 812 -2.012 -17.415 18.923 1.00 45.02 H new ATOM 0 HE3 LYS A 812 -0.999 -18.638 18.182 1.00 45.02 H new ATOM 0 HZ1 LYS A 812 -2.330 -19.563 19.961 1.00 53.13 H new ATOM 0 HZ2 LYS A 812 -0.682 -19.655 20.358 1.00 53.13 H new ATOM 0 HZ3 LYS A 812 -1.664 -18.471 21.076 1.00 53.13 H new ATOM 357 N CYS A 813 -0.895 -14.003 15.613 1.00 2.32 N ATOM 358 CA CYS A 813 -1.257 -12.824 14.845 1.00 14.32 C ATOM 359 C CYS A 813 -1.784 -13.281 13.484 1.00 55.25 C ATOM 360 O CYS A 813 -1.764 -12.519 12.518 1.00 2.33 O ATOM 361 CB CYS A 813 -0.081 -11.855 14.706 1.00 31.31 C ATOM 362 SG CYS A 813 -0.699 -10.153 14.444 1.00 14.04 S ATOM 0 H CYS A 813 -0.137 -14.556 15.213 1.00 2.32 H new ATOM 0 HA CYS A 813 -2.037 -12.271 15.369 1.00 14.32 H new ATOM 0 HB2 CYS A 813 0.539 -11.892 15.602 1.00 31.31 H new ATOM 0 HB3 CYS A 813 0.550 -12.154 13.869 1.00 31.31 H new ATOM 0 HG CYS A 813 0.308 -9.339 14.329 1.00 14.04 H new ATOM 368 N LYS A 814 -2.244 -14.523 13.449 1.00 15.23 N ATOM 369 CA LYS A 814 -2.776 -15.090 12.222 1.00 71.51 C ATOM 370 C LYS A 814 -1.816 -14.791 11.069 1.00 51.31 C ATOM 371 O LYS A 814 -2.160 -14.054 10.146 1.00 42.30 O ATOM 372 CB LYS A 814 -4.204 -14.597 11.978 1.00 64.13 C ATOM 373 CG LYS A 814 -4.903 -14.267 13.298 1.00 72.50 C ATOM 374 CD LYS A 814 -5.006 -15.507 14.188 1.00 32.44 C ATOM 375 CE LYS A 814 -5.966 -16.536 13.587 1.00 13.22 C ATOM 376 NZ LYS A 814 -7.358 -16.034 13.633 1.00 30.31 N ATOM 0 H LYS A 814 -2.259 -15.153 14.251 1.00 15.23 H new ATOM 0 HA LYS A 814 -2.848 -16.175 12.304 1.00 71.51 H new ATOM 0 HB2 LYS A 814 -4.183 -13.712 11.342 1.00 64.13 H new ATOM 0 HB3 LYS A 814 -4.770 -15.360 11.444 1.00 64.13 H new ATOM 0 HG2 LYS A 814 -4.352 -13.485 13.820 1.00 72.50 H new ATOM 0 HG3 LYS A 814 -5.900 -13.875 13.098 1.00 72.50 H new ATOM 0 HD2 LYS A 814 -4.019 -15.954 14.311 1.00 32.44 H new ATOM 0 HD3 LYS A 814 -5.351 -15.219 15.181 1.00 32.44 H new ATOM 0 HE2 LYS A 814 -5.683 -16.747 12.556 1.00 13.22 H new ATOM 0 HE3 LYS A 814 -5.893 -17.475 14.136 1.00 13.22 H new ATOM 0 HZ1 LYS A 814 -8.018 -16.827 13.499 1.00 30.31 H new ATOM 0 HZ2 LYS A 814 -7.536 -15.588 14.556 1.00 30.31 H new ATOM 0 HZ3 LYS A 814 -7.500 -15.334 12.877 1.00 30.31 H new ATOM 389 N ALA A 815 -0.632 -15.377 11.160 1.00 64.45 N ATOM 390 CA ALA A 815 0.380 -15.182 10.135 1.00 25.33 C ATOM 391 C ALA A 815 0.928 -16.543 9.700 1.00 60.01 C ATOM 392 O ALA A 815 0.975 -17.480 10.495 1.00 62.40 O ATOM 393 CB ALA A 815 1.476 -14.257 10.669 1.00 14.13 C ATOM 0 H ALA A 815 -0.350 -15.987 11.927 1.00 64.45 H new ATOM 0 HA ALA A 815 -0.052 -14.703 9.256 1.00 25.33 H new ATOM 0 HB1 ALA A 815 2.235 -14.111 9.900 1.00 14.13 H new ATOM 0 HB2 ALA A 815 1.041 -13.294 10.937 1.00 14.13 H new ATOM 0 HB3 ALA A 815 1.934 -14.706 11.550 1.00 14.13 H new ATOM 399 N LEU A 816 1.328 -16.608 8.439 1.00 41.04 N ATOM 400 CA LEU A 816 1.871 -17.838 7.888 1.00 74.41 C ATOM 401 C LEU A 816 2.774 -18.503 8.929 1.00 74.23 C ATOM 402 O LEU A 816 3.625 -17.847 9.526 1.00 24.34 O ATOM 403 CB LEU A 816 2.567 -17.567 6.553 1.00 2.41 C ATOM 404 CG LEU A 816 3.389 -18.722 5.978 1.00 74.14 C ATOM 405 CD1 LEU A 816 4.727 -18.859 6.706 1.00 43.25 C ATOM 406 CD2 LEU A 816 2.589 -20.026 5.998 1.00 22.50 C ATOM 0 H LEU A 816 1.287 -15.828 7.783 1.00 41.04 H new ATOM 0 HA LEU A 816 1.069 -18.542 7.665 1.00 74.41 H new ATOM 0 HB2 LEU A 816 1.809 -17.287 5.821 1.00 2.41 H new ATOM 0 HB3 LEU A 816 3.224 -16.706 6.677 1.00 2.41 H new ATOM 0 HG LEU A 816 3.612 -18.497 4.935 1.00 74.14 H new ATOM 0 HD11 LEU A 816 5.291 -19.687 6.277 1.00 43.25 H new ATOM 0 HD12 LEU A 816 5.297 -17.936 6.596 1.00 43.25 H new ATOM 0 HD13 LEU A 816 4.548 -19.051 7.764 1.00 43.25 H new ATOM 0 HD21 LEU A 816 3.196 -20.831 5.584 1.00 22.50 H new ATOM 0 HD22 LEU A 816 2.315 -20.269 7.025 1.00 22.50 H new ATOM 0 HD23 LEU A 816 1.686 -19.908 5.400 1.00 22.50 H new ATOM 418 N ALA A 817 2.557 -19.797 9.114 1.00 74.15 N ATOM 419 CA ALA A 817 3.340 -20.558 10.072 1.00 63.02 C ATOM 420 C ALA A 817 4.070 -21.689 9.344 1.00 52.11 C ATOM 421 O ALA A 817 5.235 -21.963 9.626 1.00 44.14 O ATOM 422 CB ALA A 817 2.425 -21.075 11.184 1.00 64.12 C ATOM 0 H ALA A 817 1.850 -20.338 8.616 1.00 74.15 H new ATOM 0 HA ALA A 817 4.095 -19.926 10.539 1.00 63.02 H new ATOM 0 HB1 ALA A 817 3.013 -21.646 11.903 1.00 64.12 H new ATOM 0 HB2 ALA A 817 1.954 -20.232 11.689 1.00 64.12 H new ATOM 0 HB3 ALA A 817 1.656 -21.716 10.754 1.00 64.12 H new ATOM 428 N CYS A 818 3.353 -22.315 8.422 1.00 24.20 N ATOM 429 CA CYS A 818 3.918 -23.410 7.652 1.00 61.24 C ATOM 430 C CYS A 818 2.881 -23.856 6.619 1.00 11.00 C ATOM 431 O CYS A 818 1.868 -23.186 6.422 1.00 20.44 O ATOM 432 CB CYS A 818 4.361 -24.566 8.552 1.00 53.35 C ATOM 433 SG CYS A 818 6.171 -24.500 8.809 1.00 2.04 S ATOM 0 H CYS A 818 2.387 -22.085 8.191 1.00 24.20 H new ATOM 0 HA CYS A 818 4.818 -23.071 7.139 1.00 61.24 H new ATOM 0 HB2 CYS A 818 3.847 -24.509 9.511 1.00 53.35 H new ATOM 0 HB3 CYS A 818 4.084 -25.518 8.098 1.00 53.35 H new ATOM 0 HG CYS A 818 6.426 -24.424 10.081 1.00 2.04 H new ATOM 439 N TYR A 819 3.169 -24.984 5.986 1.00 4.25 N ATOM 440 CA TYR A 819 2.274 -25.527 4.979 1.00 42.10 C ATOM 441 C TYR A 819 2.006 -27.012 5.228 1.00 75.54 C ATOM 442 O TYR A 819 2.872 -27.729 5.726 1.00 3.23 O ATOM 443 CB TYR A 819 3.000 -25.369 3.641 1.00 14.02 C ATOM 444 CG TYR A 819 3.105 -23.921 3.158 1.00 61.34 C ATOM 445 CD1 TYR A 819 2.068 -23.355 2.444 1.00 4.35 C ATOM 446 CD2 TYR A 819 4.237 -23.182 3.435 1.00 42.13 C ATOM 447 CE1 TYR A 819 2.168 -21.992 1.989 1.00 33.13 C ATOM 448 CE2 TYR A 819 4.337 -21.819 2.980 1.00 75.45 C ATOM 449 CZ TYR A 819 3.297 -21.292 2.279 1.00 11.33 C ATOM 450 OH TYR A 819 3.391 -20.005 1.849 1.00 13.15 O ATOM 0 H TYR A 819 4.010 -25.537 6.151 1.00 4.25 H new ATOM 0 HA TYR A 819 1.315 -25.009 4.998 1.00 42.10 H new ATOM 0 HB2 TYR A 819 4.004 -25.785 3.732 1.00 14.02 H new ATOM 0 HB3 TYR A 819 2.479 -25.957 2.885 1.00 14.02 H new ATOM 0 HD1 TYR A 819 1.182 -23.934 2.227 1.00 4.35 H new ATOM 0 HD2 TYR A 819 5.048 -23.626 3.993 1.00 42.13 H new ATOM 0 HE1 TYR A 819 1.364 -21.536 1.430 1.00 33.13 H new ATOM 0 HE2 TYR A 819 5.217 -21.229 3.190 1.00 75.45 H new ATOM 0 HH TYR A 819 4.251 -19.628 2.129 1.00 13.15 H new ATOM 460 N THR A 820 0.801 -27.431 4.869 1.00 70.44 N ATOM 461 CA THR A 820 0.407 -28.819 5.046 1.00 3.35 C ATOM 462 C THR A 820 1.168 -29.718 4.070 1.00 32.33 C ATOM 463 O THR A 820 1.214 -30.935 4.248 1.00 13.52 O ATOM 464 CB THR A 820 -1.113 -28.902 4.892 1.00 64.42 C ATOM 465 OG1 THR A 820 -1.516 -29.812 5.912 1.00 1.53 O ATOM 466 CG2 THR A 820 -1.532 -29.592 3.592 1.00 42.23 C ATOM 0 H THR A 820 0.085 -26.834 4.456 1.00 70.44 H new ATOM 0 HA THR A 820 0.667 -29.181 6.041 1.00 3.35 H new ATOM 0 HB THR A 820 -1.537 -27.898 4.924 1.00 64.42 H new ATOM 0 HG1 THR A 820 -2.489 -29.923 5.885 1.00 1.53 H new ATOM 0 HG21 THR A 820 -2.620 -29.625 3.532 1.00 42.23 H new ATOM 0 HG22 THR A 820 -1.138 -29.036 2.741 1.00 42.23 H new ATOM 0 HG23 THR A 820 -1.137 -30.608 3.575 1.00 42.23 H new ATOM 474 N ALA A 821 1.746 -29.085 3.060 1.00 31.41 N ATOM 475 CA ALA A 821 2.502 -29.813 2.055 1.00 23.23 C ATOM 476 C ALA A 821 3.925 -30.049 2.566 1.00 62.00 C ATOM 477 O ALA A 821 4.650 -30.886 2.030 1.00 30.24 O ATOM 478 CB ALA A 821 2.477 -29.038 0.736 1.00 21.24 C ATOM 0 H ALA A 821 1.706 -28.076 2.916 1.00 31.41 H new ATOM 0 HA ALA A 821 2.052 -30.788 1.868 1.00 23.23 H new ATOM 0 HB1 ALA A 821 3.044 -29.584 -0.018 1.00 21.24 H new ATOM 0 HB2 ALA A 821 1.446 -28.922 0.401 1.00 21.24 H new ATOM 0 HB3 ALA A 821 2.923 -28.054 0.883 1.00 21.24 H new ATOM 484 N ASP A 822 4.283 -29.296 3.596 1.00 55.23 N ATOM 485 CA ASP A 822 5.606 -29.412 4.185 1.00 73.33 C ATOM 486 C ASP A 822 5.493 -30.088 5.553 1.00 54.03 C ATOM 487 O ASP A 822 6.503 -30.400 6.180 1.00 4.25 O ATOM 488 CB ASP A 822 6.241 -28.036 4.388 1.00 0.54 C ATOM 489 CG ASP A 822 6.005 -27.040 3.251 1.00 11.42 C ATOM 490 OD1 ASP A 822 6.309 -25.844 3.376 1.00 62.03 O ATOM 491 OD2 ASP A 822 5.478 -27.543 2.187 1.00 54.33 O ATOM 0 H ASP A 822 3.679 -28.603 4.038 1.00 55.23 H new ATOM 0 HA ASP A 822 6.227 -29.999 3.508 1.00 73.33 H new ATOM 0 HB2 ASP A 822 5.854 -27.607 5.312 1.00 0.54 H new ATOM 0 HB3 ASP A 822 7.315 -28.164 4.521 1.00 0.54 H new ATOM 497 N VAL A 823 4.254 -30.294 5.975 1.00 72.34 N ATOM 498 CA VAL A 823 3.995 -30.927 7.257 1.00 64.33 C ATOM 499 C VAL A 823 4.098 -32.446 7.101 1.00 40.12 C ATOM 500 O VAL A 823 3.626 -33.005 6.112 1.00 23.20 O ATOM 501 CB VAL A 823 2.640 -30.472 7.801 1.00 32.52 C ATOM 502 CG1 VAL A 823 2.258 -31.265 9.053 1.00 10.20 C ATOM 503 CG2 VAL A 823 2.639 -28.969 8.082 1.00 14.44 C ATOM 0 H VAL A 823 3.418 -30.034 5.452 1.00 72.34 H new ATOM 0 HA VAL A 823 4.742 -30.624 7.990 1.00 64.33 H new ATOM 0 HB VAL A 823 1.888 -30.670 7.037 1.00 32.52 H new ATOM 0 HG11 VAL A 823 1.291 -30.922 9.420 1.00 10.20 H new ATOM 0 HG12 VAL A 823 2.198 -32.325 8.808 1.00 10.20 H new ATOM 0 HG13 VAL A 823 3.013 -31.113 9.824 1.00 10.20 H new ATOM 0 HG21 VAL A 823 1.664 -28.672 8.468 1.00 14.44 H new ATOM 0 HG22 VAL A 823 3.407 -28.736 8.819 1.00 14.44 H new ATOM 0 HG23 VAL A 823 2.845 -28.426 7.159 1.00 14.44 H new ATOM 513 N ARG A 824 4.718 -33.070 8.092 1.00 55.12 N ATOM 514 CA ARG A 824 4.888 -34.513 8.077 1.00 0.11 C ATOM 515 C ARG A 824 4.857 -35.066 9.503 1.00 1.45 C ATOM 516 O ARG A 824 5.427 -34.470 10.416 1.00 3.03 O ATOM 517 CB ARG A 824 6.210 -34.904 7.414 1.00 22.44 C ATOM 518 CG ARG A 824 6.045 -35.041 5.899 1.00 32.35 C ATOM 519 CD ARG A 824 6.424 -33.741 5.187 1.00 60.51 C ATOM 520 NE ARG A 824 5.668 -33.620 3.920 1.00 4.32 N ATOM 521 CZ ARG A 824 6.087 -34.121 2.738 1.00 14.33 C ATOM 522 NH1 ARG A 824 7.260 -34.783 2.651 1.00 11.34 N ATOM 523 NH2 ARG A 824 5.331 -33.953 1.669 1.00 30.30 N ATOM 0 H ARG A 824 5.109 -32.603 8.910 1.00 55.12 H new ATOM 0 HA ARG A 824 4.066 -34.938 7.501 1.00 0.11 H new ATOM 0 HB2 ARG A 824 6.968 -34.152 7.634 1.00 22.44 H new ATOM 0 HB3 ARG A 824 6.565 -35.846 7.831 1.00 22.44 H new ATOM 0 HG2 ARG A 824 6.670 -35.856 5.534 1.00 32.35 H new ATOM 0 HG3 ARG A 824 5.013 -35.301 5.664 1.00 32.35 H new ATOM 0 HD2 ARG A 824 6.210 -32.888 5.831 1.00 60.51 H new ATOM 0 HD3 ARG A 824 7.495 -33.726 4.984 1.00 60.51 H new ATOM 0 HE ARG A 824 4.775 -33.128 3.941 1.00 4.32 H new ATOM 0 HH11 ARG A 824 7.838 -34.908 3.482 1.00 11.34 H new ATOM 0 HH12 ARG A 824 7.569 -35.158 1.754 1.00 11.34 H new ATOM 0 HH21 ARG A 824 4.446 -33.451 1.744 1.00 30.30 H new ATOM 0 HH22 ARG A 824 5.632 -34.325 0.768 1.00 30.30 H new ATOM 536 N VAL A 825 4.186 -36.198 9.651 1.00 75.13 N ATOM 537 CA VAL A 825 4.073 -36.838 10.951 1.00 52.25 C ATOM 538 C VAL A 825 4.987 -38.064 10.992 1.00 72.04 C ATOM 539 O VAL A 825 5.224 -38.700 9.966 1.00 24.31 O ATOM 540 CB VAL A 825 2.609 -37.173 11.243 1.00 30.25 C ATOM 541 CG1 VAL A 825 1.877 -35.965 11.832 1.00 20.50 C ATOM 542 CG2 VAL A 825 1.902 -37.684 9.987 1.00 75.41 C ATOM 0 H VAL A 825 3.714 -36.689 8.892 1.00 75.13 H new ATOM 0 HA VAL A 825 4.401 -36.162 11.740 1.00 52.25 H new ATOM 0 HB VAL A 825 2.590 -37.971 11.985 1.00 30.25 H new ATOM 0 HG11 VAL A 825 0.838 -36.230 12.030 1.00 20.50 H new ATOM 0 HG12 VAL A 825 2.359 -35.666 12.763 1.00 20.50 H new ATOM 0 HG13 VAL A 825 1.911 -35.138 11.123 1.00 20.50 H new ATOM 0 HG21 VAL A 825 0.863 -37.915 10.223 1.00 75.41 H new ATOM 0 HG22 VAL A 825 1.937 -36.918 9.213 1.00 75.41 H new ATOM 0 HG23 VAL A 825 2.401 -38.584 9.629 1.00 75.41 H new ATOM 552 N ILE A 826 5.475 -38.359 12.188 1.00 52.24 N ATOM 553 CA ILE A 826 6.358 -39.498 12.376 1.00 55.42 C ATOM 554 C ILE A 826 5.540 -40.697 12.858 1.00 34.15 C ATOM 555 O ILE A 826 5.473 -40.966 14.057 1.00 42.11 O ATOM 556 CB ILE A 826 7.516 -39.129 13.305 1.00 62.53 C ATOM 557 CG1 ILE A 826 8.565 -38.294 12.568 1.00 0.53 C ATOM 558 CG2 ILE A 826 8.125 -40.379 13.944 1.00 71.32 C ATOM 559 CD1 ILE A 826 9.017 -37.106 13.421 1.00 61.22 C ATOM 0 H ILE A 826 5.276 -37.829 13.036 1.00 52.24 H new ATOM 0 HA ILE A 826 6.818 -39.785 11.430 1.00 55.42 H new ATOM 0 HB ILE A 826 7.123 -38.512 14.113 1.00 62.53 H new ATOM 0 HG12 ILE A 826 9.424 -38.918 12.322 1.00 0.53 H new ATOM 0 HG13 ILE A 826 8.152 -37.934 11.626 1.00 0.53 H new ATOM 0 HG21 ILE A 826 8.946 -40.089 14.600 1.00 71.32 H new ATOM 0 HG22 ILE A 826 7.363 -40.899 14.525 1.00 71.32 H new ATOM 0 HG23 ILE A 826 8.500 -41.041 13.163 1.00 71.32 H new ATOM 0 HD11 ILE A 826 9.763 -36.529 12.875 1.00 61.22 H new ATOM 0 HD12 ILE A 826 8.159 -36.472 13.645 1.00 61.22 H new ATOM 0 HD13 ILE A 826 9.451 -37.471 14.352 1.00 61.22 H new ATOM 571 N GLU A 827 4.937 -41.386 11.900 1.00 24.24 N ATOM 572 CA GLU A 827 4.127 -42.551 12.213 1.00 54.24 C ATOM 573 C GLU A 827 2.767 -42.118 12.764 1.00 33.35 C ATOM 574 O GLU A 827 2.128 -42.863 13.506 1.00 23.42 O ATOM 575 CB GLU A 827 4.849 -43.474 13.196 1.00 73.01 C ATOM 576 CG GLU A 827 6.323 -43.633 12.817 1.00 13.14 C ATOM 577 CD GLU A 827 6.890 -44.945 13.362 1.00 61.53 C ATOM 578 OE1 GLU A 827 7.937 -45.412 12.888 1.00 32.11 O ATOM 579 OE2 GLU A 827 6.204 -45.484 14.312 1.00 13.42 O ATOM 0 H GLU A 827 4.993 -41.160 10.907 1.00 24.24 H new ATOM 0 HA GLU A 827 3.963 -43.113 11.294 1.00 54.24 H new ATOM 0 HB2 GLU A 827 4.771 -43.069 14.205 1.00 73.01 H new ATOM 0 HB3 GLU A 827 4.365 -44.451 13.206 1.00 73.01 H new ATOM 0 HG2 GLU A 827 6.428 -43.610 11.732 1.00 13.14 H new ATOM 0 HG3 GLU A 827 6.896 -42.794 13.211 1.00 13.14 H new ATOM 587 N GLU A 828 2.364 -40.916 12.381 1.00 15.21 N ATOM 588 CA GLU A 828 1.091 -40.375 12.828 1.00 21.23 C ATOM 589 C GLU A 828 1.040 -40.334 14.357 1.00 75.21 C ATOM 590 O GLU A 828 -0.028 -40.484 14.950 1.00 63.12 O ATOM 591 CB GLU A 828 -0.078 -41.184 12.262 1.00 44.01 C ATOM 592 CG GLU A 828 0.136 -41.491 10.778 1.00 0.03 C ATOM 593 CD GLU A 828 -0.859 -42.544 10.287 1.00 34.25 C ATOM 594 OE1 GLU A 828 -0.454 -43.657 9.921 1.00 61.14 O ATOM 595 OE2 GLU A 828 -2.095 -42.173 10.297 1.00 42.24 O ATOM 0 H GLU A 828 2.896 -40.301 11.766 1.00 15.21 H new ATOM 0 HA GLU A 828 1.000 -39.356 12.453 1.00 21.23 H new ATOM 0 HB2 GLU A 828 -0.184 -42.115 12.818 1.00 44.01 H new ATOM 0 HB3 GLU A 828 -1.007 -40.628 12.392 1.00 44.01 H new ATOM 0 HG2 GLU A 828 0.022 -40.578 10.194 1.00 0.03 H new ATOM 0 HG3 GLU A 828 1.154 -41.846 10.620 1.00 0.03 H new ATOM 603 N CYS A 829 2.206 -40.130 14.951 1.00 30.32 N ATOM 604 CA CYS A 829 2.307 -40.068 16.399 1.00 2.44 C ATOM 605 C CYS A 829 2.715 -38.646 16.791 1.00 30.03 C ATOM 606 O CYS A 829 2.232 -38.110 17.788 1.00 62.51 O ATOM 607 CB CYS A 829 3.284 -41.112 16.944 1.00 73.11 C ATOM 608 SG CYS A 829 2.417 -42.702 17.206 1.00 30.31 S ATOM 0 H CYS A 829 3.089 -40.005 14.456 1.00 30.32 H new ATOM 0 HA CYS A 829 1.340 -40.304 16.844 1.00 2.44 H new ATOM 0 HB2 CYS A 829 4.110 -41.249 16.246 1.00 73.11 H new ATOM 0 HB3 CYS A 829 3.715 -40.764 17.883 1.00 73.11 H new ATOM 0 HG CYS A 829 3.255 -43.583 17.667 1.00 30.31 H new ATOM 614 N HIS A 830 3.600 -38.075 15.987 1.00 73.30 N ATOM 615 CA HIS A 830 4.078 -36.726 16.237 1.00 32.23 C ATOM 616 C HIS A 830 3.993 -35.904 14.950 1.00 75.34 C ATOM 617 O HIS A 830 4.376 -36.377 13.881 1.00 52.14 O ATOM 618 CB HIS A 830 5.487 -36.751 16.833 1.00 71.13 C ATOM 619 CG HIS A 830 6.307 -35.522 16.522 1.00 52.44 C ATOM 620 ND1 HIS A 830 7.659 -35.576 16.231 1.00 11.01 N ATOM 621 CD2 HIS A 830 5.952 -34.206 16.458 1.00 73.32 C ATOM 622 CE1 HIS A 830 8.088 -34.343 16.005 1.00 30.03 C ATOM 623 NE2 HIS A 830 7.029 -33.496 16.147 1.00 54.52 N ATOM 0 H HIS A 830 3.999 -38.522 15.162 1.00 73.30 H new ATOM 0 HA HIS A 830 3.441 -36.242 16.978 1.00 32.23 H new ATOM 0 HB2 HIS A 830 5.411 -36.860 17.915 1.00 71.13 H new ATOM 0 HB3 HIS A 830 6.013 -37.630 16.460 1.00 71.13 H new ATOM 0 HD1 HIS A 830 8.228 -36.422 16.196 1.00 11.01 H new ATOM 0 HD2 HIS A 830 4.962 -33.810 16.631 1.00 73.32 H new ATOM 0 HE1 HIS A 830 9.099 -34.059 15.753 1.00 30.03 H new ATOM 631 N TYR A 831 3.488 -34.688 15.094 1.00 34.04 N ATOM 632 CA TYR A 831 3.347 -33.796 13.956 1.00 1.32 C ATOM 633 C TYR A 831 4.557 -32.866 13.835 1.00 35.44 C ATOM 634 O TYR A 831 4.966 -32.244 14.814 1.00 14.31 O ATOM 635 CB TYR A 831 2.099 -32.955 14.231 1.00 34.20 C ATOM 636 CG TYR A 831 1.212 -32.738 13.003 1.00 33.43 C ATOM 637 CD1 TYR A 831 0.355 -33.737 12.586 1.00 63.04 C ATOM 638 CD2 TYR A 831 1.268 -31.544 12.313 1.00 20.55 C ATOM 639 CE1 TYR A 831 -0.479 -33.533 11.430 1.00 34.01 C ATOM 640 CE2 TYR A 831 0.433 -31.341 11.158 1.00 43.50 C ATOM 641 CZ TYR A 831 -0.399 -32.345 10.773 1.00 12.23 C ATOM 642 OH TYR A 831 -1.188 -32.152 9.682 1.00 65.20 O ATOM 0 H TYR A 831 3.171 -34.299 15.982 1.00 34.04 H new ATOM 0 HA TYR A 831 3.272 -34.365 13.030 1.00 1.32 H new ATOM 0 HB2 TYR A 831 1.511 -33.440 15.010 1.00 34.20 H new ATOM 0 HB3 TYR A 831 2.406 -31.985 14.621 1.00 34.20 H new ATOM 0 HD1 TYR A 831 0.310 -34.671 13.127 1.00 63.04 H new ATOM 0 HD2 TYR A 831 1.938 -30.762 12.639 1.00 20.55 H new ATOM 0 HE1 TYR A 831 -1.153 -34.306 11.092 1.00 34.01 H new ATOM 0 HE2 TYR A 831 0.467 -30.411 10.609 1.00 43.50 H new ATOM 0 HH TYR A 831 -2.116 -32.023 9.968 1.00 65.20 H new ATOM 652 N THR A 832 5.095 -32.802 12.626 1.00 32.24 N ATOM 653 CA THR A 832 6.249 -31.959 12.365 1.00 62.41 C ATOM 654 C THR A 832 6.129 -31.302 10.989 1.00 54.12 C ATOM 655 O THR A 832 5.119 -31.466 10.305 1.00 44.42 O ATOM 656 CB THR A 832 7.506 -32.818 12.520 1.00 1.22 C ATOM 657 OG1 THR A 832 7.218 -33.657 13.635 1.00 74.53 O ATOM 658 CG2 THR A 832 8.720 -32.003 12.972 1.00 14.20 C ATOM 0 H THR A 832 4.753 -33.320 11.817 1.00 32.24 H new ATOM 0 HA THR A 832 6.308 -31.137 13.079 1.00 62.41 H new ATOM 0 HB THR A 832 7.729 -33.308 11.572 1.00 1.22 H new ATOM 0 HG1 THR A 832 6.933 -33.106 14.394 1.00 74.53 H new ATOM 0 HG21 THR A 832 9.585 -32.660 13.066 1.00 14.20 H new ATOM 0 HG22 THR A 832 8.932 -31.228 12.236 1.00 14.20 H new ATOM 0 HG23 THR A 832 8.509 -31.540 13.936 1.00 14.20 H new ATOM 666 N VAL A 833 7.172 -30.572 10.624 1.00 41.31 N ATOM 667 CA VAL A 833 7.196 -29.889 9.342 1.00 51.44 C ATOM 668 C VAL A 833 8.644 -29.759 8.864 1.00 12.15 C ATOM 669 O VAL A 833 9.572 -29.791 9.671 1.00 61.11 O ATOM 670 CB VAL A 833 6.480 -28.541 9.453 1.00 3.12 C ATOM 671 CG1 VAL A 833 6.251 -27.926 8.071 1.00 0.33 C ATOM 672 CG2 VAL A 833 5.162 -28.682 10.216 1.00 13.24 C ATOM 0 H VAL A 833 8.007 -30.438 11.194 1.00 41.31 H new ATOM 0 HA VAL A 833 6.657 -30.468 8.592 1.00 51.44 H new ATOM 0 HB VAL A 833 7.123 -27.866 10.017 1.00 3.12 H new ATOM 0 HG11 VAL A 833 5.741 -26.969 8.179 1.00 0.33 H new ATOM 0 HG12 VAL A 833 7.211 -27.772 7.578 1.00 0.33 H new ATOM 0 HG13 VAL A 833 5.638 -28.598 7.471 1.00 0.33 H new ATOM 0 HG21 VAL A 833 4.673 -27.710 10.281 1.00 13.24 H new ATOM 0 HG22 VAL A 833 4.511 -29.381 9.691 1.00 13.24 H new ATOM 0 HG23 VAL A 833 5.361 -29.055 11.220 1.00 13.24 H new ATOM 682 N LEU A 834 8.791 -29.615 7.556 1.00 63.13 N ATOM 683 CA LEU A 834 10.111 -29.480 6.962 1.00 75.44 C ATOM 684 C LEU A 834 10.159 -28.203 6.121 1.00 14.10 C ATOM 685 O LEU A 834 9.192 -27.443 6.084 1.00 73.54 O ATOM 686 CB LEU A 834 10.478 -30.744 6.181 1.00 23.14 C ATOM 687 CG LEU A 834 9.797 -32.036 6.637 1.00 54.10 C ATOM 688 CD1 LEU A 834 9.923 -33.127 5.573 1.00 60.45 C ATOM 689 CD2 LEU A 834 10.338 -32.493 7.993 1.00 13.53 C ATOM 0 H LEU A 834 8.019 -29.589 6.890 1.00 63.13 H new ATOM 0 HA LEU A 834 10.870 -29.380 7.738 1.00 75.44 H new ATOM 0 HB2 LEU A 834 10.237 -30.581 5.131 1.00 23.14 H new ATOM 0 HB3 LEU A 834 11.557 -30.884 6.242 1.00 23.14 H new ATOM 0 HG LEU A 834 8.734 -31.834 6.767 1.00 54.10 H new ATOM 0 HD11 LEU A 834 9.431 -34.035 5.922 1.00 60.45 H new ATOM 0 HD12 LEU A 834 9.451 -32.791 4.650 1.00 60.45 H new ATOM 0 HD13 LEU A 834 10.977 -33.334 5.388 1.00 60.45 H new ATOM 0 HD21 LEU A 834 9.837 -33.413 8.293 1.00 13.53 H new ATOM 0 HD22 LEU A 834 11.410 -32.673 7.915 1.00 13.53 H new ATOM 0 HD23 LEU A 834 10.153 -31.719 8.738 1.00 13.53 H new ATOM 701 N GLY A 835 11.294 -28.005 5.467 1.00 32.23 N ATOM 702 CA GLY A 835 11.481 -26.833 4.630 1.00 54.34 C ATOM 703 C GLY A 835 12.224 -25.730 5.387 1.00 70.51 C ATOM 704 O GLY A 835 11.918 -25.454 6.546 1.00 41.33 O ATOM 0 H GLY A 835 12.094 -28.637 5.500 1.00 32.23 H new ATOM 0 HA2 GLY A 835 12.042 -27.106 3.736 1.00 54.34 H new ATOM 0 HA3 GLY A 835 10.512 -26.461 4.297 1.00 54.34 H new ATOM 708 N ASP A 836 13.186 -25.131 4.701 1.00 23.22 N ATOM 709 CA ASP A 836 13.976 -24.065 5.295 1.00 72.43 C ATOM 710 C ASP A 836 13.067 -22.873 5.601 1.00 70.21 C ATOM 711 O ASP A 836 13.347 -22.092 6.508 1.00 11.35 O ATOM 712 CB ASP A 836 15.070 -23.592 4.336 1.00 3.44 C ATOM 713 CG ASP A 836 15.859 -24.710 3.652 1.00 4.15 C ATOM 714 OD1 ASP A 836 16.726 -24.453 2.804 1.00 40.13 O ATOM 715 OD2 ASP A 836 15.550 -25.904 4.028 1.00 34.35 O ATOM 0 H ASP A 836 13.437 -25.363 3.740 1.00 23.22 H new ATOM 0 HA ASP A 836 14.436 -24.451 6.205 1.00 72.43 H new ATOM 0 HB2 ASP A 836 14.614 -22.968 3.568 1.00 3.44 H new ATOM 0 HB3 ASP A 836 15.767 -22.961 4.887 1.00 3.44 H new ATOM 721 N ALA A 837 11.997 -22.771 4.826 1.00 20.41 N ATOM 722 CA ALA A 837 11.045 -21.688 5.003 1.00 3.31 C ATOM 723 C ALA A 837 10.456 -21.757 6.413 1.00 23.24 C ATOM 724 O ALA A 837 10.115 -20.731 6.999 1.00 55.35 O ATOM 725 CB ALA A 837 9.970 -21.770 3.918 1.00 43.25 C ATOM 0 H ALA A 837 11.768 -23.421 4.074 1.00 20.41 H new ATOM 0 HA ALA A 837 11.540 -20.722 4.899 1.00 3.31 H new ATOM 0 HB1 ALA A 837 9.256 -20.957 4.051 1.00 43.25 H new ATOM 0 HB2 ALA A 837 10.437 -21.686 2.936 1.00 43.25 H new ATOM 0 HB3 ALA A 837 9.450 -22.725 3.992 1.00 43.25 H new ATOM 731 N PHE A 838 10.356 -22.978 6.919 1.00 53.14 N ATOM 732 CA PHE A 838 9.814 -23.195 8.249 1.00 11.23 C ATOM 733 C PHE A 838 10.872 -22.931 9.322 1.00 5.11 C ATOM 734 O PHE A 838 10.550 -22.476 10.419 1.00 62.34 O ATOM 735 CB PHE A 838 9.384 -24.661 8.324 1.00 61.24 C ATOM 736 CG PHE A 838 9.074 -25.148 9.741 1.00 55.43 C ATOM 737 CD1 PHE A 838 8.581 -24.280 10.665 1.00 51.22 C ATOM 738 CD2 PHE A 838 9.290 -26.448 10.076 1.00 0.32 C ATOM 739 CE1 PHE A 838 8.293 -24.731 11.980 1.00 74.21 C ATOM 740 CE2 PHE A 838 9.002 -26.899 11.391 1.00 33.12 C ATOM 741 CZ PHE A 838 8.509 -26.031 12.315 1.00 21.43 C ATOM 0 H PHE A 838 10.641 -23.827 6.431 1.00 53.14 H new ATOM 0 HA PHE A 838 8.979 -22.517 8.425 1.00 11.23 H new ATOM 0 HB2 PHE A 838 8.501 -24.802 7.701 1.00 61.24 H new ATOM 0 HB3 PHE A 838 10.174 -25.282 7.902 1.00 61.24 H new ATOM 0 HD1 PHE A 838 8.409 -23.248 10.398 1.00 51.22 H new ATOM 0 HD2 PHE A 838 9.681 -27.137 9.342 1.00 0.32 H new ATOM 0 HE1 PHE A 838 7.902 -24.042 12.714 1.00 74.21 H new ATOM 0 HE2 PHE A 838 9.174 -27.931 11.658 1.00 33.12 H new ATOM 0 HZ PHE A 838 8.289 -26.374 13.315 1.00 21.43 H new ATOM 751 N LYS A 839 12.114 -23.227 8.968 1.00 23.42 N ATOM 752 CA LYS A 839 13.222 -23.028 9.887 1.00 42.11 C ATOM 753 C LYS A 839 13.292 -21.552 10.282 1.00 13.53 C ATOM 754 O LYS A 839 13.509 -21.227 11.449 1.00 70.13 O ATOM 755 CB LYS A 839 14.522 -23.565 9.284 1.00 52.12 C ATOM 756 CG LYS A 839 14.395 -25.051 8.942 1.00 54.34 C ATOM 757 CD LYS A 839 15.772 -25.706 8.822 1.00 41.32 C ATOM 758 CE LYS A 839 16.758 -24.781 8.104 1.00 30.53 C ATOM 759 NZ LYS A 839 17.997 -25.513 7.760 1.00 65.32 N ATOM 0 H LYS A 839 12.378 -23.603 8.057 1.00 23.42 H new ATOM 0 HA LYS A 839 13.064 -23.597 10.803 1.00 42.11 H new ATOM 0 HB2 LYS A 839 14.770 -23.001 8.385 1.00 52.12 H new ATOM 0 HB3 LYS A 839 15.341 -23.419 9.988 1.00 52.12 H new ATOM 0 HG2 LYS A 839 13.814 -25.557 9.713 1.00 54.34 H new ATOM 0 HG3 LYS A 839 13.850 -25.167 8.005 1.00 54.34 H new ATOM 0 HD2 LYS A 839 16.152 -25.948 9.815 1.00 41.32 H new ATOM 0 HD3 LYS A 839 15.686 -26.646 8.276 1.00 41.32 H new ATOM 0 HE2 LYS A 839 16.300 -24.384 7.198 1.00 30.53 H new ATOM 0 HE3 LYS A 839 16.997 -23.929 8.741 1.00 30.53 H new ATOM 0 HZ1 LYS A 839 18.655 -24.872 7.274 1.00 65.32 H new ATOM 0 HZ2 LYS A 839 18.441 -25.871 8.629 1.00 65.32 H new ATOM 0 HZ3 LYS A 839 17.766 -26.311 7.135 1.00 65.32 H new ATOM 772 N GLU A 840 13.103 -20.696 9.288 1.00 21.22 N ATOM 773 CA GLU A 840 13.142 -19.262 9.518 1.00 53.15 C ATOM 774 C GLU A 840 11.777 -18.764 9.997 1.00 33.13 C ATOM 775 O GLU A 840 11.637 -17.607 10.391 1.00 62.12 O ATOM 776 CB GLU A 840 13.585 -18.517 8.257 1.00 52.21 C ATOM 777 CG GLU A 840 12.595 -18.740 7.112 1.00 50.43 C ATOM 778 CD GLU A 840 12.568 -17.536 6.168 1.00 3.40 C ATOM 779 OE1 GLU A 840 11.501 -17.180 5.647 1.00 13.43 O ATOM 780 OE2 GLU A 840 13.709 -16.962 5.983 1.00 30.23 O ATOM 0 H GLU A 840 12.922 -20.968 8.322 1.00 21.22 H new ATOM 0 HA GLU A 840 13.876 -19.058 10.298 1.00 53.15 H new ATOM 0 HB2 GLU A 840 13.666 -17.451 8.470 1.00 52.21 H new ATOM 0 HB3 GLU A 840 14.576 -18.859 7.958 1.00 52.21 H new ATOM 0 HG2 GLU A 840 12.872 -19.636 6.556 1.00 50.43 H new ATOM 0 HG3 GLU A 840 11.598 -18.912 7.517 1.00 50.43 H new ATOM 788 N CYS A 841 10.804 -19.663 9.949 1.00 43.32 N ATOM 789 CA CYS A 841 9.455 -19.329 10.374 1.00 63.35 C ATOM 790 C CYS A 841 9.410 -19.366 11.902 1.00 22.23 C ATOM 791 O CYS A 841 8.598 -18.679 12.520 1.00 73.34 O ATOM 792 CB CYS A 841 8.418 -20.265 9.749 1.00 22.02 C ATOM 793 SG CYS A 841 6.787 -19.438 9.686 1.00 40.03 S ATOM 0 H CYS A 841 10.923 -20.622 9.622 1.00 43.32 H new ATOM 0 HA CYS A 841 9.199 -18.327 10.029 1.00 63.35 H new ATOM 0 HB2 CYS A 841 8.730 -20.548 8.744 1.00 22.02 H new ATOM 0 HB3 CYS A 841 8.347 -21.184 10.331 1.00 22.02 H new ATOM 0 HG CYS A 841 5.866 -20.315 9.415 1.00 40.03 H new ATOM 799 N PHE A 842 10.293 -20.175 12.469 1.00 3.23 N ATOM 800 CA PHE A 842 10.364 -20.310 13.914 1.00 25.23 C ATOM 801 C PHE A 842 11.813 -20.237 14.401 1.00 1.22 C ATOM 802 O PHE A 842 12.715 -19.909 13.631 1.00 14.34 O ATOM 803 CB PHE A 842 9.791 -21.685 14.264 1.00 54.25 C ATOM 804 CG PHE A 842 10.846 -22.784 14.397 1.00 23.20 C ATOM 805 CD1 PHE A 842 11.636 -23.101 13.336 1.00 1.11 C ATOM 806 CD2 PHE A 842 10.995 -23.445 15.577 1.00 52.35 C ATOM 807 CE1 PHE A 842 12.616 -24.121 13.460 1.00 72.30 C ATOM 808 CE2 PHE A 842 11.975 -24.465 15.700 1.00 35.14 C ATOM 809 CZ PHE A 842 12.764 -24.782 14.639 1.00 4.15 C ATOM 0 H PHE A 842 10.965 -20.744 11.954 1.00 3.23 H new ATOM 0 HA PHE A 842 9.807 -19.503 14.390 1.00 25.23 H new ATOM 0 HB2 PHE A 842 9.240 -21.609 15.201 1.00 54.25 H new ATOM 0 HB3 PHE A 842 9.074 -21.975 13.495 1.00 54.25 H new ATOM 0 HD1 PHE A 842 11.518 -22.577 12.399 1.00 1.11 H new ATOM 0 HD2 PHE A 842 10.368 -23.194 16.420 1.00 52.35 H new ATOM 0 HE1 PHE A 842 13.244 -24.372 12.618 1.00 72.30 H new ATOM 0 HE2 PHE A 842 12.094 -24.989 16.637 1.00 35.14 H new ATOM 0 HZ PHE A 842 13.508 -25.559 14.733 1.00 4.15 H new ATOM 819 N VAL A 843 11.992 -20.548 15.677 1.00 55.33 N ATOM 820 CA VAL A 843 13.315 -20.521 16.275 1.00 22.24 C ATOM 821 C VAL A 843 13.367 -21.520 17.433 1.00 72.40 C ATOM 822 O VAL A 843 12.329 -21.941 17.941 1.00 13.14 O ATOM 823 CB VAL A 843 13.669 -19.095 16.701 1.00 54.41 C ATOM 824 CG1 VAL A 843 13.360 -18.097 15.583 1.00 42.21 C ATOM 825 CG2 VAL A 843 12.943 -18.712 17.993 1.00 63.33 C ATOM 0 H VAL A 843 11.242 -20.820 16.313 1.00 55.33 H new ATOM 0 HA VAL A 843 14.068 -20.825 15.548 1.00 22.24 H new ATOM 0 HB VAL A 843 14.741 -19.060 16.896 1.00 54.41 H new ATOM 0 HG11 VAL A 843 13.621 -17.091 15.911 1.00 42.21 H new ATOM 0 HG12 VAL A 843 13.941 -18.352 14.697 1.00 42.21 H new ATOM 0 HG13 VAL A 843 12.297 -18.137 15.343 1.00 42.21 H new ATOM 0 HG21 VAL A 843 13.212 -17.694 18.274 1.00 63.33 H new ATOM 0 HG22 VAL A 843 11.866 -18.773 17.837 1.00 63.33 H new ATOM 0 HG23 VAL A 843 13.233 -19.397 18.790 1.00 63.33 H new ATOM 835 N SER A 844 14.586 -21.871 17.816 1.00 73.43 N ATOM 836 CA SER A 844 14.786 -22.813 18.904 1.00 63.32 C ATOM 837 C SER A 844 15.883 -22.304 19.841 1.00 11.03 C ATOM 838 O SER A 844 16.924 -21.832 19.386 1.00 33.04 O ATOM 839 CB SER A 844 15.146 -24.202 18.371 1.00 10.31 C ATOM 840 OG SER A 844 16.547 -24.343 18.152 1.00 20.14 O ATOM 0 H SER A 844 15.445 -21.520 17.392 1.00 73.43 H new ATOM 0 HA SER A 844 13.852 -22.897 19.460 1.00 63.32 H new ATOM 0 HB2 SER A 844 14.812 -24.960 19.079 1.00 10.31 H new ATOM 0 HB3 SER A 844 14.613 -24.381 17.437 1.00 10.31 H new ATOM 0 HG SER A 844 16.752 -25.276 17.934 1.00 20.14 H new ATOM 846 N ARG A 845 15.612 -22.417 21.133 1.00 11.12 N ATOM 847 CA ARG A 845 16.563 -21.974 22.139 1.00 54.32 C ATOM 848 C ARG A 845 16.817 -23.088 23.156 1.00 2.21 C ATOM 849 O ARG A 845 15.953 -23.932 23.387 1.00 60.23 O ATOM 850 CB ARG A 845 16.051 -20.731 22.871 1.00 70.43 C ATOM 851 CG ARG A 845 15.162 -19.884 21.958 1.00 63.23 C ATOM 852 CD ARG A 845 15.970 -19.294 20.800 1.00 21.11 C ATOM 853 NE ARG A 845 16.495 -17.963 21.176 1.00 3.44 N ATOM 854 CZ ARG A 845 15.720 -16.887 21.428 1.00 52.40 C ATOM 855 NH1 ARG A 845 14.375 -16.977 21.345 1.00 3.42 N ATOM 856 NH2 ARG A 845 16.296 -15.745 21.756 1.00 72.10 N ATOM 0 H ARG A 845 14.748 -22.809 21.507 1.00 11.12 H new ATOM 0 HA ARG A 845 17.493 -21.724 21.629 1.00 54.32 H new ATOM 0 HB2 ARG A 845 15.489 -21.031 23.755 1.00 70.43 H new ATOM 0 HB3 ARG A 845 16.895 -20.135 23.217 1.00 70.43 H new ATOM 0 HG2 ARG A 845 14.350 -20.496 21.565 1.00 63.23 H new ATOM 0 HG3 ARG A 845 14.705 -19.080 22.534 1.00 63.23 H new ATOM 0 HD2 ARG A 845 16.794 -19.960 20.544 1.00 21.11 H new ATOM 0 HD3 ARG A 845 15.342 -19.209 19.913 1.00 21.11 H new ATOM 0 HE ARG A 845 17.506 -17.851 21.249 1.00 3.44 H new ATOM 0 HH11 ARG A 845 13.938 -17.863 21.090 1.00 3.42 H new ATOM 0 HH12 ARG A 845 13.796 -16.159 21.537 1.00 3.42 H new ATOM 0 HH21 ARG A 845 17.312 -15.685 21.816 1.00 72.10 H new ATOM 0 HH22 ARG A 845 15.724 -14.923 21.949 1.00 72.10 H new ATOM 869 N PRO A 846 18.039 -23.053 23.753 1.00 73.11 N ATOM 870 CA PRO A 846 18.418 -24.049 24.740 1.00 30.41 C ATOM 871 C PRO A 846 17.719 -23.791 26.077 1.00 43.14 C ATOM 872 O PRO A 846 16.731 -23.061 26.133 1.00 33.23 O ATOM 873 CB PRO A 846 19.932 -23.955 24.833 1.00 1.43 C ATOM 874 CG PRO A 846 20.302 -22.602 24.246 1.00 31.03 C ATOM 875 CD PRO A 846 19.087 -22.068 23.505 1.00 64.13 C ATOM 0 HA PRO A 846 18.112 -25.057 24.459 1.00 30.41 H new ATOM 0 HB2 PRO A 846 20.266 -24.036 25.867 1.00 1.43 H new ATOM 0 HB3 PRO A 846 20.408 -24.764 24.280 1.00 1.43 H new ATOM 0 HG2 PRO A 846 20.601 -21.912 25.035 1.00 31.03 H new ATOM 0 HG3 PRO A 846 21.150 -22.699 23.568 1.00 31.03 H new ATOM 0 HD2 PRO A 846 18.800 -21.083 23.873 1.00 64.13 H new ATOM 0 HD3 PRO A 846 19.288 -21.963 22.439 1.00 64.13 H new ATOM 1029 N PHE A 856 8.347 -37.276 24.966 1.00 34.44 N ATOM 1030 CA PHE A 856 9.760 -37.176 24.643 1.00 55.45 C ATOM 1031 C PHE A 856 10.467 -36.190 25.575 1.00 51.02 C ATOM 1032 O PHE A 856 9.838 -35.596 26.449 1.00 34.42 O ATOM 1033 CB PHE A 856 9.853 -36.657 23.206 1.00 22.50 C ATOM 1034 CG PHE A 856 9.277 -37.614 22.161 1.00 74.34 C ATOM 1035 CD1 PHE A 856 9.444 -38.957 22.301 1.00 3.44 C ATOM 1036 CD2 PHE A 856 8.596 -37.123 21.090 1.00 4.45 C ATOM 1037 CE1 PHE A 856 8.909 -39.845 21.331 1.00 3.41 C ATOM 1038 CE2 PHE A 856 8.061 -38.011 20.120 1.00 3.41 C ATOM 1039 CZ PHE A 856 8.229 -39.353 20.261 1.00 41.11 C ATOM 0 HA PHE A 856 10.238 -38.149 24.757 1.00 55.45 H new ATOM 0 HB2 PHE A 856 9.328 -35.704 23.140 1.00 22.50 H new ATOM 0 HB3 PHE A 856 10.899 -36.462 22.968 1.00 22.50 H new ATOM 0 HD1 PHE A 856 9.984 -39.348 23.151 1.00 3.44 H new ATOM 0 HD2 PHE A 856 8.462 -36.057 20.978 1.00 4.45 H new ATOM 0 HE1 PHE A 856 9.042 -40.911 21.443 1.00 3.41 H new ATOM 0 HE2 PHE A 856 7.521 -37.621 19.270 1.00 3.41 H new ATOM 0 HZ PHE A 856 7.822 -40.028 19.523 1.00 41.11 H new ATOM 1049 N GLU A 857 11.766 -36.046 25.356 1.00 33.13 N ATOM 1050 CA GLU A 857 12.565 -35.143 26.166 1.00 43.40 C ATOM 1051 C GLU A 857 12.780 -33.819 25.429 1.00 1.14 C ATOM 1052 O GLU A 857 13.084 -33.810 24.238 1.00 45.13 O ATOM 1053 CB GLU A 857 13.902 -35.783 26.544 1.00 44.10 C ATOM 1054 CG GLU A 857 13.757 -37.297 26.712 1.00 3.34 C ATOM 1055 CD GLU A 857 15.069 -37.924 27.189 1.00 42.42 C ATOM 1056 OE1 GLU A 857 15.975 -38.159 26.375 1.00 31.44 O ATOM 1057 OE2 GLU A 857 15.130 -38.166 28.454 1.00 12.34 O ATOM 0 H GLU A 857 12.285 -36.540 24.629 1.00 33.13 H new ATOM 0 HA GLU A 857 12.023 -34.939 27.090 1.00 43.40 H new ATOM 0 HB2 GLU A 857 14.643 -35.568 25.774 1.00 44.10 H new ATOM 0 HB3 GLU A 857 14.270 -35.344 27.471 1.00 44.10 H new ATOM 0 HG2 GLU A 857 12.965 -37.513 27.429 1.00 3.34 H new ATOM 0 HG3 GLU A 857 13.459 -37.745 25.764 1.00 3.34 H new ATOM 1065 N LYS A 858 12.613 -32.733 26.169 1.00 1.35 N ATOM 1066 CA LYS A 858 12.785 -31.406 25.601 1.00 31.45 C ATOM 1067 C LYS A 858 13.849 -30.649 26.398 1.00 21.12 C ATOM 1068 O LYS A 858 13.795 -30.603 27.626 1.00 14.11 O ATOM 1069 CB LYS A 858 11.441 -30.679 25.524 1.00 43.34 C ATOM 1070 CG LYS A 858 10.649 -30.850 26.821 1.00 32.41 C ATOM 1071 CD LYS A 858 9.229 -30.299 26.674 1.00 42.14 C ATOM 1072 CE LYS A 858 8.293 -31.349 26.072 1.00 40.22 C ATOM 1073 NZ LYS A 858 6.893 -30.870 26.098 1.00 72.15 N ATOM 0 H LYS A 858 12.360 -32.744 27.157 1.00 1.35 H new ATOM 0 HA LYS A 858 13.144 -31.474 24.574 1.00 31.45 H new ATOM 0 HB2 LYS A 858 11.608 -29.619 25.333 1.00 43.34 H new ATOM 0 HB3 LYS A 858 10.861 -31.067 24.686 1.00 43.34 H new ATOM 0 HG2 LYS A 858 10.607 -31.906 27.089 1.00 32.41 H new ATOM 0 HG3 LYS A 858 11.160 -30.335 27.634 1.00 32.41 H new ATOM 0 HD2 LYS A 858 8.853 -29.988 27.649 1.00 42.14 H new ATOM 0 HD3 LYS A 858 9.243 -29.413 26.040 1.00 42.14 H new ATOM 0 HE2 LYS A 858 8.591 -31.565 25.046 1.00 40.22 H new ATOM 0 HE3 LYS A 858 8.375 -32.281 26.631 1.00 40.22 H new ATOM 0 HZ1 LYS A 858 6.375 -31.268 25.289 1.00 72.15 H new ATOM 0 HZ2 LYS A 858 6.439 -31.173 26.983 1.00 72.15 H new ATOM 0 HZ3 LYS A 858 6.880 -29.832 26.040 1.00 72.15 H new ATOM 1086 N ARG A 859 14.792 -30.074 25.667 1.00 65.12 N ATOM 1087 CA ARG A 859 15.868 -29.321 26.290 1.00 73.12 C ATOM 1088 C ARG A 859 16.038 -27.967 25.598 1.00 72.21 C ATOM 1089 O ARG A 859 17.058 -27.301 25.771 1.00 74.41 O ATOM 1090 CB ARG A 859 17.189 -30.090 26.223 1.00 11.20 C ATOM 1091 CG ARG A 859 16.980 -31.569 26.554 1.00 1.25 C ATOM 1092 CD ARG A 859 18.295 -32.227 26.978 1.00 11.45 C ATOM 1093 NE ARG A 859 18.035 -33.589 27.496 1.00 4.43 N ATOM 1094 CZ ARG A 859 19.003 -34.474 27.814 1.00 22.44 C ATOM 1095 NH1 ARG A 859 20.305 -34.148 27.670 1.00 62.10 N ATOM 1096 NH2 ARG A 859 18.657 -35.665 28.269 1.00 43.53 N ATOM 0 H ARG A 859 14.834 -30.114 24.649 1.00 65.12 H new ATOM 0 HA ARG A 859 15.603 -29.167 27.336 1.00 73.12 H new ATOM 0 HB2 ARG A 859 17.620 -29.994 25.226 1.00 11.20 H new ATOM 0 HB3 ARG A 859 17.903 -29.655 26.922 1.00 11.20 H new ATOM 0 HG2 ARG A 859 16.246 -31.666 27.354 1.00 1.25 H new ATOM 0 HG3 ARG A 859 16.574 -32.086 25.685 1.00 1.25 H new ATOM 0 HD2 ARG A 859 18.977 -32.276 26.129 1.00 11.45 H new ATOM 0 HD3 ARG A 859 18.782 -31.624 27.744 1.00 11.45 H new ATOM 0 HE ARG A 859 17.064 -33.876 27.620 1.00 4.43 H new ATOM 0 HH11 ARG A 859 20.564 -33.226 27.318 1.00 62.10 H new ATOM 0 HH12 ARG A 859 21.030 -34.823 27.913 1.00 62.10 H new ATOM 0 HH21 ARG A 859 17.671 -35.904 28.375 1.00 43.53 H new ATOM 0 HH22 ARG A 859 19.376 -36.346 28.514 1.00 43.53 H new ATOM 1109 N ALA A 860 15.023 -27.600 24.829 1.00 44.02 N ATOM 1110 CA ALA A 860 15.048 -26.337 24.110 1.00 31.41 C ATOM 1111 C ALA A 860 13.614 -25.904 23.800 1.00 33.11 C ATOM 1112 O ALA A 860 12.773 -26.731 23.451 1.00 63.54 O ATOM 1113 CB ALA A 860 15.898 -26.485 22.847 1.00 62.32 C ATOM 0 H ALA A 860 14.179 -28.155 24.688 1.00 44.02 H new ATOM 0 HA ALA A 860 15.504 -25.557 24.720 1.00 31.41 H new ATOM 0 HB1 ALA A 860 15.917 -25.538 22.308 1.00 62.32 H new ATOM 0 HB2 ALA A 860 16.914 -26.765 23.123 1.00 62.32 H new ATOM 0 HB3 ALA A 860 15.469 -27.257 22.208 1.00 62.32 H new ATOM 1119 N LYS A 861 13.378 -24.608 23.939 1.00 11.23 N ATOM 1120 CA LYS A 861 12.060 -24.055 23.678 1.00 12.44 C ATOM 1121 C LYS A 861 12.038 -23.438 22.279 1.00 43.45 C ATOM 1122 O LYS A 861 13.002 -22.794 21.865 1.00 73.20 O ATOM 1123 CB LYS A 861 11.659 -23.079 24.787 1.00 44.22 C ATOM 1124 CG LYS A 861 11.287 -23.827 26.068 1.00 23.43 C ATOM 1125 CD LYS A 861 12.529 -24.119 26.913 1.00 1.53 C ATOM 1126 CE LYS A 861 12.828 -22.959 27.866 1.00 32.54 C ATOM 1127 NZ LYS A 861 13.587 -21.898 27.169 1.00 2.31 N ATOM 0 H LYS A 861 14.077 -23.925 24.229 1.00 11.23 H new ATOM 0 HA LYS A 861 11.307 -24.843 23.691 1.00 12.44 H new ATOM 0 HB2 LYS A 861 12.482 -22.393 24.988 1.00 44.22 H new ATOM 0 HB3 LYS A 861 10.814 -22.475 24.456 1.00 44.22 H new ATOM 0 HG2 LYS A 861 10.580 -23.234 26.648 1.00 23.43 H new ATOM 0 HG3 LYS A 861 10.787 -24.762 25.815 1.00 23.43 H new ATOM 0 HD2 LYS A 861 12.377 -25.035 27.485 1.00 1.53 H new ATOM 0 HD3 LYS A 861 13.386 -24.289 26.261 1.00 1.53 H new ATOM 0 HE2 LYS A 861 11.895 -22.551 28.255 1.00 32.54 H new ATOM 0 HE3 LYS A 861 13.399 -23.321 28.721 1.00 32.54 H new ATOM 0 HZ1 LYS A 861 14.187 -21.394 27.853 1.00 2.31 H new ATOM 0 HZ2 LYS A 861 14.184 -22.325 26.433 1.00 2.31 H new ATOM 0 HZ3 LYS A 861 12.924 -21.227 26.731 1.00 2.31 H new ATOM 1140 N ILE A 862 10.929 -23.656 21.588 1.00 41.45 N ATOM 1141 CA ILE A 862 10.769 -23.129 20.243 1.00 64.03 C ATOM 1142 C ILE A 862 9.869 -21.893 20.287 1.00 34.12 C ATOM 1143 O ILE A 862 8.877 -21.869 21.014 1.00 34.52 O ATOM 1144 CB ILE A 862 10.269 -24.221 19.296 1.00 74.34 C ATOM 1145 CG1 ILE A 862 8.745 -24.347 19.361 1.00 62.51 C ATOM 1146 CG2 ILE A 862 10.967 -25.553 19.577 1.00 32.40 C ATOM 1147 CD1 ILE A 862 8.077 -23.484 18.289 1.00 61.11 C ATOM 0 H ILE A 862 10.132 -24.191 21.934 1.00 41.45 H new ATOM 0 HA ILE A 862 11.731 -22.808 19.843 1.00 64.03 H new ATOM 0 HB ILE A 862 10.525 -23.933 18.277 1.00 74.34 H new ATOM 0 HG12 ILE A 862 8.457 -25.389 19.225 1.00 62.51 H new ATOM 0 HG13 ILE A 862 8.393 -24.045 20.347 1.00 62.51 H new ATOM 0 HG21 ILE A 862 10.593 -26.312 18.890 1.00 32.40 H new ATOM 0 HG22 ILE A 862 12.042 -25.437 19.439 1.00 32.40 H new ATOM 0 HG23 ILE A 862 10.764 -25.861 20.603 1.00 32.40 H new ATOM 0 HD11 ILE A 862 6.995 -23.592 18.357 1.00 61.11 H new ATOM 0 HD12 ILE A 862 8.348 -22.439 18.442 1.00 61.11 H new ATOM 0 HD13 ILE A 862 8.412 -23.805 17.303 1.00 61.11 H new ATOM 1159 N PHE A 863 10.246 -20.896 19.500 1.00 23.34 N ATOM 1160 CA PHE A 863 9.485 -19.660 19.441 1.00 71.12 C ATOM 1161 C PHE A 863 9.430 -19.119 18.011 1.00 54.41 C ATOM 1162 O PHE A 863 10.329 -19.374 17.211 1.00 10.25 O ATOM 1163 CB PHE A 863 10.208 -18.646 20.330 1.00 72.41 C ATOM 1164 CG PHE A 863 10.611 -19.196 21.700 1.00 62.24 C ATOM 1165 CD1 PHE A 863 9.685 -19.299 22.691 1.00 64.04 C ATOM 1166 CD2 PHE A 863 11.895 -19.582 21.926 1.00 5.11 C ATOM 1167 CE1 PHE A 863 10.060 -19.809 23.962 1.00 73.23 C ATOM 1168 CE2 PHE A 863 12.270 -20.092 23.197 1.00 32.14 C ATOM 1169 CZ PHE A 863 11.344 -20.195 24.188 1.00 0.13 C ATOM 0 H PHE A 863 11.069 -20.919 18.898 1.00 23.34 H new ATOM 0 HA PHE A 863 8.462 -19.836 19.774 1.00 71.12 H new ATOM 0 HB2 PHE A 863 11.102 -18.297 19.813 1.00 72.41 H new ATOM 0 HB3 PHE A 863 9.563 -17.779 20.473 1.00 72.41 H new ATOM 0 HD1 PHE A 863 8.665 -18.993 22.511 1.00 64.04 H new ATOM 0 HD2 PHE A 863 12.630 -19.501 21.139 1.00 5.11 H new ATOM 0 HE1 PHE A 863 9.325 -19.890 24.749 1.00 73.23 H new ATOM 0 HE2 PHE A 863 13.290 -20.398 23.377 1.00 32.14 H new ATOM 0 HZ PHE A 863 11.629 -20.583 25.155 1.00 0.13 H new ATOM 1179 N CYS A 864 8.365 -18.381 17.732 1.00 11.13 N ATOM 1180 CA CYS A 864 8.181 -17.801 16.413 1.00 74.23 C ATOM 1181 C CYS A 864 9.362 -16.872 16.127 1.00 60.01 C ATOM 1182 O CYS A 864 9.801 -16.132 17.006 1.00 24.41 O ATOM 1183 CB CYS A 864 6.840 -17.072 16.297 1.00 23.34 C ATOM 1184 SG CYS A 864 5.555 -18.220 15.680 1.00 1.42 S ATOM 0 H CYS A 864 7.621 -18.172 18.397 1.00 11.13 H new ATOM 0 HA CYS A 864 8.155 -18.594 15.665 1.00 74.23 H new ATOM 0 HB2 CYS A 864 6.548 -16.674 17.269 1.00 23.34 H new ATOM 0 HB3 CYS A 864 6.936 -16.223 15.621 1.00 23.34 H new ATOM 0 HG CYS A 864 5.842 -19.432 16.051 1.00 1.42 H new ATOM 1190 N ALA A 865 9.843 -16.940 14.894 1.00 33.42 N ATOM 1191 CA ALA A 865 10.965 -16.114 14.482 1.00 72.44 C ATOM 1192 C ALA A 865 10.486 -14.675 14.282 1.00 44.05 C ATOM 1193 O ALA A 865 11.297 -13.753 14.206 1.00 13.43 O ATOM 1194 CB ALA A 865 11.593 -16.701 13.216 1.00 73.41 C ATOM 0 H ALA A 865 9.476 -17.554 14.167 1.00 33.42 H new ATOM 0 HA ALA A 865 11.736 -16.101 15.252 1.00 72.44 H new ATOM 0 HB1 ALA A 865 12.435 -16.082 12.907 1.00 73.41 H new ATOM 0 HB2 ALA A 865 11.943 -17.713 13.419 1.00 73.41 H new ATOM 0 HB3 ALA A 865 10.849 -16.727 12.419 1.00 73.41 H new ATOM 1200 N ARG A 866 9.172 -14.528 14.201 1.00 42.20 N ATOM 1201 CA ARG A 866 8.576 -13.216 14.011 1.00 23.21 C ATOM 1202 C ARG A 866 8.849 -12.328 15.227 1.00 73.30 C ATOM 1203 O ARG A 866 9.594 -12.713 16.126 1.00 22.15 O ATOM 1204 CB ARG A 866 7.065 -13.324 13.795 1.00 44.20 C ATOM 1205 CG ARG A 866 6.742 -14.291 12.654 1.00 22.25 C ATOM 1206 CD ARG A 866 6.669 -13.555 11.315 1.00 3.12 C ATOM 1207 NE ARG A 866 5.561 -12.574 11.336 1.00 31.54 N ATOM 1208 CZ ARG A 866 5.518 -11.464 10.569 1.00 34.35 C ATOM 1209 NH1 ARG A 866 6.523 -11.184 9.713 1.00 55.23 N ATOM 1210 NH2 ARG A 866 4.478 -10.657 10.670 1.00 61.10 N ATOM 0 H ARG A 866 8.503 -15.295 14.263 1.00 42.20 H new ATOM 0 HA ARG A 866 9.027 -12.772 13.124 1.00 23.21 H new ATOM 0 HB2 ARG A 866 6.586 -13.666 14.713 1.00 44.20 H new ATOM 0 HB3 ARG A 866 6.655 -12.340 13.569 1.00 44.20 H new ATOM 0 HG2 ARG A 866 7.505 -15.068 12.605 1.00 22.25 H new ATOM 0 HG3 ARG A 866 5.792 -14.788 12.852 1.00 22.25 H new ATOM 0 HD2 ARG A 866 7.613 -13.046 11.119 1.00 3.12 H new ATOM 0 HD3 ARG A 866 6.518 -14.269 10.506 1.00 3.12 H new ATOM 0 HE ARG A 866 4.781 -12.748 11.970 1.00 31.54 H new ATOM 0 HH11 ARG A 866 7.323 -11.813 9.642 1.00 55.23 H new ATOM 0 HH12 ARG A 866 6.483 -10.343 9.137 1.00 55.23 H new ATOM 0 HH21 ARG A 866 3.723 -10.877 11.320 1.00 61.10 H new ATOM 0 HH22 ARG A 866 4.429 -9.814 10.098 1.00 61.10 H new ATOM 1223 N GLN A 867 8.230 -11.157 15.215 1.00 54.01 N ATOM 1224 CA GLN A 867 8.396 -10.211 16.305 1.00 20.35 C ATOM 1225 C GLN A 867 8.258 -10.924 17.652 1.00 31.41 C ATOM 1226 O GLN A 867 9.043 -10.685 18.569 1.00 73.25 O ATOM 1227 CB GLN A 867 7.396 -9.060 16.190 1.00 53.51 C ATOM 1228 CG GLN A 867 7.970 -7.773 16.786 1.00 12.31 C ATOM 1229 CD GLN A 867 7.158 -6.554 16.343 1.00 4.50 C ATOM 1230 OE1 GLN A 867 6.108 -6.663 15.732 1.00 31.34 O ATOM 1231 NE2 GLN A 867 7.702 -5.389 16.684 1.00 45.33 N ATOM 0 H GLN A 867 7.612 -10.842 14.467 1.00 54.01 H new ATOM 0 HA GLN A 867 9.398 -9.786 16.241 1.00 20.35 H new ATOM 0 HB2 GLN A 867 7.142 -8.898 15.143 1.00 53.51 H new ATOM 0 HB3 GLN A 867 6.472 -9.323 16.705 1.00 53.51 H new ATOM 0 HG2 GLN A 867 7.969 -7.840 17.874 1.00 12.31 H new ATOM 0 HG3 GLN A 867 9.008 -7.655 16.475 1.00 12.31 H new ATOM 0 HE21 GLN A 867 8.584 -5.368 17.196 1.00 45.33 H new ATOM 0 HE22 GLN A 867 7.237 -4.516 16.434 1.00 45.33 H new ATOM 1240 N ASN A 868 7.254 -11.786 17.729 1.00 4.02 N ATOM 1241 CA ASN A 868 7.003 -12.535 18.948 1.00 24.45 C ATOM 1242 C ASN A 868 8.060 -13.632 19.094 1.00 21.24 C ATOM 1243 O ASN A 868 7.980 -14.668 18.435 1.00 1.25 O ATOM 1244 CB ASN A 868 5.629 -13.206 18.910 1.00 54.41 C ATOM 1245 CG ASN A 868 4.511 -12.162 18.855 1.00 42.12 C ATOM 1246 OD1 ASN A 868 4.258 -11.538 17.837 1.00 25.31 O ATOM 1247 ND2 ASN A 868 3.858 -12.007 20.003 1.00 23.31 N ATOM 0 H ASN A 868 6.605 -11.982 16.967 1.00 4.02 H new ATOM 0 HA ASN A 868 7.041 -11.838 19.785 1.00 24.45 H new ATOM 0 HB2 ASN A 868 5.564 -13.860 18.041 1.00 54.41 H new ATOM 0 HB3 ASN A 868 5.502 -13.834 19.792 1.00 54.41 H new ATOM 0 HD21 ASN A 868 3.095 -11.334 20.069 1.00 23.31 H new ATOM 0 HD22 ASN A 868 4.120 -12.561 20.818 1.00 23.31 H new ATOM 1254 N CYS A 869 9.026 -13.367 19.962 1.00 72.41 N ATOM 1255 CA CYS A 869 10.097 -14.319 20.203 1.00 61.13 C ATOM 1256 C CYS A 869 9.894 -14.929 21.591 1.00 64.51 C ATOM 1257 O CYS A 869 10.419 -16.003 21.883 1.00 33.05 O ATOM 1258 CB CYS A 869 11.474 -13.668 20.061 1.00 25.02 C ATOM 1259 SG CYS A 869 11.943 -13.573 18.295 1.00 40.32 S ATOM 0 H CYS A 869 9.089 -12.507 20.507 1.00 72.41 H new ATOM 0 HA CYS A 869 10.062 -15.108 19.452 1.00 61.13 H new ATOM 0 HB2 CYS A 869 11.459 -12.669 20.496 1.00 25.02 H new ATOM 0 HB3 CYS A 869 12.217 -14.245 20.612 1.00 25.02 H new ATOM 0 HG CYS A 869 10.903 -13.247 17.587 1.00 40.32 H new ATOM 1265 N SER A 870 9.132 -14.219 22.409 1.00 4.23 N ATOM 1266 CA SER A 870 8.854 -14.677 23.760 1.00 71.23 C ATOM 1267 C SER A 870 7.578 -15.522 23.773 1.00 64.22 C ATOM 1268 O SER A 870 6.936 -15.667 24.812 1.00 52.43 O ATOM 1269 CB SER A 870 8.719 -13.498 24.725 1.00 42.22 C ATOM 1270 OG SER A 870 9.854 -12.637 24.677 1.00 55.51 O ATOM 0 H SER A 870 8.698 -13.329 22.163 1.00 4.23 H new ATOM 0 HA SER A 870 9.692 -15.289 24.093 1.00 71.23 H new ATOM 0 HB2 SER A 870 7.822 -12.930 24.480 1.00 42.22 H new ATOM 0 HB3 SER A 870 8.591 -13.873 25.740 1.00 42.22 H new ATOM 0 HG SER A 870 9.729 -11.896 25.306 1.00 55.51 H new ATOM 1276 N HIS A 871 7.250 -16.058 22.607 1.00 70.34 N ATOM 1277 CA HIS A 871 6.063 -16.885 22.471 1.00 72.12 C ATOM 1278 C HIS A 871 6.436 -18.215 21.813 1.00 62.01 C ATOM 1279 O HIS A 871 6.878 -18.242 20.665 1.00 12.32 O ATOM 1280 CB HIS A 871 4.964 -16.137 21.714 1.00 74.12 C ATOM 1281 CG HIS A 871 3.563 -16.539 22.110 1.00 52.22 C ATOM 1282 ND1 HIS A 871 3.180 -17.858 22.274 1.00 35.50 N ATOM 1283 CD2 HIS A 871 2.459 -15.782 22.373 1.00 3.41 C ATOM 1284 CE1 HIS A 871 1.901 -17.883 22.620 1.00 53.34 C ATOM 1285 NE2 HIS A 871 1.456 -16.595 22.680 1.00 40.40 N ATOM 0 H HIS A 871 7.786 -15.936 21.748 1.00 70.34 H new ATOM 0 HA HIS A 871 5.657 -17.109 23.457 1.00 72.12 H new ATOM 0 HB2 HIS A 871 5.085 -15.067 21.882 1.00 74.12 H new ATOM 0 HB3 HIS A 871 5.092 -16.308 20.645 1.00 74.12 H new ATOM 0 HD2 HIS A 871 2.410 -14.704 22.337 1.00 3.41 H new ATOM 0 HE1 HIS A 871 1.314 -18.768 22.819 1.00 53.34 H new ATOM 0 HE2 HIS A 871 0.508 -16.305 22.921 1.00 40.40 H new ATOM 1293 N ASP A 872 6.245 -19.286 22.568 1.00 30.45 N ATOM 1294 CA ASP A 872 6.556 -20.617 22.073 1.00 1.43 C ATOM 1295 C ASP A 872 5.257 -21.336 21.704 1.00 12.54 C ATOM 1296 O ASP A 872 4.258 -21.224 22.414 1.00 24.02 O ATOM 1297 CB ASP A 872 7.270 -21.448 23.141 1.00 61.45 C ATOM 1298 CG ASP A 872 6.704 -21.309 24.555 1.00 2.31 C ATOM 1299 OD1 ASP A 872 6.362 -22.306 25.207 1.00 33.14 O ATOM 1300 OD2 ASP A 872 6.619 -20.098 24.991 1.00 4.42 O ATOM 0 H ASP A 872 5.879 -19.260 23.520 1.00 30.45 H new ATOM 0 HA ASP A 872 7.206 -20.511 21.204 1.00 1.43 H new ATOM 0 HB2 ASP A 872 7.228 -22.498 22.851 1.00 61.45 H new ATOM 0 HB3 ASP A 872 8.322 -21.164 23.158 1.00 61.45 H new ATOM 1306 N TRP A 873 5.312 -22.057 20.595 1.00 71.32 N ATOM 1307 CA TRP A 873 4.152 -22.794 20.123 1.00 30.30 C ATOM 1308 C TRP A 873 4.528 -24.276 20.056 1.00 43.20 C ATOM 1309 O TRP A 873 3.711 -25.111 19.673 1.00 74.01 O ATOM 1310 CB TRP A 873 3.658 -22.242 18.784 1.00 5.35 C ATOM 1311 CG TRP A 873 4.773 -21.710 17.881 1.00 25.45 C ATOM 1312 CD1 TRP A 873 5.731 -20.825 18.188 1.00 44.34 C ATOM 1313 CD2 TRP A 873 5.009 -22.070 16.504 1.00 54.54 C ATOM 1314 NE1 TRP A 873 6.563 -20.588 17.112 1.00 3.42 N ATOM 1315 CE2 TRP A 873 6.110 -21.369 16.056 1.00 52.23 C ATOM 1316 CE3 TRP A 873 4.314 -22.957 15.663 1.00 33.45 C ATOM 1317 CZ2 TRP A 873 6.614 -21.483 14.755 1.00 52.24 C ATOM 1318 CZ3 TRP A 873 4.830 -23.060 14.366 1.00 21.02 C ATOM 1319 CH2 TRP A 873 5.938 -22.361 13.900 1.00 75.41 C ATOM 0 H TRP A 873 6.142 -22.147 20.009 1.00 71.32 H new ATOM 0 HA TRP A 873 3.315 -22.677 20.812 1.00 30.30 H new ATOM 0 HB2 TRP A 873 3.120 -23.028 18.255 1.00 5.35 H new ATOM 0 HB3 TRP A 873 2.945 -21.440 18.974 1.00 5.35 H new ATOM 0 HD1 TRP A 873 5.839 -20.356 19.155 1.00 44.34 H new ATOM 0 HE1 TRP A 873 7.363 -19.956 17.095 1.00 3.42 H new ATOM 0 HE3 TRP A 873 3.450 -23.515 15.992 1.00 33.45 H new ATOM 0 HZ2 TRP A 873 7.478 -20.923 14.429 1.00 52.24 H new ATOM 0 HZ3 TRP A 873 4.333 -23.729 13.679 1.00 21.02 H new ATOM 0 HH2 TRP A 873 6.275 -22.495 12.883 1.00 75.41 H new ATOM 1330 N GLY A 874 5.767 -24.557 20.434 1.00 14.45 N ATOM 1331 CA GLY A 874 6.261 -25.923 20.422 1.00 3.21 C ATOM 1332 C GLY A 874 7.495 -26.067 21.315 1.00 23.21 C ATOM 1333 O GLY A 874 7.786 -25.189 22.126 1.00 54.33 O ATOM 0 H GLY A 874 6.443 -23.862 20.750 1.00 14.45 H new ATOM 0 HA2 GLY A 874 5.478 -26.600 20.765 1.00 3.21 H new ATOM 0 HA3 GLY A 874 6.510 -26.215 19.402 1.00 3.21 H new ATOM 1337 N ILE A 875 8.188 -27.182 21.136 1.00 24.14 N ATOM 1338 CA ILE A 875 9.384 -27.453 21.916 1.00 44.21 C ATOM 1339 C ILE A 875 10.385 -28.227 21.055 1.00 52.42 C ATOM 1340 O ILE A 875 9.999 -29.108 20.289 1.00 34.20 O ATOM 1341 CB ILE A 875 9.023 -28.160 23.224 1.00 50.32 C ATOM 1342 CG1 ILE A 875 7.792 -29.050 23.044 1.00 70.34 C ATOM 1343 CG2 ILE A 875 8.839 -27.151 24.360 1.00 64.05 C ATOM 1344 CD1 ILE A 875 8.093 -30.217 22.101 1.00 54.04 C ATOM 0 H ILE A 875 7.944 -27.908 20.462 1.00 24.14 H new ATOM 0 HA ILE A 875 9.867 -26.520 22.208 1.00 44.21 H new ATOM 0 HB ILE A 875 9.853 -28.810 23.501 1.00 50.32 H new ATOM 0 HG12 ILE A 875 7.471 -29.434 24.013 1.00 70.34 H new ATOM 0 HG13 ILE A 875 6.967 -28.459 22.646 1.00 70.34 H new ATOM 0 HG21 ILE A 875 8.583 -27.680 25.278 1.00 64.05 H new ATOM 0 HG22 ILE A 875 9.765 -26.596 24.507 1.00 64.05 H new ATOM 0 HG23 ILE A 875 8.037 -26.458 24.105 1.00 64.05 H new ATOM 0 HD11 ILE A 875 7.202 -30.834 21.990 1.00 54.04 H new ATOM 0 HD12 ILE A 875 8.390 -29.830 21.126 1.00 54.04 H new ATOM 0 HD13 ILE A 875 8.902 -30.819 22.514 1.00 54.04 H new ATOM 1356 N HIS A 876 11.651 -27.869 21.209 1.00 0.53 N ATOM 1357 CA HIS A 876 12.710 -28.518 20.455 1.00 32.24 C ATOM 1358 C HIS A 876 13.091 -29.834 21.136 1.00 24.12 C ATOM 1359 O HIS A 876 13.579 -29.835 22.266 1.00 51.55 O ATOM 1360 CB HIS A 876 13.902 -27.577 20.273 1.00 64.54 C ATOM 1361 CG HIS A 876 14.665 -27.795 18.988 1.00 61.34 C ATOM 1362 ND1 HIS A 876 14.530 -26.968 17.886 1.00 34.41 N ATOM 1363 CD2 HIS A 876 15.572 -28.753 18.641 1.00 63.00 C ATOM 1364 CE1 HIS A 876 15.323 -27.418 16.925 1.00 23.33 C ATOM 1365 NE2 HIS A 876 15.968 -28.525 17.395 1.00 42.41 N ATOM 0 H HIS A 876 11.968 -27.137 21.845 1.00 0.53 H new ATOM 0 HA HIS A 876 12.355 -28.757 19.453 1.00 32.24 H new ATOM 0 HB2 HIS A 876 13.547 -26.547 20.302 1.00 64.54 H new ATOM 0 HB3 HIS A 876 14.583 -27.703 21.114 1.00 64.54 H new ATOM 0 HD2 HIS A 876 15.911 -29.560 19.273 1.00 63.00 H new ATOM 0 HE1 HIS A 876 15.439 -26.985 15.942 1.00 23.33 H new ATOM 0 HE2 HIS A 876 16.643 -29.085 16.874 1.00 42.41 H new ATOM 1373 N VAL A 877 12.855 -30.924 20.421 1.00 41.25 N ATOM 1374 CA VAL A 877 13.168 -32.244 20.941 1.00 11.33 C ATOM 1375 C VAL A 877 14.196 -32.917 20.029 1.00 14.33 C ATOM 1376 O VAL A 877 14.712 -32.293 19.104 1.00 43.33 O ATOM 1377 CB VAL A 877 11.884 -33.061 21.101 1.00 63.01 C ATOM 1378 CG1 VAL A 877 10.773 -32.219 21.729 1.00 15.53 C ATOM 1379 CG2 VAL A 877 11.437 -33.647 19.760 1.00 2.02 C ATOM 0 H VAL A 877 12.450 -30.920 19.485 1.00 41.25 H new ATOM 0 HA VAL A 877 13.615 -32.168 21.932 1.00 11.33 H new ATOM 0 HB VAL A 877 12.096 -33.891 21.775 1.00 63.01 H new ATOM 0 HG11 VAL A 877 9.872 -32.824 21.831 1.00 15.53 H new ATOM 0 HG12 VAL A 877 11.091 -31.872 22.712 1.00 15.53 H new ATOM 0 HG13 VAL A 877 10.563 -31.360 21.092 1.00 15.53 H new ATOM 0 HG21 VAL A 877 10.522 -34.223 19.901 1.00 2.02 H new ATOM 0 HG22 VAL A 877 11.251 -32.838 19.053 1.00 2.02 H new ATOM 0 HG23 VAL A 877 12.219 -34.298 19.369 1.00 2.02 H new ATOM 1389 N LYS A 878 14.461 -34.181 20.323 1.00 65.14 N ATOM 1390 CA LYS A 878 15.418 -34.946 19.541 1.00 42.55 C ATOM 1391 C LYS A 878 15.106 -36.437 19.678 1.00 64.14 C ATOM 1392 O LYS A 878 14.895 -36.932 20.784 1.00 51.42 O ATOM 1393 CB LYS A 878 16.850 -34.578 19.936 1.00 14.54 C ATOM 1394 CG LYS A 878 17.862 -35.499 19.252 1.00 13.15 C ATOM 1395 CD LYS A 878 18.153 -36.729 20.114 1.00 31.22 C ATOM 1396 CE LYS A 878 19.343 -37.516 19.562 1.00 22.01 C ATOM 1397 NZ LYS A 878 19.312 -37.533 18.082 1.00 33.05 N ATOM 0 H LYS A 878 14.030 -34.695 21.092 1.00 65.14 H new ATOM 0 HA LYS A 878 15.330 -34.698 18.483 1.00 42.55 H new ATOM 0 HB2 LYS A 878 17.052 -33.543 19.662 1.00 14.54 H new ATOM 0 HB3 LYS A 878 16.962 -34.649 21.018 1.00 14.54 H new ATOM 0 HG2 LYS A 878 17.476 -35.813 18.282 1.00 13.15 H new ATOM 0 HG3 LYS A 878 18.787 -34.954 19.065 1.00 13.15 H new ATOM 0 HD2 LYS A 878 18.361 -36.419 21.138 1.00 31.22 H new ATOM 0 HD3 LYS A 878 17.272 -37.370 20.148 1.00 31.22 H new ATOM 0 HE2 LYS A 878 20.275 -37.067 19.907 1.00 22.01 H new ATOM 0 HE3 LYS A 878 19.320 -38.537 19.944 1.00 22.01 H new ATOM 0 HZ1 LYS A 878 19.908 -38.310 17.731 1.00 33.05 H new ATOM 0 HZ2 LYS A 878 18.334 -37.673 17.757 1.00 33.05 H new ATOM 0 HZ3 LYS A 878 19.672 -36.628 17.717 1.00 33.05 H new ATOM 1410 N TYR A 879 15.088 -37.112 18.538 1.00 72.33 N ATOM 1411 CA TYR A 879 14.805 -38.537 18.517 1.00 64.54 C ATOM 1412 C TYR A 879 16.033 -39.333 18.068 1.00 31.10 C ATOM 1413 O TYR A 879 16.974 -38.768 17.513 1.00 62.50 O ATOM 1414 CB TYR A 879 13.685 -38.730 17.492 1.00 23.24 C ATOM 1415 CG TYR A 879 12.483 -37.809 17.705 1.00 54.22 C ATOM 1416 CD1 TYR A 879 12.083 -37.480 18.984 1.00 13.22 C ATOM 1417 CD2 TYR A 879 11.798 -37.306 16.617 1.00 35.52 C ATOM 1418 CE1 TYR A 879 10.951 -36.612 19.184 1.00 32.42 C ATOM 1419 CE2 TYR A 879 10.666 -36.439 16.817 1.00 34.21 C ATOM 1420 CZ TYR A 879 10.298 -36.135 18.091 1.00 41.13 C ATOM 1421 OH TYR A 879 9.229 -35.316 18.280 1.00 50.24 O ATOM 0 H TYR A 879 15.265 -36.699 17.622 1.00 72.33 H new ATOM 0 HA TYR A 879 14.527 -38.888 19.511 1.00 64.54 H new ATOM 0 HB2 TYR A 879 14.087 -38.561 16.493 1.00 23.24 H new ATOM 0 HB3 TYR A 879 13.347 -39.766 17.528 1.00 23.24 H new ATOM 0 HD1 TYR A 879 12.619 -37.873 19.835 1.00 13.22 H new ATOM 0 HD2 TYR A 879 12.111 -37.563 15.616 1.00 35.52 H new ATOM 0 HE1 TYR A 879 10.628 -36.346 20.180 1.00 32.42 H new ATOM 0 HE2 TYR A 879 10.121 -36.039 15.975 1.00 34.21 H new ATOM 0 HH TYR A 879 8.431 -35.723 17.882 1.00 50.24 H new ATOM 1431 N LYS A 880 15.983 -40.632 18.325 1.00 1.24 N ATOM 1432 CA LYS A 880 17.079 -41.511 17.955 1.00 3.20 C ATOM 1433 C LYS A 880 17.189 -41.567 16.430 1.00 23.00 C ATOM 1434 O LYS A 880 18.171 -42.078 15.893 1.00 31.33 O ATOM 1435 CB LYS A 880 16.911 -42.883 18.611 1.00 52.15 C ATOM 1436 CG LYS A 880 16.673 -42.746 20.116 1.00 75.03 C ATOM 1437 CD LYS A 880 17.559 -41.651 20.714 1.00 73.53 C ATOM 1438 CE LYS A 880 19.041 -41.990 20.540 1.00 54.24 C ATOM 1439 NZ LYS A 880 19.871 -40.774 20.688 1.00 52.40 N ATOM 0 H LYS A 880 15.200 -41.097 18.785 1.00 1.24 H new ATOM 0 HA LYS A 880 18.025 -41.119 18.329 1.00 3.20 H new ATOM 0 HB2 LYS A 880 16.073 -43.409 18.153 1.00 52.15 H new ATOM 0 HB3 LYS A 880 17.801 -43.486 18.433 1.00 52.15 H new ATOM 0 HG2 LYS A 880 15.625 -42.513 20.302 1.00 75.03 H new ATOM 0 HG3 LYS A 880 16.880 -43.696 20.609 1.00 75.03 H new ATOM 0 HD2 LYS A 880 17.341 -40.698 20.232 1.00 73.53 H new ATOM 0 HD3 LYS A 880 17.331 -41.532 21.773 1.00 73.53 H new ATOM 0 HE2 LYS A 880 19.339 -42.733 21.279 1.00 54.24 H new ATOM 0 HE3 LYS A 880 19.206 -42.433 19.558 1.00 54.24 H new ATOM 0 HZ1 LYS A 880 20.756 -41.015 21.178 1.00 52.40 H new ATOM 0 HZ2 LYS A 880 20.090 -40.387 19.748 1.00 52.40 H new ATOM 0 HZ3 LYS A 880 19.351 -40.064 21.242 1.00 52.40 H new ATOM 1452 N THR A 881 16.168 -41.034 15.775 1.00 22.40 N ATOM 1453 CA THR A 881 16.138 -41.018 14.322 1.00 12.54 C ATOM 1454 C THR A 881 16.572 -39.648 13.796 1.00 74.22 C ATOM 1455 O THR A 881 17.551 -39.544 13.058 1.00 33.45 O ATOM 1456 CB THR A 881 14.732 -41.424 13.874 1.00 4.52 C ATOM 1457 OG1 THR A 881 13.932 -40.281 14.166 1.00 74.54 O ATOM 1458 CG2 THR A 881 14.136 -42.529 14.747 1.00 31.43 C ATOM 0 H THR A 881 15.356 -40.610 16.223 1.00 22.40 H new ATOM 0 HA THR A 881 16.847 -41.732 13.903 1.00 12.54 H new ATOM 0 HB THR A 881 14.763 -41.758 12.837 1.00 4.52 H new ATOM 0 HG1 THR A 881 13.004 -40.456 13.905 1.00 74.54 H new ATOM 0 HG21 THR A 881 13.138 -42.779 14.386 1.00 31.43 H new ATOM 0 HG22 THR A 881 14.772 -43.413 14.699 1.00 31.43 H new ATOM 0 HG23 THR A 881 14.073 -42.183 15.779 1.00 31.43 H new ATOM 1466 N PHE A 882 15.822 -38.632 14.195 1.00 13.40 N ATOM 1467 CA PHE A 882 16.116 -37.273 13.773 1.00 44.15 C ATOM 1468 C PHE A 882 15.808 -36.273 14.889 1.00 44.44 C ATOM 1469 O PHE A 882 15.114 -36.603 15.849 1.00 45.10 O ATOM 1470 CB PHE A 882 15.217 -36.973 12.572 1.00 14.42 C ATOM 1471 CG PHE A 882 15.529 -37.815 11.334 1.00 64.21 C ATOM 1472 CD1 PHE A 882 16.775 -37.786 10.788 1.00 11.04 C ATOM 1473 CD2 PHE A 882 14.562 -38.593 10.779 1.00 70.43 C ATOM 1474 CE1 PHE A 882 17.065 -38.568 9.639 1.00 22.02 C ATOM 1475 CE2 PHE A 882 14.852 -39.375 9.630 1.00 63.34 C ATOM 1476 CZ PHE A 882 16.098 -39.346 9.084 1.00 33.21 C ATOM 0 H PHE A 882 15.011 -38.722 14.806 1.00 13.40 H new ATOM 0 HA PHE A 882 17.173 -37.182 13.523 1.00 44.15 H new ATOM 0 HB2 PHE A 882 14.178 -37.138 12.859 1.00 14.42 H new ATOM 0 HB3 PHE A 882 15.312 -35.918 12.315 1.00 14.42 H new ATOM 0 HD1 PHE A 882 17.543 -37.168 11.229 1.00 11.04 H new ATOM 0 HD2 PHE A 882 13.573 -38.616 11.212 1.00 70.43 H new ATOM 0 HE1 PHE A 882 18.054 -38.545 9.206 1.00 22.02 H new ATOM 0 HE2 PHE A 882 14.084 -39.993 9.189 1.00 63.34 H new ATOM 0 HZ PHE A 882 16.319 -39.941 8.210 1.00 33.21 H new ATOM 1486 N GLU A 883 16.340 -35.070 14.725 1.00 55.11 N ATOM 1487 CA GLU A 883 16.130 -34.019 15.707 1.00 60.34 C ATOM 1488 C GLU A 883 15.300 -32.885 15.102 1.00 73.53 C ATOM 1489 O GLU A 883 15.739 -32.222 14.163 1.00 33.24 O ATOM 1490 CB GLU A 883 17.464 -33.496 16.243 1.00 70.12 C ATOM 1491 CG GLU A 883 18.236 -32.745 15.156 1.00 75.34 C ATOM 1492 CD GLU A 883 19.696 -32.538 15.563 1.00 14.04 C ATOM 1493 OE1 GLU A 883 20.011 -31.567 16.267 1.00 12.20 O ATOM 1494 OE2 GLU A 883 20.517 -33.430 15.123 1.00 35.54 O ATOM 0 H GLU A 883 16.916 -34.800 13.927 1.00 55.11 H new ATOM 0 HA GLU A 883 15.577 -34.439 16.547 1.00 60.34 H new ATOM 0 HB2 GLU A 883 17.285 -32.834 17.090 1.00 70.12 H new ATOM 0 HB3 GLU A 883 18.064 -34.329 16.610 1.00 70.12 H new ATOM 0 HG2 GLU A 883 18.191 -33.304 14.221 1.00 75.34 H new ATOM 0 HG3 GLU A 883 17.766 -31.779 14.973 1.00 75.34 H new ATOM 1502 N ILE A 884 14.115 -32.698 15.664 1.00 54.13 N ATOM 1503 CA ILE A 884 13.219 -31.656 15.191 1.00 11.24 C ATOM 1504 C ILE A 884 12.246 -31.280 16.311 1.00 51.23 C ATOM 1505 O ILE A 884 12.067 -32.037 17.263 1.00 72.41 O ATOM 1506 CB ILE A 884 12.529 -32.089 13.896 1.00 11.33 C ATOM 1507 CG1 ILE A 884 12.356 -33.608 13.848 1.00 23.25 C ATOM 1508 CG2 ILE A 884 13.278 -31.558 12.672 1.00 31.12 C ATOM 1509 CD1 ILE A 884 11.399 -34.086 14.942 1.00 1.03 C ATOM 0 H ILE A 884 13.754 -33.250 16.442 1.00 54.13 H new ATOM 0 HA ILE A 884 13.780 -30.756 14.940 1.00 11.24 H new ATOM 0 HB ILE A 884 11.531 -31.651 13.878 1.00 11.33 H new ATOM 0 HG12 ILE A 884 11.974 -33.903 12.871 1.00 23.25 H new ATOM 0 HG13 ILE A 884 13.325 -34.092 13.971 1.00 23.25 H new ATOM 0 HG21 ILE A 884 12.767 -31.880 11.765 1.00 31.12 H new ATOM 0 HG22 ILE A 884 13.305 -30.469 12.706 1.00 31.12 H new ATOM 0 HG23 ILE A 884 14.296 -31.946 12.672 1.00 31.12 H new ATOM 0 HD11 ILE A 884 11.294 -35.169 14.885 1.00 1.03 H new ATOM 0 HD12 ILE A 884 11.796 -33.811 15.919 1.00 1.03 H new ATOM 0 HD13 ILE A 884 10.424 -33.619 14.802 1.00 1.03 H new ATOM 1521 N PRO A 885 11.627 -30.079 16.155 1.00 51.12 N ATOM 1522 CA PRO A 885 10.677 -29.593 17.141 1.00 73.21 C ATOM 1523 C PRO A 885 9.343 -30.334 17.029 1.00 71.34 C ATOM 1524 O PRO A 885 9.031 -30.904 15.984 1.00 50.41 O ATOM 1525 CB PRO A 885 10.553 -28.103 16.867 1.00 22.15 C ATOM 1526 CG PRO A 885 11.075 -27.894 15.455 1.00 3.33 C ATOM 1527 CD PRO A 885 11.815 -29.155 15.040 1.00 75.11 C ATOM 0 HA PRO A 885 11.006 -29.770 18.165 1.00 73.21 H new ATOM 0 HB2 PRO A 885 9.517 -27.775 16.953 1.00 22.15 H new ATOM 0 HB3 PRO A 885 11.131 -27.524 17.587 1.00 22.15 H new ATOM 0 HG2 PRO A 885 10.252 -27.692 14.770 1.00 3.33 H new ATOM 0 HG3 PRO A 885 11.740 -27.031 15.418 1.00 3.33 H new ATOM 0 HD2 PRO A 885 11.411 -29.564 14.114 1.00 75.11 H new ATOM 0 HD3 PRO A 885 12.872 -28.955 14.866 1.00 75.11 H new ATOM 1535 N VAL A 886 8.591 -30.303 18.119 1.00 5.04 N ATOM 1536 CA VAL A 886 7.298 -30.965 18.157 1.00 43.44 C ATOM 1537 C VAL A 886 6.200 -29.917 18.351 1.00 71.34 C ATOM 1538 O VAL A 886 6.282 -29.087 19.254 1.00 12.22 O ATOM 1539 CB VAL A 886 7.294 -32.044 19.241 1.00 14.21 C ATOM 1540 CG1 VAL A 886 6.170 -33.055 19.004 1.00 51.33 C ATOM 1541 CG2 VAL A 886 8.652 -32.743 19.325 1.00 71.15 C ATOM 0 H VAL A 886 8.853 -29.829 18.984 1.00 5.04 H new ATOM 0 HA VAL A 886 7.100 -31.472 17.213 1.00 43.44 H new ATOM 0 HB VAL A 886 7.110 -31.556 20.198 1.00 14.21 H new ATOM 0 HG11 VAL A 886 6.189 -33.811 19.789 1.00 51.33 H new ATOM 0 HG12 VAL A 886 5.209 -32.541 19.019 1.00 51.33 H new ATOM 0 HG13 VAL A 886 6.310 -33.534 18.035 1.00 51.33 H new ATOM 0 HG21 VAL A 886 8.621 -33.505 20.104 1.00 71.15 H new ATOM 0 HG22 VAL A 886 8.880 -33.211 18.367 1.00 71.15 H new ATOM 0 HG23 VAL A 886 9.424 -32.011 19.564 1.00 71.15 H new ATOM 1551 N ILE A 887 5.197 -29.991 17.488 1.00 44.24 N ATOM 1552 CA ILE A 887 4.084 -29.059 17.553 1.00 71.54 C ATOM 1553 C ILE A 887 2.776 -29.843 17.684 1.00 4.15 C ATOM 1554 O ILE A 887 2.754 -31.057 17.490 1.00 31.31 O ATOM 1555 CB ILE A 887 4.112 -28.107 16.356 1.00 11.50 C ATOM 1556 CG1 ILE A 887 5.524 -27.570 16.116 1.00 44.35 C ATOM 1557 CG2 ILE A 887 3.092 -26.979 16.529 1.00 70.21 C ATOM 1558 CD1 ILE A 887 5.853 -26.436 17.089 1.00 41.22 C ATOM 0 H ILE A 887 5.132 -30.682 16.740 1.00 44.24 H new ATOM 0 HA ILE A 887 4.168 -28.426 18.437 1.00 71.54 H new ATOM 0 HB ILE A 887 3.825 -28.668 15.467 1.00 11.50 H new ATOM 0 HG12 ILE A 887 6.248 -28.376 16.234 1.00 44.35 H new ATOM 0 HG13 ILE A 887 5.611 -27.211 15.091 1.00 44.35 H new ATOM 0 HG21 ILE A 887 3.132 -26.316 15.665 1.00 70.21 H new ATOM 0 HG22 ILE A 887 2.092 -27.403 16.615 1.00 70.21 H new ATOM 0 HG23 ILE A 887 3.325 -26.413 17.431 1.00 70.21 H new ATOM 0 HD11 ILE A 887 6.862 -26.073 16.896 1.00 41.22 H new ATOM 0 HD12 ILE A 887 5.142 -25.621 16.952 1.00 41.22 H new ATOM 0 HD13 ILE A 887 5.789 -26.805 18.113 1.00 41.22 H new ATOM 1570 N LYS A 888 1.719 -29.116 18.014 1.00 52.02 N ATOM 1571 CA LYS A 888 0.411 -29.728 18.174 1.00 54.31 C ATOM 1572 C LYS A 888 -0.571 -29.088 17.189 1.00 4.05 C ATOM 1573 O LYS A 888 -0.207 -28.175 16.450 1.00 63.35 O ATOM 1574 CB LYS A 888 -0.043 -29.649 19.633 1.00 41.20 C ATOM 1575 CG LYS A 888 -0.309 -28.200 20.047 1.00 43.11 C ATOM 1576 CD LYS A 888 0.964 -27.540 20.580 1.00 3.24 C ATOM 1577 CE LYS A 888 1.053 -27.670 22.102 1.00 23.52 C ATOM 1578 NZ LYS A 888 0.097 -26.751 22.758 1.00 0.22 N ATOM 0 H LYS A 888 1.742 -28.109 18.175 1.00 52.02 H new ATOM 0 HA LYS A 888 0.456 -30.791 17.935 1.00 54.31 H new ATOM 0 HB2 LYS A 888 -0.948 -30.242 19.769 1.00 41.20 H new ATOM 0 HB3 LYS A 888 0.721 -30.081 20.279 1.00 41.20 H new ATOM 0 HG2 LYS A 888 -0.685 -27.637 19.193 1.00 43.11 H new ATOM 0 HG3 LYS A 888 -1.085 -28.173 20.812 1.00 43.11 H new ATOM 0 HD2 LYS A 888 1.837 -28.002 20.120 1.00 3.24 H new ATOM 0 HD3 LYS A 888 0.976 -26.487 20.300 1.00 3.24 H new ATOM 0 HE2 LYS A 888 0.840 -28.697 22.398 1.00 23.52 H new ATOM 0 HE3 LYS A 888 2.067 -27.446 22.433 1.00 23.52 H new ATOM 0 HZ1 LYS A 888 0.368 -26.620 23.753 1.00 0.22 H new ATOM 0 HZ2 LYS A 888 0.110 -25.832 22.272 1.00 0.22 H new ATOM 0 HZ3 LYS A 888 -0.861 -27.154 22.710 1.00 0.22 H new ATOM 1591 N ILE A 889 -1.796 -29.592 17.213 1.00 64.24 N ATOM 1592 CA ILE A 889 -2.832 -29.081 16.331 1.00 21.53 C ATOM 1593 C ILE A 889 -3.381 -27.772 16.902 1.00 62.22 C ATOM 1594 O ILE A 889 -3.829 -26.905 16.154 1.00 52.31 O ATOM 1595 CB ILE A 889 -3.905 -30.146 16.093 1.00 43.15 C ATOM 1596 CG1 ILE A 889 -4.588 -29.941 14.739 1.00 72.51 C ATOM 1597 CG2 ILE A 889 -4.912 -30.177 17.244 1.00 24.51 C ATOM 1598 CD1 ILE A 889 -5.952 -30.635 14.703 1.00 3.40 C ATOM 0 H ILE A 889 -2.094 -30.348 17.829 1.00 64.24 H new ATOM 0 HA ILE A 889 -2.418 -28.852 15.349 1.00 21.53 H new ATOM 0 HB ILE A 889 -3.419 -31.121 16.065 1.00 43.15 H new ATOM 0 HG12 ILE A 889 -4.713 -28.875 14.548 1.00 72.51 H new ATOM 0 HG13 ILE A 889 -3.954 -30.335 13.944 1.00 72.51 H new ATOM 0 HG21 ILE A 889 -5.663 -30.942 17.050 1.00 24.51 H new ATOM 0 HG22 ILE A 889 -4.393 -30.406 18.175 1.00 24.51 H new ATOM 0 HG23 ILE A 889 -5.398 -29.205 17.329 1.00 24.51 H new ATOM 0 HD11 ILE A 889 -6.417 -30.474 13.730 1.00 3.40 H new ATOM 0 HD12 ILE A 889 -5.821 -31.704 14.870 1.00 3.40 H new ATOM 0 HD13 ILE A 889 -6.591 -30.222 15.483 1.00 3.40 H new ATOM 1610 N GLU A 890 -3.327 -27.671 18.222 1.00 54.33 N ATOM 1611 CA GLU A 890 -3.814 -26.482 18.901 1.00 4.12 C ATOM 1612 C GLU A 890 -2.681 -25.467 19.072 1.00 72.25 C ATOM 1613 O GLU A 890 -2.669 -24.701 20.034 1.00 60.12 O ATOM 1614 CB GLU A 890 -4.438 -26.839 20.252 1.00 43.23 C ATOM 1615 CG GLU A 890 -3.378 -27.357 21.226 1.00 63.23 C ATOM 1616 CD GLU A 890 -3.902 -27.347 22.663 1.00 72.20 C ATOM 1617 OE1 GLU A 890 -3.612 -28.273 23.435 1.00 4.24 O ATOM 1618 OE2 GLU A 890 -4.636 -26.331 22.969 1.00 62.14 O ATOM 0 H GLU A 890 -2.954 -28.392 18.839 1.00 54.33 H new ATOM 0 HA GLU A 890 -4.592 -26.029 18.286 1.00 4.12 H new ATOM 0 HB2 GLU A 890 -4.927 -25.961 20.674 1.00 43.23 H new ATOM 0 HB3 GLU A 890 -5.209 -27.596 20.112 1.00 43.23 H new ATOM 0 HG2 GLU A 890 -3.088 -28.370 20.948 1.00 63.23 H new ATOM 0 HG3 GLU A 890 -2.483 -26.739 21.157 1.00 63.23 H new ATOM 1626 N SER A 891 -1.757 -25.495 18.123 1.00 51.15 N ATOM 1627 CA SER A 891 -0.623 -24.587 18.156 1.00 70.05 C ATOM 1628 C SER A 891 -0.797 -23.494 17.099 1.00 22.10 C ATOM 1629 O SER A 891 -0.624 -22.311 17.390 1.00 62.53 O ATOM 1630 CB SER A 891 0.691 -25.338 17.931 1.00 74.41 C ATOM 1631 OG SER A 891 1.108 -25.288 16.569 1.00 22.23 O ATOM 0 H SER A 891 -1.770 -26.132 17.327 1.00 51.15 H new ATOM 0 HA SER A 891 -0.582 -24.126 19.143 1.00 70.05 H new ATOM 0 HB2 SER A 891 1.467 -24.908 18.564 1.00 74.41 H new ATOM 0 HB3 SER A 891 0.571 -26.378 18.236 1.00 74.41 H new ATOM 0 HG SER A 891 1.921 -24.746 16.495 1.00 22.23 H new ATOM 1637 N PHE A 892 -1.137 -23.929 15.894 1.00 3.25 N ATOM 1638 CA PHE A 892 -1.336 -23.002 14.793 1.00 22.11 C ATOM 1639 C PHE A 892 -2.657 -23.281 14.074 1.00 60.34 C ATOM 1640 O PHE A 892 -3.266 -24.331 14.272 1.00 34.05 O ATOM 1641 CB PHE A 892 -0.180 -23.217 13.814 1.00 52.34 C ATOM 1642 CG PHE A 892 0.279 -24.672 13.702 1.00 31.11 C ATOM 1643 CD1 PHE A 892 -0.613 -25.643 13.367 1.00 42.55 C ATOM 1644 CD2 PHE A 892 1.579 -24.995 13.939 1.00 73.14 C ATOM 1645 CE1 PHE A 892 -0.187 -26.993 13.263 1.00 63.20 C ATOM 1646 CE2 PHE A 892 2.005 -26.346 13.835 1.00 13.31 C ATOM 1647 CZ PHE A 892 1.113 -27.316 13.499 1.00 21.24 C ATOM 0 H PHE A 892 -1.280 -24.911 15.656 1.00 3.25 H new ATOM 0 HA PHE A 892 -1.367 -21.979 15.168 1.00 22.11 H new ATOM 0 HB2 PHE A 892 -0.483 -22.865 12.828 1.00 52.34 H new ATOM 0 HB3 PHE A 892 0.665 -22.603 14.126 1.00 52.34 H new ATOM 0 HD1 PHE A 892 -1.645 -25.387 13.180 1.00 42.55 H new ATOM 0 HD2 PHE A 892 2.287 -24.224 14.206 1.00 73.14 H new ATOM 0 HE1 PHE A 892 -0.895 -27.764 12.996 1.00 63.20 H new ATOM 0 HE2 PHE A 892 3.037 -26.603 14.023 1.00 13.31 H new ATOM 0 HZ PHE A 892 1.437 -28.343 13.420 1.00 21.24 H new ATOM 1657 N VAL A 893 -3.061 -22.323 13.252 1.00 23.15 N ATOM 1658 CA VAL A 893 -4.298 -22.453 12.502 1.00 14.44 C ATOM 1659 C VAL A 893 -3.990 -23.007 11.110 1.00 13.11 C ATOM 1660 O VAL A 893 -2.829 -23.091 10.715 1.00 64.33 O ATOM 1661 CB VAL A 893 -5.029 -21.109 12.463 1.00 53.03 C ATOM 1662 CG1 VAL A 893 -4.813 -20.328 13.761 1.00 65.44 C ATOM 1663 CG2 VAL A 893 -4.596 -20.285 11.248 1.00 33.13 C ATOM 0 H VAL A 893 -2.553 -21.454 13.089 1.00 23.15 H new ATOM 0 HA VAL A 893 -4.969 -23.159 12.991 1.00 14.44 H new ATOM 0 HB VAL A 893 -6.096 -21.311 12.368 1.00 53.03 H new ATOM 0 HG11 VAL A 893 -5.343 -19.377 13.706 1.00 65.44 H new ATOM 0 HG12 VAL A 893 -5.193 -20.908 14.602 1.00 65.44 H new ATOM 0 HG13 VAL A 893 -3.748 -20.142 13.901 1.00 65.44 H new ATOM 0 HG21 VAL A 893 -5.130 -19.335 11.244 1.00 33.13 H new ATOM 0 HG22 VAL A 893 -3.523 -20.098 11.299 1.00 33.13 H new ATOM 0 HG23 VAL A 893 -4.826 -20.834 10.335 1.00 33.13 H new ATOM 1673 N VAL A 894 -5.051 -23.370 10.405 1.00 73.53 N ATOM 1674 CA VAL A 894 -4.909 -23.914 9.065 1.00 62.41 C ATOM 1675 C VAL A 894 -5.687 -23.040 8.079 1.00 65.31 C ATOM 1676 O VAL A 894 -6.917 -23.042 8.079 1.00 5.31 O ATOM 1677 CB VAL A 894 -5.352 -25.379 9.045 1.00 55.45 C ATOM 1678 CG1 VAL A 894 -6.863 -25.491 8.828 1.00 42.20 C ATOM 1679 CG2 VAL A 894 -4.586 -26.169 7.982 1.00 1.02 C ATOM 0 H VAL A 894 -6.013 -23.298 10.736 1.00 73.53 H new ATOM 0 HA VAL A 894 -3.864 -23.900 8.756 1.00 62.41 H new ATOM 0 HB VAL A 894 -5.119 -25.813 10.017 1.00 55.45 H new ATOM 0 HG11 VAL A 894 -7.152 -26.542 8.818 1.00 42.20 H new ATOM 0 HG12 VAL A 894 -7.386 -24.979 9.636 1.00 42.20 H new ATOM 0 HG13 VAL A 894 -7.129 -25.032 7.876 1.00 42.20 H new ATOM 0 HG21 VAL A 894 -4.920 -27.207 7.989 1.00 1.02 H new ATOM 0 HG22 VAL A 894 -4.773 -25.734 7.000 1.00 1.02 H new ATOM 0 HG23 VAL A 894 -3.518 -26.130 8.199 1.00 1.02 H new ATOM 1689 N GLU A 895 -4.937 -22.315 7.262 1.00 10.31 N ATOM 1690 CA GLU A 895 -5.541 -21.438 6.273 1.00 3.22 C ATOM 1691 C GLU A 895 -5.390 -22.035 4.872 1.00 14.54 C ATOM 1692 O GLU A 895 -4.276 -22.186 4.375 1.00 62.02 O ATOM 1693 CB GLU A 895 -4.933 -20.035 6.340 1.00 63.51 C ATOM 1694 CG GLU A 895 -5.621 -19.092 5.352 1.00 40.24 C ATOM 1695 CD GLU A 895 -4.742 -18.849 4.123 1.00 0.51 C ATOM 1696 OE1 GLU A 895 -4.939 -17.856 3.407 1.00 41.42 O ATOM 1697 OE2 GLU A 895 -3.826 -19.735 3.924 1.00 50.31 O ATOM 0 H GLU A 895 -3.917 -22.317 7.265 1.00 10.31 H new ATOM 0 HA GLU A 895 -6.604 -21.348 6.496 1.00 3.22 H new ATOM 0 HB2 GLU A 895 -5.029 -19.641 7.352 1.00 63.51 H new ATOM 0 HB3 GLU A 895 -3.867 -20.086 6.118 1.00 63.51 H new ATOM 0 HG2 GLU A 895 -6.576 -19.517 5.042 1.00 40.24 H new ATOM 0 HG3 GLU A 895 -5.839 -18.143 5.841 1.00 40.24 H new ATOM 1705 N ASP A 896 -6.529 -22.357 4.276 1.00 23.00 N ATOM 1706 CA ASP A 896 -6.538 -22.934 2.942 1.00 4.24 C ATOM 1707 C ASP A 896 -6.179 -21.852 1.921 1.00 31.23 C ATOM 1708 O ASP A 896 -6.572 -20.697 2.072 1.00 55.51 O ATOM 1709 CB ASP A 896 -7.922 -23.479 2.587 1.00 13.23 C ATOM 1710 CG ASP A 896 -8.050 -25.003 2.639 1.00 14.53 C ATOM 1711 OD1 ASP A 896 -8.937 -25.546 3.315 1.00 24.30 O ATOM 1712 OD2 ASP A 896 -7.180 -25.647 1.938 1.00 10.04 O ATOM 0 H ASP A 896 -7.452 -22.229 4.692 1.00 23.00 H new ATOM 0 HA ASP A 896 -5.814 -23.749 2.922 1.00 4.24 H new ATOM 0 HB2 ASP A 896 -8.653 -23.045 3.269 1.00 13.23 H new ATOM 0 HB3 ASP A 896 -8.182 -23.142 1.584 1.00 13.23 H new ATOM 1718 N ILE A 897 -5.437 -22.266 0.905 1.00 44.30 N ATOM 1719 CA ILE A 897 -5.021 -21.347 -0.141 1.00 4.42 C ATOM 1720 C ILE A 897 -6.075 -21.331 -1.249 1.00 72.02 C ATOM 1721 O ILE A 897 -6.082 -20.435 -2.092 1.00 64.42 O ATOM 1722 CB ILE A 897 -3.615 -21.697 -0.634 1.00 12.41 C ATOM 1723 CG1 ILE A 897 -2.762 -22.266 0.501 1.00 20.51 C ATOM 1724 CG2 ILE A 897 -2.951 -20.490 -1.300 1.00 13.43 C ATOM 1725 CD1 ILE A 897 -2.508 -23.762 0.299 1.00 51.42 C ATOM 0 H ILE A 897 -5.113 -23.226 0.784 1.00 44.30 H new ATOM 0 HA ILE A 897 -4.953 -20.331 0.249 1.00 4.42 H new ATOM 0 HB ILE A 897 -3.703 -22.475 -1.392 1.00 12.41 H new ATOM 0 HG12 ILE A 897 -1.811 -21.735 0.548 1.00 20.51 H new ATOM 0 HG13 ILE A 897 -3.264 -22.104 1.455 1.00 20.51 H new ATOM 0 HG21 ILE A 897 -1.953 -20.766 -1.641 1.00 13.43 H new ATOM 0 HG22 ILE A 897 -3.550 -20.169 -2.152 1.00 13.43 H new ATOM 0 HG23 ILE A 897 -2.876 -19.674 -0.582 1.00 13.43 H new ATOM 0 HD11 ILE A 897 -1.899 -24.142 1.120 1.00 51.42 H new ATOM 0 HD12 ILE A 897 -3.460 -24.293 0.277 1.00 51.42 H new ATOM 0 HD13 ILE A 897 -1.984 -23.918 -0.644 1.00 51.42 H new ATOM 1737 N ALA A 898 -6.941 -22.333 -1.212 1.00 53.10 N ATOM 1738 CA ALA A 898 -7.998 -22.446 -2.203 1.00 12.41 C ATOM 1739 C ALA A 898 -9.256 -21.746 -1.683 1.00 23.42 C ATOM 1740 O ALA A 898 -10.148 -21.408 -2.459 1.00 1.42 O ATOM 1741 CB ALA A 898 -8.242 -23.922 -2.524 1.00 11.44 C ATOM 0 H ALA A 898 -6.932 -23.074 -0.511 1.00 53.10 H new ATOM 0 HA ALA A 898 -7.707 -21.955 -3.132 1.00 12.41 H new ATOM 0 HB1 ALA A 898 -9.035 -24.006 -3.267 1.00 11.44 H new ATOM 0 HB2 ALA A 898 -7.327 -24.365 -2.917 1.00 11.44 H new ATOM 0 HB3 ALA A 898 -8.538 -24.448 -1.616 1.00 11.44 H new ATOM 1747 N THR A 899 -9.286 -21.551 -0.373 1.00 35.13 N ATOM 1748 CA THR A 899 -10.420 -20.898 0.260 1.00 21.32 C ATOM 1749 C THR A 899 -9.976 -19.605 0.946 1.00 43.45 C ATOM 1750 O THR A 899 -10.754 -18.659 1.059 1.00 52.02 O ATOM 1751 CB THR A 899 -11.069 -21.901 1.217 1.00 52.45 C ATOM 1752 OG1 THR A 899 -10.259 -21.839 2.387 1.00 64.02 O ATOM 1753 CG2 THR A 899 -10.923 -23.346 0.738 1.00 62.34 C ATOM 0 H THR A 899 -8.544 -21.833 0.267 1.00 35.13 H new ATOM 0 HA THR A 899 -11.166 -20.599 -0.476 1.00 21.32 H new ATOM 0 HB THR A 899 -12.126 -21.662 1.331 1.00 52.45 H new ATOM 0 HG1 THR A 899 -10.530 -22.545 3.010 1.00 64.02 H new ATOM 0 HG21 THR A 899 -11.400 -24.016 1.453 1.00 62.34 H new ATOM 0 HG22 THR A 899 -11.399 -23.456 -0.236 1.00 62.34 H new ATOM 0 HG23 THR A 899 -9.865 -23.597 0.656 1.00 62.34 H new ATOM 1761 N GLY A 900 -8.726 -19.604 1.385 1.00 62.41 N ATOM 1762 CA GLY A 900 -8.169 -18.442 2.056 1.00 24.31 C ATOM 1763 C GLY A 900 -8.841 -18.217 3.412 1.00 73.13 C ATOM 1764 O GLY A 900 -8.866 -17.096 3.918 1.00 24.52 O ATOM 0 H GLY A 900 -8.083 -20.390 1.289 1.00 62.41 H new ATOM 0 HA2 GLY A 900 -7.097 -18.578 2.196 1.00 24.31 H new ATOM 0 HA3 GLY A 900 -8.300 -17.559 1.430 1.00 24.31 H new ATOM 1768 N VAL A 901 -9.371 -19.300 3.961 1.00 71.42 N ATOM 1769 CA VAL A 901 -10.042 -19.235 5.248 1.00 73.22 C ATOM 1770 C VAL A 901 -9.215 -19.992 6.289 1.00 44.33 C ATOM 1771 O VAL A 901 -8.685 -21.065 6.005 1.00 30.01 O ATOM 1772 CB VAL A 901 -11.472 -19.766 5.120 1.00 3.21 C ATOM 1773 CG1 VAL A 901 -11.477 -21.210 4.615 1.00 52.11 C ATOM 1774 CG2 VAL A 901 -12.222 -19.646 6.448 1.00 25.53 C ATOM 0 H VAL A 901 -9.349 -20.228 3.538 1.00 71.42 H new ATOM 0 HA VAL A 901 -10.122 -18.201 5.585 1.00 73.22 H new ATOM 0 HB VAL A 901 -11.993 -19.153 4.385 1.00 3.21 H new ATOM 0 HG11 VAL A 901 -12.505 -21.563 4.533 1.00 52.11 H new ATOM 0 HG12 VAL A 901 -10.999 -21.255 3.637 1.00 52.11 H new ATOM 0 HG13 VAL A 901 -10.931 -21.842 5.315 1.00 52.11 H new ATOM 0 HG21 VAL A 901 -13.235 -20.030 6.330 1.00 25.53 H new ATOM 0 HG22 VAL A 901 -11.702 -20.223 7.213 1.00 25.53 H new ATOM 0 HG23 VAL A 901 -12.264 -18.599 6.749 1.00 25.53 H new ATOM 1784 N GLN A 902 -9.129 -19.402 7.472 1.00 30.11 N ATOM 1785 CA GLN A 902 -8.375 -20.007 8.557 1.00 63.12 C ATOM 1786 C GLN A 902 -9.290 -20.879 9.418 1.00 33.31 C ATOM 1787 O GLN A 902 -10.497 -20.648 9.479 1.00 2.31 O ATOM 1788 CB GLN A 902 -7.679 -18.939 9.403 1.00 35.14 C ATOM 1789 CG GLN A 902 -7.056 -17.858 8.518 1.00 23.14 C ATOM 1790 CD GLN A 902 -6.162 -16.926 9.339 1.00 23.11 C ATOM 1791 OE1 GLN A 902 -6.419 -15.742 9.480 1.00 41.25 O ATOM 1792 NE2 GLN A 902 -5.100 -17.525 9.872 1.00 53.04 N ATOM 0 H GLN A 902 -9.569 -18.511 7.703 1.00 30.11 H new ATOM 0 HA GLN A 902 -7.602 -20.643 8.126 1.00 63.12 H new ATOM 0 HB2 GLN A 902 -8.398 -18.485 10.086 1.00 35.14 H new ATOM 0 HB3 GLN A 902 -6.906 -19.402 10.016 1.00 35.14 H new ATOM 0 HG2 GLN A 902 -6.471 -18.324 7.725 1.00 23.14 H new ATOM 0 HG3 GLN A 902 -7.844 -17.280 8.035 1.00 23.14 H new ATOM 0 HE21 GLN A 902 -4.944 -18.521 9.715 1.00 53.04 H new ATOM 0 HE22 GLN A 902 -4.442 -16.989 10.438 1.00 53.04 H new ATOM 1801 N THR A 903 -8.682 -21.864 10.062 1.00 23.15 N ATOM 1802 CA THR A 903 -9.427 -22.772 10.918 1.00 71.14 C ATOM 1803 C THR A 903 -8.513 -23.364 11.992 1.00 63.42 C ATOM 1804 O THR A 903 -7.409 -23.816 11.692 1.00 24.11 O ATOM 1805 CB THR A 903 -10.082 -23.829 10.027 1.00 75.40 C ATOM 1806 OG1 THR A 903 -10.670 -23.077 8.969 1.00 13.45 O ATOM 1807 CG2 THR A 903 -11.273 -24.511 10.706 1.00 44.34 C ATOM 0 H THR A 903 -7.681 -22.054 10.008 1.00 23.15 H new ATOM 0 HA THR A 903 -10.215 -22.249 11.460 1.00 71.14 H new ATOM 0 HB THR A 903 -9.342 -24.580 9.752 1.00 75.40 H new ATOM 0 HG1 THR A 903 -11.121 -22.290 9.339 1.00 13.45 H new ATOM 0 HG21 THR A 903 -11.701 -25.252 10.031 1.00 44.34 H new ATOM 0 HG22 THR A 903 -10.938 -25.003 11.619 1.00 44.34 H new ATOM 0 HG23 THR A 903 -12.028 -23.764 10.952 1.00 44.34 H new ATOM 1815 N LEU A 904 -9.006 -23.343 13.221 1.00 34.21 N ATOM 1816 CA LEU A 904 -8.248 -23.873 14.342 1.00 44.45 C ATOM 1817 C LEU A 904 -8.912 -25.158 14.840 1.00 1.51 C ATOM 1818 O LEU A 904 -9.937 -25.108 15.519 1.00 44.22 O ATOM 1819 CB LEU A 904 -8.079 -22.807 15.426 1.00 13.50 C ATOM 1820 CG LEU A 904 -8.749 -21.459 15.151 1.00 2.51 C ATOM 1821 CD1 LEU A 904 -10.225 -21.488 15.551 1.00 11.13 C ATOM 1822 CD2 LEU A 904 -7.991 -20.320 15.837 1.00 34.04 C ATOM 0 H LEU A 904 -9.922 -22.967 13.466 1.00 34.21 H new ATOM 0 HA LEU A 904 -7.238 -24.138 14.028 1.00 44.45 H new ATOM 0 HB2 LEU A 904 -8.474 -23.203 16.362 1.00 13.50 H new ATOM 0 HB3 LEU A 904 -7.013 -22.636 15.577 1.00 13.50 H new ATOM 0 HG LEU A 904 -8.711 -21.271 14.078 1.00 2.51 H new ATOM 0 HD11 LEU A 904 -10.677 -20.518 15.345 1.00 11.13 H new ATOM 0 HD12 LEU A 904 -10.742 -22.258 14.978 1.00 11.13 H new ATOM 0 HD13 LEU A 904 -10.309 -21.709 16.615 1.00 11.13 H new ATOM 0 HD21 LEU A 904 -8.488 -19.373 15.626 1.00 34.04 H new ATOM 0 HD22 LEU A 904 -7.976 -20.490 16.914 1.00 34.04 H new ATOM 0 HD23 LEU A 904 -6.969 -20.285 15.461 1.00 34.04 H new ATOM 1834 N TYR A 905 -8.301 -26.278 14.484 1.00 32.11 N ATOM 1835 CA TYR A 905 -8.821 -27.574 14.887 1.00 45.01 C ATOM 1836 C TYR A 905 -8.723 -27.757 16.403 1.00 55.50 C ATOM 1837 O TYR A 905 -8.458 -26.801 17.131 1.00 21.30 O ATOM 1838 CB TYR A 905 -7.933 -28.615 14.202 1.00 32.30 C ATOM 1839 CG TYR A 905 -8.007 -28.587 12.674 1.00 25.11 C ATOM 1840 CD1 TYR A 905 -9.213 -28.354 12.045 1.00 4.53 C ATOM 1841 CD2 TYR A 905 -6.866 -28.795 11.925 1.00 75.25 C ATOM 1842 CE1 TYR A 905 -9.282 -28.327 10.607 1.00 4.03 C ATOM 1843 CE2 TYR A 905 -6.935 -28.769 10.486 1.00 15.34 C ATOM 1844 CZ TYR A 905 -8.140 -28.536 9.899 1.00 43.12 C ATOM 1845 OH TYR A 905 -8.205 -28.511 8.541 1.00 42.24 O ATOM 0 H TYR A 905 -7.451 -26.315 13.921 1.00 32.11 H new ATOM 0 HA TYR A 905 -9.870 -27.670 14.609 1.00 45.01 H new ATOM 0 HB2 TYR A 905 -6.899 -28.454 14.509 1.00 32.30 H new ATOM 0 HB3 TYR A 905 -8.218 -29.607 14.551 1.00 32.30 H new ATOM 0 HD1 TYR A 905 -10.105 -28.192 12.631 1.00 4.53 H new ATOM 0 HD2 TYR A 905 -5.922 -28.977 12.417 1.00 75.25 H new ATOM 0 HE1 TYR A 905 -10.219 -28.145 10.102 1.00 4.03 H new ATOM 0 HE2 TYR A 905 -6.051 -28.931 9.887 1.00 15.34 H new ATOM 0 HH TYR A 905 -7.314 -28.675 8.168 1.00 42.24 H new ATOM 1855 N SER A 906 -8.944 -28.990 16.834 1.00 40.13 N ATOM 1856 CA SER A 906 -8.885 -29.310 18.250 1.00 43.12 C ATOM 1857 C SER A 906 -7.885 -30.444 18.489 1.00 55.43 C ATOM 1858 O SER A 906 -6.991 -30.322 19.324 1.00 43.42 O ATOM 1859 CB SER A 906 -10.265 -29.697 18.785 1.00 3.02 C ATOM 1860 OG SER A 906 -10.327 -29.620 20.207 1.00 43.32 O ATOM 0 H SER A 906 -9.164 -29.780 16.227 1.00 40.13 H new ATOM 0 HA SER A 906 -8.553 -28.422 18.788 1.00 43.12 H new ATOM 0 HB2 SER A 906 -11.019 -29.039 18.353 1.00 3.02 H new ATOM 0 HB3 SER A 906 -10.506 -30.711 18.466 1.00 3.02 H new ATOM 0 HG SER A 906 -11.224 -29.873 20.509 1.00 43.32 H new ATOM 1866 N LYS A 907 -8.072 -31.521 17.740 1.00 2.04 N ATOM 1867 CA LYS A 907 -7.198 -32.676 17.860 1.00 1.32 C ATOM 1868 C LYS A 907 -6.807 -33.161 16.463 1.00 62.10 C ATOM 1869 O LYS A 907 -7.550 -32.964 15.503 1.00 72.30 O ATOM 1870 CB LYS A 907 -7.852 -33.755 18.726 1.00 44.14 C ATOM 1871 CG LYS A 907 -6.795 -34.649 19.378 1.00 73.45 C ATOM 1872 CD LYS A 907 -6.357 -34.084 20.730 1.00 70.10 C ATOM 1873 CE LYS A 907 -5.414 -32.893 20.547 1.00 60.31 C ATOM 1874 NZ LYS A 907 -4.509 -32.765 21.711 1.00 70.10 N ATOM 0 H LYS A 907 -8.815 -31.618 17.048 1.00 2.04 H new ATOM 0 HA LYS A 907 -6.275 -32.405 18.373 1.00 1.32 H new ATOM 0 HB2 LYS A 907 -8.463 -33.286 19.497 1.00 44.14 H new ATOM 0 HB3 LYS A 907 -8.520 -34.362 18.115 1.00 44.14 H new ATOM 0 HG2 LYS A 907 -7.196 -35.654 19.512 1.00 73.45 H new ATOM 0 HG3 LYS A 907 -5.931 -34.736 18.719 1.00 73.45 H new ATOM 0 HD2 LYS A 907 -7.233 -33.775 21.300 1.00 70.10 H new ATOM 0 HD3 LYS A 907 -5.859 -34.862 21.309 1.00 70.10 H new ATOM 0 HE2 LYS A 907 -4.829 -33.021 19.636 1.00 60.31 H new ATOM 0 HE3 LYS A 907 -5.994 -31.978 20.427 1.00 60.31 H new ATOM 0 HZ1 LYS A 907 -3.876 -31.952 21.571 1.00 70.10 H new ATOM 0 HZ2 LYS A 907 -5.071 -32.621 22.574 1.00 70.10 H new ATOM 0 HZ3 LYS A 907 -3.943 -33.632 21.808 1.00 70.10 H new ATOM 1887 N TRP A 908 -5.641 -33.786 16.393 1.00 23.14 N ATOM 1888 CA TRP A 908 -5.142 -34.301 15.130 1.00 61.25 C ATOM 1889 C TRP A 908 -6.222 -35.203 14.527 1.00 4.33 C ATOM 1890 O TRP A 908 -6.270 -35.392 13.313 1.00 75.51 O ATOM 1891 CB TRP A 908 -3.803 -35.017 15.319 1.00 11.23 C ATOM 1892 CG TRP A 908 -2.775 -34.213 16.118 1.00 52.53 C ATOM 1893 CD1 TRP A 908 -2.158 -33.078 15.761 1.00 13.42 C ATOM 1894 CD2 TRP A 908 -2.266 -34.530 17.430 1.00 34.24 C ATOM 1895 NE1 TRP A 908 -1.293 -32.642 16.744 1.00 64.31 N ATOM 1896 CE2 TRP A 908 -1.361 -33.554 17.791 1.00 4.32 C ATOM 1897 CE3 TRP A 908 -2.562 -35.607 18.285 1.00 71.03 C ATOM 1898 CZ2 TRP A 908 -0.676 -33.556 19.013 1.00 73.44 C ATOM 1899 CZ3 TRP A 908 -1.870 -35.595 19.502 1.00 62.35 C ATOM 1900 CH2 TRP A 908 -0.955 -34.620 19.880 1.00 43.34 C ATOM 0 H TRP A 908 -5.027 -33.947 17.191 1.00 23.14 H new ATOM 0 HA TRP A 908 -4.940 -33.486 14.435 1.00 61.25 H new ATOM 0 HB2 TRP A 908 -3.979 -35.967 15.824 1.00 11.23 H new ATOM 0 HB3 TRP A 908 -3.385 -35.250 14.339 1.00 11.23 H new ATOM 0 HD1 TRP A 908 -2.318 -32.569 14.822 1.00 13.42 H new ATOM 0 HE1 TRP A 908 -0.711 -31.805 16.709 1.00 64.31 H new ATOM 0 HE3 TRP A 908 -3.267 -36.382 18.023 1.00 71.03 H new ATOM 0 HZ2 TRP A 908 0.029 -32.780 19.272 1.00 73.44 H new ATOM 0 HZ3 TRP A 908 -2.061 -36.400 20.196 1.00 62.35 H new ATOM 0 HH2 TRP A 908 -0.461 -34.682 20.838 1.00 43.34 H new ATOM 1911 N LYS A 909 -7.060 -35.734 15.404 1.00 34.33 N ATOM 1912 CA LYS A 909 -8.136 -36.611 14.974 1.00 32.33 C ATOM 1913 C LYS A 909 -9.003 -35.882 13.946 1.00 42.31 C ATOM 1914 O LYS A 909 -9.461 -36.484 12.976 1.00 10.21 O ATOM 1915 CB LYS A 909 -8.920 -37.130 16.182 1.00 42.32 C ATOM 1916 CG LYS A 909 -10.100 -36.212 16.505 1.00 54.53 C ATOM 1917 CD LYS A 909 -10.946 -36.786 17.643 1.00 12.41 C ATOM 1918 CE LYS A 909 -10.069 -37.177 18.834 1.00 31.20 C ATOM 1919 NZ LYS A 909 -10.894 -37.348 20.051 1.00 62.30 N ATOM 0 H LYS A 909 -7.016 -35.574 16.410 1.00 34.33 H new ATOM 0 HA LYS A 909 -7.732 -37.495 14.481 1.00 32.33 H new ATOM 0 HB2 LYS A 909 -9.283 -38.137 15.979 1.00 42.32 H new ATOM 0 HB3 LYS A 909 -8.260 -37.198 17.047 1.00 42.32 H new ATOM 0 HG2 LYS A 909 -9.732 -35.225 16.783 1.00 54.53 H new ATOM 0 HG3 LYS A 909 -10.718 -36.083 15.617 1.00 54.53 H new ATOM 0 HD2 LYS A 909 -11.686 -36.050 17.958 1.00 12.41 H new ATOM 0 HD3 LYS A 909 -11.495 -37.659 17.289 1.00 12.41 H new ATOM 0 HE2 LYS A 909 -9.539 -38.103 18.614 1.00 31.20 H new ATOM 0 HE3 LYS A 909 -9.314 -36.410 19.004 1.00 31.20 H new ATOM 0 HZ1 LYS A 909 -10.283 -37.613 20.850 1.00 62.30 H new ATOM 0 HZ2 LYS A 909 -11.381 -36.455 20.269 1.00 62.30 H new ATOM 0 HZ3 LYS A 909 -11.598 -38.096 19.891 1.00 62.30 H new ATOM 1932 N ASP A 910 -9.202 -34.595 14.193 1.00 64.31 N ATOM 1933 CA ASP A 910 -10.005 -33.777 13.300 1.00 31.35 C ATOM 1934 C ASP A 910 -9.275 -33.619 11.965 1.00 33.11 C ATOM 1935 O ASP A 910 -9.898 -33.333 10.944 1.00 42.15 O ATOM 1936 CB ASP A 910 -10.229 -32.381 13.885 1.00 32.31 C ATOM 1937 CG ASP A 910 -11.143 -31.474 13.059 1.00 0.54 C ATOM 1938 OD1 ASP A 910 -11.029 -31.403 11.827 1.00 63.33 O ATOM 1939 OD2 ASP A 910 -12.014 -30.810 13.742 1.00 22.41 O ATOM 0 H ASP A 910 -8.821 -34.099 14.999 1.00 64.31 H new ATOM 0 HA ASP A 910 -10.968 -34.270 13.165 1.00 31.35 H new ATOM 0 HB2 ASP A 910 -10.652 -32.486 14.884 1.00 32.31 H new ATOM 0 HB3 ASP A 910 -9.262 -31.891 13.998 1.00 32.31 H new ATOM 1945 N PHE A 911 -7.966 -33.812 12.016 1.00 24.25 N ATOM 1946 CA PHE A 911 -7.144 -33.695 10.824 1.00 54.44 C ATOM 1947 C PHE A 911 -7.324 -34.910 9.912 1.00 55.02 C ATOM 1948 O PHE A 911 -7.699 -35.987 10.374 1.00 41.24 O ATOM 1949 CB PHE A 911 -5.688 -33.631 11.288 1.00 61.43 C ATOM 1950 CG PHE A 911 -4.877 -32.507 10.640 1.00 24.41 C ATOM 1951 CD1 PHE A 911 -4.556 -32.574 9.320 1.00 12.50 C ATOM 1952 CD2 PHE A 911 -4.476 -31.442 11.385 1.00 61.05 C ATOM 1953 CE1 PHE A 911 -3.803 -31.530 8.719 1.00 74.30 C ATOM 1954 CE2 PHE A 911 -3.723 -30.399 10.784 1.00 51.15 C ATOM 1955 CZ PHE A 911 -3.403 -30.465 9.463 1.00 3.15 C ATOM 0 H PHE A 911 -7.453 -34.049 12.865 1.00 24.25 H new ATOM 0 HA PHE A 911 -7.430 -32.807 10.261 1.00 54.44 H new ATOM 0 HB2 PHE A 911 -5.668 -33.502 12.370 1.00 61.43 H new ATOM 0 HB3 PHE A 911 -5.206 -34.584 11.071 1.00 61.43 H new ATOM 0 HD1 PHE A 911 -4.873 -33.420 8.729 1.00 12.50 H new ATOM 0 HD2 PHE A 911 -4.730 -31.390 12.433 1.00 61.05 H new ATOM 0 HE1 PHE A 911 -3.548 -31.582 7.671 1.00 74.30 H new ATOM 0 HE2 PHE A 911 -3.404 -29.553 11.375 1.00 51.15 H new ATOM 0 HZ PHE A 911 -2.831 -29.671 9.006 1.00 3.15 H new ATOM 1965 N HIS A 912 -7.049 -34.697 8.633 1.00 14.44 N ATOM 1966 CA HIS A 912 -7.176 -35.761 7.653 1.00 74.32 C ATOM 1967 C HIS A 912 -5.856 -35.922 6.896 1.00 74.00 C ATOM 1968 O HIS A 912 -5.851 -36.278 5.719 1.00 41.14 O ATOM 1969 CB HIS A 912 -8.365 -35.505 6.724 1.00 20.50 C ATOM 1970 CG HIS A 912 -9.019 -36.763 6.203 1.00 44.15 C ATOM 1971 ND1 HIS A 912 -9.976 -37.462 6.917 1.00 52.32 N ATOM 1972 CD2 HIS A 912 -8.843 -37.438 5.031 1.00 73.44 C ATOM 1973 CE1 HIS A 912 -10.352 -38.509 6.198 1.00 34.21 C ATOM 1974 NE2 HIS A 912 -9.649 -38.493 5.030 1.00 63.33 N ATOM 0 H HIS A 912 -6.739 -33.803 8.253 1.00 14.44 H new ATOM 0 HA HIS A 912 -7.382 -36.704 8.159 1.00 74.32 H new ATOM 0 HB2 HIS A 912 -9.110 -34.915 7.258 1.00 20.50 H new ATOM 0 HB3 HIS A 912 -8.030 -34.905 5.878 1.00 20.50 H new ATOM 0 HD2 HIS A 912 -8.163 -37.161 4.238 1.00 73.44 H new ATOM 0 HE1 HIS A 912 -11.087 -39.246 6.486 1.00 34.21 H new ATOM 0 HE2 HIS A 912 -9.729 -39.179 4.279 1.00 63.33 H new ATOM 1982 N PHE A 913 -4.769 -35.652 7.603 1.00 12.23 N ATOM 1983 CA PHE A 913 -3.446 -35.762 7.013 1.00 1.13 C ATOM 1984 C PHE A 913 -3.106 -37.220 6.696 1.00 14.25 C ATOM 1985 O PHE A 913 -3.986 -38.080 6.696 1.00 41.34 O ATOM 1986 CB PHE A 913 -2.450 -35.232 8.047 1.00 40.35 C ATOM 1987 CG PHE A 913 -1.314 -34.401 7.446 1.00 1.34 C ATOM 1988 CD1 PHE A 913 -1.595 -33.382 6.590 1.00 33.32 C ATOM 1989 CD2 PHE A 913 -0.023 -34.681 7.769 1.00 2.34 C ATOM 1990 CE1 PHE A 913 -0.541 -32.611 6.033 1.00 21.14 C ATOM 1991 CE2 PHE A 913 1.031 -33.910 7.213 1.00 45.55 C ATOM 1992 CZ PHE A 913 0.750 -32.891 6.356 1.00 2.03 C ATOM 0 H PHE A 913 -4.777 -35.357 8.579 1.00 12.23 H new ATOM 0 HA PHE A 913 -3.406 -35.197 6.082 1.00 1.13 H new ATOM 0 HB2 PHE A 913 -2.986 -34.623 8.775 1.00 40.35 H new ATOM 0 HB3 PHE A 913 -2.022 -36.075 8.590 1.00 40.35 H new ATOM 0 HD1 PHE A 913 -2.620 -33.159 6.334 1.00 33.32 H new ATOM 0 HD2 PHE A 913 0.200 -35.490 8.449 1.00 2.34 H new ATOM 0 HE1 PHE A 913 -0.764 -31.802 5.353 1.00 21.14 H new ATOM 0 HE2 PHE A 913 2.056 -34.132 7.470 1.00 45.55 H new ATOM 0 HZ PHE A 913 1.552 -32.305 5.932 1.00 2.03 H new ATOM 2002 N GLU A 914 -1.829 -37.453 6.435 1.00 24.11 N ATOM 2003 CA GLU A 914 -1.362 -38.792 6.118 1.00 60.05 C ATOM 2004 C GLU A 914 0.020 -39.031 6.728 1.00 24.11 C ATOM 2005 O GLU A 914 0.656 -38.099 7.218 1.00 62.01 O ATOM 2006 CB GLU A 914 -1.340 -39.021 4.605 1.00 53.31 C ATOM 2007 CG GLU A 914 -0.054 -38.471 3.986 1.00 43.23 C ATOM 2008 CD GLU A 914 -0.137 -38.471 2.458 1.00 60.21 C ATOM 2009 OE1 GLU A 914 0.018 -39.529 1.829 1.00 53.41 O ATOM 2010 OE2 GLU A 914 -0.373 -37.321 1.924 1.00 2.44 O ATOM 0 H GLU A 914 -1.102 -36.737 6.436 1.00 24.11 H new ATOM 0 HA GLU A 914 -2.058 -39.510 6.552 1.00 60.05 H new ATOM 0 HB2 GLU A 914 -1.422 -40.087 4.394 1.00 53.31 H new ATOM 0 HB3 GLU A 914 -2.203 -38.538 4.148 1.00 53.31 H new ATOM 0 HG2 GLU A 914 0.121 -37.457 4.344 1.00 43.23 H new ATOM 0 HG3 GLU A 914 0.795 -39.074 4.308 1.00 43.23 H new ATOM 2018 N LYS A 915 0.445 -40.285 6.679 1.00 60.22 N ATOM 2019 CA LYS A 915 1.740 -40.659 7.221 1.00 44.50 C ATOM 2020 C LYS A 915 2.813 -40.463 6.148 1.00 42.32 C ATOM 2021 O LYS A 915 2.685 -40.974 5.037 1.00 63.34 O ATOM 2022 CB LYS A 915 1.693 -42.077 7.792 1.00 25.21 C ATOM 2023 CG LYS A 915 1.263 -43.084 6.724 1.00 72.32 C ATOM 2024 CD LYS A 915 1.874 -44.461 6.991 1.00 73.54 C ATOM 2025 CE LYS A 915 3.186 -44.637 6.223 1.00 34.33 C ATOM 2026 NZ LYS A 915 2.917 -44.945 4.801 1.00 52.13 N ATOM 0 H LYS A 915 -0.085 -41.055 6.272 1.00 60.22 H new ATOM 0 HA LYS A 915 2.004 -40.012 8.058 1.00 44.50 H new ATOM 0 HB2 LYS A 915 2.675 -42.349 8.180 1.00 25.21 H new ATOM 0 HB3 LYS A 915 0.998 -42.112 8.631 1.00 25.21 H new ATOM 0 HG2 LYS A 915 0.176 -43.161 6.709 1.00 72.32 H new ATOM 0 HG3 LYS A 915 1.571 -42.730 5.740 1.00 72.32 H new ATOM 0 HD2 LYS A 915 2.055 -44.582 8.059 1.00 73.54 H new ATOM 0 HD3 LYS A 915 1.169 -45.239 6.697 1.00 73.54 H new ATOM 0 HE2 LYS A 915 3.783 -43.728 6.298 1.00 34.33 H new ATOM 0 HE3 LYS A 915 3.771 -45.440 6.671 1.00 34.33 H new ATOM 0 HZ1 LYS A 915 3.815 -45.128 4.310 1.00 52.13 H new ATOM 0 HZ2 LYS A 915 2.309 -45.787 4.737 1.00 52.13 H new ATOM 0 HZ3 LYS A 915 2.437 -44.137 4.356 1.00 52.13 H new ATOM 2039 N ILE A 916 3.847 -39.721 6.518 1.00 13.01 N ATOM 2040 CA ILE A 916 4.941 -39.451 5.601 1.00 21.30 C ATOM 2041 C ILE A 916 6.272 -39.638 6.333 1.00 73.33 C ATOM 2042 O ILE A 916 6.406 -39.253 7.493 1.00 51.41 O ATOM 2043 CB ILE A 916 4.778 -38.070 4.964 1.00 3.32 C ATOM 2044 CG1 ILE A 916 3.355 -37.872 4.439 1.00 33.05 C ATOM 2045 CG2 ILE A 916 5.828 -37.841 3.874 1.00 32.25 C ATOM 2046 CD1 ILE A 916 3.056 -36.389 4.210 1.00 33.14 C ATOM 0 H ILE A 916 3.950 -39.298 7.441 1.00 13.01 H new ATOM 0 HA ILE A 916 4.929 -40.161 4.774 1.00 21.30 H new ATOM 0 HB ILE A 916 4.944 -37.317 5.735 1.00 3.32 H new ATOM 0 HG12 ILE A 916 3.228 -38.420 3.506 1.00 33.05 H new ATOM 0 HG13 ILE A 916 2.640 -38.285 5.151 1.00 33.05 H new ATOM 0 HG21 ILE A 916 5.690 -36.852 3.438 1.00 32.25 H new ATOM 0 HG22 ILE A 916 6.825 -37.909 4.309 1.00 32.25 H new ATOM 0 HG23 ILE A 916 5.718 -38.599 3.098 1.00 32.25 H new ATOM 0 HD11 ILE A 916 2.038 -36.276 3.837 1.00 33.14 H new ATOM 0 HD12 ILE A 916 3.160 -35.847 5.150 1.00 33.14 H new ATOM 0 HD13 ILE A 916 3.757 -35.985 3.480 1.00 33.14 H new ATOM 2058 N PRO A 917 7.247 -40.246 5.605 1.00 21.14 N ATOM 2059 CA PRO A 917 8.562 -40.489 6.173 1.00 64.01 C ATOM 2060 C PRO A 917 9.375 -39.195 6.246 1.00 4.03 C ATOM 2061 O PRO A 917 9.618 -38.551 5.227 1.00 73.13 O ATOM 2062 CB PRO A 917 9.193 -41.536 5.270 1.00 61.42 C ATOM 2063 CG PRO A 917 8.401 -41.501 3.973 1.00 13.51 C ATOM 2064 CD PRO A 917 7.124 -40.716 4.229 1.00 70.43 C ATOM 0 HA PRO A 917 8.516 -40.845 7.202 1.00 64.01 H new ATOM 0 HB2 PRO A 917 10.245 -41.314 5.091 1.00 61.42 H new ATOM 0 HB3 PRO A 917 9.149 -42.524 5.728 1.00 61.42 H new ATOM 0 HG2 PRO A 917 8.985 -41.032 3.181 1.00 13.51 H new ATOM 0 HG3 PRO A 917 8.167 -42.512 3.641 1.00 13.51 H new ATOM 0 HD2 PRO A 917 7.025 -39.883 3.533 1.00 70.43 H new ATOM 0 HD3 PRO A 917 6.242 -41.343 4.102 1.00 70.43 H new ATOM 2072 N PHE A 918 9.775 -38.853 7.462 1.00 15.25 N ATOM 2073 CA PHE A 918 10.555 -37.647 7.682 1.00 25.33 C ATOM 2074 C PHE A 918 11.933 -37.759 7.026 1.00 51.02 C ATOM 2075 O PHE A 918 12.863 -38.307 7.615 1.00 30.23 O ATOM 2076 CB PHE A 918 10.735 -37.500 9.195 1.00 71.34 C ATOM 2077 CG PHE A 918 11.061 -36.076 9.647 1.00 44.51 C ATOM 2078 CD1 PHE A 918 12.259 -35.518 9.325 1.00 41.53 C ATOM 2079 CD2 PHE A 918 10.154 -35.367 10.371 1.00 20.20 C ATOM 2080 CE1 PHE A 918 12.562 -34.195 9.744 1.00 22.45 C ATOM 2081 CE2 PHE A 918 10.457 -34.045 10.791 1.00 41.01 C ATOM 2082 CZ PHE A 918 11.655 -33.487 10.469 1.00 51.03 C ATOM 0 H PHE A 918 9.573 -39.390 8.305 1.00 15.25 H new ATOM 0 HA PHE A 918 10.043 -36.788 7.248 1.00 25.33 H new ATOM 0 HB2 PHE A 918 9.823 -37.828 9.693 1.00 71.34 H new ATOM 0 HB3 PHE A 918 11.534 -38.166 9.522 1.00 71.34 H new ATOM 0 HD1 PHE A 918 12.980 -36.081 8.751 1.00 41.53 H new ATOM 0 HD2 PHE A 918 9.203 -35.810 10.627 1.00 20.20 H new ATOM 0 HE1 PHE A 918 13.513 -33.751 9.487 1.00 22.45 H new ATOM 0 HE2 PHE A 918 9.736 -33.483 11.366 1.00 41.01 H new ATOM 0 HZ PHE A 918 11.886 -32.482 10.789 1.00 51.03 H new ATOM 2092 N ASP A 919 12.020 -37.230 5.814 1.00 21.30 N ATOM 2093 CA ASP A 919 13.268 -37.264 5.071 1.00 44.40 C ATOM 2094 C ASP A 919 14.244 -36.253 5.676 1.00 5.15 C ATOM 2095 O ASP A 919 13.872 -35.114 5.953 1.00 40.21 O ATOM 2096 CB ASP A 919 13.047 -36.887 3.605 1.00 52.02 C ATOM 2097 CG ASP A 919 12.777 -38.066 2.668 1.00 74.10 C ATOM 2098 OD1 ASP A 919 13.707 -38.653 2.096 1.00 72.24 O ATOM 2099 OD2 ASP A 919 11.533 -38.382 2.534 1.00 40.34 O ATOM 0 H ASP A 919 11.247 -36.776 5.328 1.00 21.30 H new ATOM 0 HA ASP A 919 13.666 -38.277 5.127 1.00 44.40 H new ATOM 0 HB2 ASP A 919 12.206 -36.196 3.546 1.00 52.02 H new ATOM 0 HB3 ASP A 919 13.926 -36.351 3.247 1.00 52.02 H new ATOM 2105 N PRO A 920 15.508 -36.718 5.870 1.00 74.53 N ATOM 2106 CA PRO A 920 16.540 -35.868 6.437 1.00 30.13 C ATOM 2107 C PRO A 920 17.036 -34.848 5.411 1.00 51.15 C ATOM 2108 O PRO A 920 17.632 -33.835 5.774 1.00 33.13 O ATOM 2109 CB PRO A 920 17.628 -36.824 6.898 1.00 60.30 C ATOM 2110 CG PRO A 920 17.378 -38.128 6.157 1.00 3.11 C ATOM 2111 CD PRO A 920 15.985 -38.062 5.554 1.00 13.21 C ATOM 0 HA PRO A 920 16.178 -35.266 7.270 1.00 30.13 H new ATOM 0 HB2 PRO A 920 18.618 -36.429 6.670 1.00 60.30 H new ATOM 0 HB3 PRO A 920 17.585 -36.973 7.977 1.00 60.30 H new ATOM 0 HG2 PRO A 920 18.125 -38.273 5.377 1.00 3.11 H new ATOM 0 HG3 PRO A 920 17.459 -38.975 6.838 1.00 3.11 H new ATOM 0 HD2 PRO A 920 16.011 -38.230 4.477 1.00 13.21 H new ATOM 0 HD3 PRO A 920 15.333 -38.824 5.980 1.00 13.21 H new ATOM 2119 N ALA A 921 16.772 -35.150 4.148 1.00 34.40 N ATOM 2120 CA ALA A 921 17.183 -34.272 3.066 1.00 24.20 C ATOM 2121 C ALA A 921 16.420 -32.950 3.169 1.00 30.32 C ATOM 2122 O ALA A 921 16.850 -31.936 2.622 1.00 65.41 O ATOM 2123 CB ALA A 921 16.957 -34.973 1.725 1.00 30.21 C ATOM 0 H ALA A 921 16.278 -35.991 3.850 1.00 34.40 H new ATOM 0 HA ALA A 921 18.247 -34.045 3.140 1.00 24.20 H new ATOM 0 HB1 ALA A 921 17.265 -34.314 0.913 1.00 30.21 H new ATOM 0 HB2 ALA A 921 17.544 -35.891 1.691 1.00 30.21 H new ATOM 0 HB3 ALA A 921 15.900 -35.215 1.614 1.00 30.21 H new ATOM 2129 N GLU A 922 15.300 -33.004 3.875 1.00 72.33 N ATOM 2130 CA GLU A 922 14.472 -31.824 4.057 1.00 43.24 C ATOM 2131 C GLU A 922 14.958 -31.015 5.261 1.00 23.42 C ATOM 2132 O GLU A 922 14.898 -29.787 5.254 1.00 12.20 O ATOM 2133 CB GLU A 922 12.999 -32.206 4.211 1.00 52.41 C ATOM 2134 CG GLU A 922 12.670 -33.461 3.401 1.00 20.42 C ATOM 2135 CD GLU A 922 11.219 -33.436 2.916 1.00 63.45 C ATOM 2136 OE1 GLU A 922 10.586 -34.496 2.800 1.00 32.12 O ATOM 2137 OE2 GLU A 922 10.752 -32.263 2.655 1.00 52.31 O ATOM 0 H GLU A 922 14.947 -33.847 4.328 1.00 72.33 H new ATOM 0 HA GLU A 922 14.560 -31.201 3.167 1.00 43.24 H new ATOM 0 HB2 GLU A 922 12.773 -32.378 5.263 1.00 52.41 H new ATOM 0 HB3 GLU A 922 12.369 -31.380 3.880 1.00 52.41 H new ATOM 0 HG2 GLU A 922 13.342 -33.533 2.546 1.00 20.42 H new ATOM 0 HG3 GLU A 922 12.837 -34.347 4.013 1.00 20.42 H new ATOM 2145 N MET A 923 15.429 -31.738 6.267 1.00 4.41 N ATOM 2146 CA MET A 923 15.926 -31.103 7.476 1.00 14.23 C ATOM 2147 C MET A 923 17.183 -30.280 7.187 1.00 32.04 C ATOM 2148 O MET A 923 17.384 -29.220 7.777 1.00 1.44 O ATOM 2149 CB MET A 923 16.245 -32.174 8.521 1.00 1.11 C ATOM 2150 CG MET A 923 16.128 -31.609 9.938 1.00 24.34 C ATOM 2151 SD MET A 923 17.243 -32.473 11.033 1.00 2.50 S ATOM 2152 CE MET A 923 16.194 -33.824 11.542 1.00 55.40 C ATOM 0 H MET A 923 15.477 -32.757 6.270 1.00 4.41 H new ATOM 0 HA MET A 923 15.155 -30.432 7.854 1.00 14.23 H new ATOM 0 HB2 MET A 923 15.563 -33.016 8.404 1.00 1.11 H new ATOM 0 HB3 MET A 923 17.253 -32.556 8.360 1.00 1.11 H new ATOM 0 HG2 MET A 923 16.361 -30.544 9.934 1.00 24.34 H new ATOM 0 HG3 MET A 923 15.103 -31.710 10.295 1.00 24.34 H new ATOM 0 HE1 MET A 923 16.771 -34.748 11.554 1.00 55.40 H new ATOM 0 HE2 MET A 923 15.805 -33.626 12.541 1.00 55.40 H new ATOM 0 HE3 MET A 923 15.364 -33.924 10.842 1.00 55.40 H new ATOM 2162 N SER A 924 17.996 -30.800 6.280 1.00 51.12 N ATOM 2163 CA SER A 924 19.228 -30.127 5.906 1.00 40.35 C ATOM 2164 C SER A 924 19.014 -29.318 4.625 1.00 51.53 C ATOM 2165 O SER A 924 18.008 -29.490 3.938 1.00 61.10 O ATOM 2166 CB SER A 924 20.368 -31.129 5.715 1.00 33.55 C ATOM 2167 OG SER A 924 19.900 -32.381 5.219 1.00 25.04 O ATOM 0 H SER A 924 17.826 -31.680 5.793 1.00 51.12 H new ATOM 0 HA SER A 924 19.506 -29.451 6.714 1.00 40.35 H new ATOM 0 HB2 SER A 924 21.102 -30.716 5.023 1.00 33.55 H new ATOM 0 HB3 SER A 924 20.878 -31.283 6.666 1.00 33.55 H new ATOM 0 HG SER A 924 20.657 -32.993 5.109 1.00 25.04 H new ATOM 2173 N LYS A 925 19.976 -28.452 4.342 1.00 2.21 N ATOM 2174 CA LYS A 925 19.906 -27.615 3.156 1.00 74.41 C ATOM 2175 C LYS A 925 19.835 -28.505 1.913 1.00 31.13 C ATOM 2176 O LYS A 925 20.759 -29.269 1.639 1.00 30.21 O ATOM 2177 CB LYS A 925 21.066 -26.619 3.133 1.00 3.34 C ATOM 2178 CG LYS A 925 20.782 -25.468 2.166 1.00 62.25 C ATOM 2179 CD LYS A 925 22.084 -24.860 1.640 1.00 0.42 C ATOM 2180 CE LYS A 925 22.699 -25.738 0.549 1.00 31.51 C ATOM 2181 NZ LYS A 925 22.136 -25.391 -0.775 1.00 1.22 N ATOM 0 H LYS A 925 20.809 -28.312 4.914 1.00 2.21 H new ATOM 0 HA LYS A 925 18.999 -27.011 3.169 1.00 74.41 H new ATOM 0 HB2 LYS A 925 21.231 -26.224 4.136 1.00 3.34 H new ATOM 0 HB3 LYS A 925 21.982 -27.130 2.837 1.00 3.34 H new ATOM 0 HG2 LYS A 925 20.182 -25.829 1.331 1.00 62.25 H new ATOM 0 HG3 LYS A 925 20.196 -24.700 2.671 1.00 62.25 H new ATOM 0 HD2 LYS A 925 21.890 -23.864 1.243 1.00 0.42 H new ATOM 0 HD3 LYS A 925 22.792 -24.744 2.460 1.00 0.42 H new ATOM 0 HE2 LYS A 925 23.781 -25.607 0.536 1.00 31.51 H new ATOM 0 HE3 LYS A 925 22.507 -26.788 0.768 1.00 31.51 H new ATOM 0 HZ1 LYS A 925 22.564 -25.997 -1.504 1.00 1.22 H new ATOM 0 HZ2 LYS A 925 21.107 -25.538 -0.764 1.00 1.22 H new ATOM 0 HZ3 LYS A 925 22.341 -24.394 -0.989 1.00 1.22 H new