USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 667 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 451 LYS NZ :NH3+ -119:sc= 0 (180deg=-0.105) USER MOD Set 1.2: A 455 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.512) USER MOD Single : A 379 SER OG : rot -87:sc= 1.23 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.03) USER MOD Single : A 389 LYS NZ :NH3+ -165:sc= 0.148 (180deg=0.0867) USER MOD Single : A 391 GLN : amide:sc=-0.00614 X(o=-0.0061,f=-0.27) USER MOD Single : A 392 TYR OH : rot 30:sc= -0.119 USER MOD Single : A 395 GLN : amide:sc= -0.218 K(o=-0.22,f=-2.8!) USER MOD Single : A 403 LYS NZ :NH3+ -160:sc= -0.0177 (180deg=-0.218) USER MOD Single : A 404 LYS NZ :NH3+ -169:sc=-0.00538 (180deg=-0.153) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0 USER MOD Single : A 407 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00531) USER MOD Single : A 409 TYR OH : rot 180:sc= 0 USER MOD Single : A 415 MET CE :methyl 145:sc= -3.87! (180deg=-5.53!) USER MOD Single : A 417 THR OG1 : rot 79:sc= 0.842 USER MOD Single : A 418 LYS NZ :NH3+ 169:sc= -0.0663 (180deg=-0.267) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 THR OG1 : rot 170:sc= -1.51 USER MOD Single : A 431 GLN : amide:sc= -0.409 K(o=-0.41,f=-1.9) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.0144 X(o=-0.014,f=-0.02) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.262 K(o=-0.26,f=-2.8!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 -1.096 16.838 1.108 1.00 0.00 N ATOM 44 CA SER A 379 -0.031 15.838 1.063 1.00 0.00 C ATOM 45 C SER A 379 -0.151 14.844 2.217 1.00 0.00 C ATOM 46 O SER A 379 0.300 13.704 2.112 1.00 0.00 O ATOM 47 CB SER A 379 1.339 16.523 1.105 1.00 0.00 C ATOM 48 OG SER A 379 1.207 17.932 1.169 1.00 0.00 O ATOM 0 HA SER A 379 -0.131 15.286 0.128 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.899 16.168 1.970 1.00 0.00 H new ATOM 0 HB3 SER A 379 1.913 16.249 0.220 1.00 0.00 H new ATOM 0 HG SER A 379 1.128 18.295 0.262 1.00 0.00 H new ATOM 54 N ILE A 380 -0.757 15.281 3.318 1.00 0.00 N ATOM 55 CA ILE A 380 -0.925 14.421 4.484 1.00 0.00 C ATOM 56 C ILE A 380 -2.116 13.481 4.314 1.00 0.00 C ATOM 57 O ILE A 380 -2.034 12.297 4.637 1.00 0.00 O ATOM 58 CB ILE A 380 -1.110 15.245 5.775 1.00 0.00 C ATOM 59 CG1 ILE A 380 -1.078 14.328 6.999 1.00 0.00 C ATOM 60 CG2 ILE A 380 -2.411 16.035 5.730 1.00 0.00 C ATOM 61 CD1 ILE A 380 0.231 14.377 7.757 1.00 0.00 C ATOM 0 H ILE A 380 -1.138 16.221 3.426 1.00 0.00 H new ATOM 0 HA ILE A 380 -0.013 13.830 4.570 1.00 0.00 H new ATOM 0 HB ILE A 380 -0.286 15.955 5.851 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -1.889 14.606 7.672 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.266 13.303 6.680 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -2.520 16.608 6.650 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -2.394 16.715 4.878 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -3.251 15.348 5.629 1.00 0.00 H new ATOM 0 HD11 ILE A 380 0.182 13.702 8.612 1.00 0.00 H new ATOM 0 HD12 ILE A 380 1.044 14.070 7.099 1.00 0.00 H new ATOM 0 HD13 ILE A 380 0.411 15.394 8.107 1.00 0.00 H new ATOM 73 N LYS A 381 -3.222 14.015 3.807 1.00 0.00 N ATOM 74 CA LYS A 381 -4.428 13.220 3.598 1.00 0.00 C ATOM 75 C LYS A 381 -4.147 12.027 2.690 1.00 0.00 C ATOM 76 O LYS A 381 -4.649 10.925 2.921 1.00 0.00 O ATOM 77 CB LYS A 381 -5.537 14.085 2.994 1.00 0.00 C ATOM 78 CG LYS A 381 -6.311 14.890 4.024 1.00 0.00 C ATOM 79 CD LYS A 381 -7.207 13.999 4.869 1.00 0.00 C ATOM 80 CE LYS A 381 -8.643 14.020 4.370 1.00 0.00 C ATOM 81 NZ LYS A 381 -9.492 14.952 5.161 1.00 0.00 N ATOM 0 H LYS A 381 -3.309 14.994 3.533 1.00 0.00 H new ATOM 0 HA LYS A 381 -4.756 12.845 4.568 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -5.098 14.768 2.267 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -6.231 13.444 2.450 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -5.613 15.423 4.670 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.917 15.643 3.519 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.829 12.977 4.849 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -7.176 14.330 5.907 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -8.659 14.316 3.321 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -9.061 13.015 4.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -10.463 14.937 4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -9.498 14.655 6.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -9.109 15.916 5.090 1.00 0.00 H new ATOM 95 N LYS A 382 -3.342 12.253 1.658 1.00 0.00 N ATOM 96 CA LYS A 382 -2.996 11.198 0.714 1.00 0.00 C ATOM 97 C LYS A 382 -2.223 10.078 1.404 1.00 0.00 C ATOM 98 O LYS A 382 -2.620 8.913 1.353 1.00 0.00 O ATOM 99 CB LYS A 382 -2.168 11.770 -0.440 1.00 0.00 C ATOM 100 CG LYS A 382 -2.982 12.038 -1.695 1.00 0.00 C ATOM 101 CD LYS A 382 -3.378 13.503 -1.801 1.00 0.00 C ATOM 102 CE LYS A 382 -4.805 13.730 -1.326 1.00 0.00 C ATOM 103 NZ LYS A 382 -5.505 14.762 -2.139 1.00 0.00 N ATOM 0 H LYS A 382 -2.917 13.158 1.454 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.922 10.782 0.318 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.699 12.699 -0.115 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.364 11.074 -0.680 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -2.403 11.752 -2.573 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -3.878 11.417 -1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -2.695 14.110 -1.207 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -3.281 13.834 -2.835 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -5.358 12.792 -1.377 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -4.795 14.038 -0.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -6.474 14.886 -1.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -4.992 15.664 -2.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -5.538 14.457 -3.133 1.00 0.00 H new ATOM 117 N ILE A 383 -1.113 10.435 2.047 1.00 0.00 N ATOM 118 CA ILE A 383 -0.284 9.458 2.741 1.00 0.00 C ATOM 119 C ILE A 383 -1.088 8.698 3.795 1.00 0.00 C ATOM 120 O ILE A 383 -0.880 7.501 4.002 1.00 0.00 O ATOM 121 CB ILE A 383 0.933 10.125 3.411 1.00 0.00 C ATOM 122 CG1 ILE A 383 0.480 11.192 4.409 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.846 10.736 2.356 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.609 11.757 5.242 1.00 0.00 C ATOM 0 H ILE A 383 -0.769 11.394 2.101 1.00 0.00 H new ATOM 0 HA ILE A 383 0.071 8.754 1.988 1.00 0.00 H new ATOM 0 HB ILE A 383 1.490 9.362 3.955 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -0.002 12.005 3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.271 10.762 5.072 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.702 11.204 2.842 1.00 0.00 H new ATOM 0 HG22 ILE A 383 2.195 9.955 1.680 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.296 11.487 1.789 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.215 12.508 5.927 1.00 0.00 H new ATOM 0 HD12 ILE A 383 2.077 10.955 5.812 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.350 12.216 4.587 1.00 0.00 H new ATOM 136 N ILE A 384 -2.013 9.394 4.452 1.00 0.00 N ATOM 137 CA ILE A 384 -2.848 8.772 5.472 1.00 0.00 C ATOM 138 C ILE A 384 -3.762 7.722 4.846 1.00 0.00 C ATOM 139 O ILE A 384 -3.855 6.595 5.333 1.00 0.00 O ATOM 140 CB ILE A 384 -3.703 9.817 6.221 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.801 10.810 6.955 1.00 0.00 C ATOM 142 CG2 ILE A 384 -4.650 9.138 7.202 1.00 0.00 C ATOM 143 CD1 ILE A 384 -3.444 12.163 7.176 1.00 0.00 C ATOM 0 H ILE A 384 -2.201 10.384 4.296 1.00 0.00 H new ATOM 0 HA ILE A 384 -2.182 8.294 6.190 1.00 0.00 H new ATOM 0 HB ILE A 384 -4.301 10.359 5.489 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -2.520 10.388 7.920 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.881 10.943 6.385 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -5.242 9.894 7.718 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -5.314 8.465 6.660 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -4.072 8.569 7.931 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -2.747 12.816 7.702 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -3.700 12.606 6.213 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -4.349 12.043 7.772 1.00 0.00 H new ATOM 155 N HIS A 385 -4.430 8.100 3.760 1.00 0.00 N ATOM 156 CA HIS A 385 -5.331 7.189 3.062 1.00 0.00 C ATOM 157 C HIS A 385 -4.593 5.924 2.637 1.00 0.00 C ATOM 158 O HIS A 385 -5.019 4.810 2.943 1.00 0.00 O ATOM 159 CB HIS A 385 -5.936 7.878 1.836 1.00 0.00 C ATOM 160 CG HIS A 385 -7.284 7.347 1.455 1.00 0.00 C ATOM 161 ND1 HIS A 385 -7.710 7.243 0.147 1.00 0.00 N ATOM 162 CD2 HIS A 385 -8.304 6.890 2.219 1.00 0.00 C ATOM 163 CE1 HIS A 385 -8.933 6.745 0.123 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.317 6.522 1.367 1.00 0.00 N ATOM 0 H HIS A 385 -4.364 9.029 3.345 1.00 0.00 H new ATOM 0 HA HIS A 385 -6.134 6.911 3.745 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -6.018 8.947 2.034 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.257 7.761 0.992 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -8.319 6.827 3.297 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -9.520 6.553 -0.763 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -10.219 6.139 1.649 1.00 0.00 H new ATOM 173 N VAL A 386 -3.477 6.106 1.935 1.00 0.00 N ATOM 174 CA VAL A 386 -2.676 4.978 1.477 1.00 0.00 C ATOM 175 C VAL A 386 -2.214 4.131 2.655 1.00 0.00 C ATOM 176 O VAL A 386 -2.194 2.902 2.579 1.00 0.00 O ATOM 177 CB VAL A 386 -1.447 5.447 0.678 1.00 0.00 C ATOM 178 CG1 VAL A 386 -1.875 6.095 -0.629 1.00 0.00 C ATOM 179 CG2 VAL A 386 -0.606 6.405 1.508 1.00 0.00 C ATOM 0 H VAL A 386 -3.110 7.021 1.673 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.310 4.378 0.824 1.00 0.00 H new ATOM 0 HB VAL A 386 -0.836 4.576 0.440 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -0.993 6.420 -1.180 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -2.431 5.374 -1.228 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -2.509 6.956 -0.418 1.00 0.00 H new ATOM 0 HG21 VAL A 386 0.259 6.727 0.928 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.205 7.274 1.778 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.268 5.901 2.414 1.00 0.00 H new ATOM 189 N LEU A 387 -1.848 4.795 3.749 1.00 0.00 N ATOM 190 CA LEU A 387 -1.394 4.100 4.948 1.00 0.00 C ATOM 191 C LEU A 387 -2.458 3.119 5.432 1.00 0.00 C ATOM 192 O LEU A 387 -2.191 1.929 5.598 1.00 0.00 O ATOM 193 CB LEU A 387 -1.067 5.105 6.055 1.00 0.00 C ATOM 194 CG LEU A 387 0.360 5.653 6.031 1.00 0.00 C ATOM 195 CD1 LEU A 387 0.551 6.690 7.128 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.367 4.523 6.183 1.00 0.00 C ATOM 0 H LEU A 387 -1.857 5.812 3.829 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.491 3.543 4.700 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.762 5.941 5.982 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.241 4.629 7.020 1.00 0.00 H new ATOM 0 HG LEU A 387 0.528 6.136 5.068 1.00 0.00 H new ATOM 0 HD11 LEU A 387 1.572 7.069 7.096 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -0.147 7.513 6.976 1.00 0.00 H new ATOM 0 HD13 LEU A 387 0.365 6.231 8.099 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.378 4.931 6.164 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.200 4.012 7.131 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.246 3.815 5.363 1.00 0.00 H new ATOM 208 N GLU A 388 -3.669 3.627 5.642 1.00 0.00 N ATOM 209 CA GLU A 388 -4.778 2.792 6.092 1.00 0.00 C ATOM 210 C GLU A 388 -5.014 1.650 5.110 1.00 0.00 C ATOM 211 O GLU A 388 -5.229 0.504 5.510 1.00 0.00 O ATOM 212 CB GLU A 388 -6.050 3.629 6.239 1.00 0.00 C ATOM 213 CG GLU A 388 -6.243 4.203 7.633 1.00 0.00 C ATOM 214 CD GLU A 388 -5.887 5.674 7.711 1.00 0.00 C ATOM 215 OE1 GLU A 388 -4.683 5.999 7.647 1.00 0.00 O ATOM 216 OE2 GLU A 388 -6.813 6.502 7.835 1.00 0.00 O ATOM 0 H GLU A 388 -3.907 4.610 5.508 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.521 2.372 7.064 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -6.022 4.447 5.519 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.912 3.012 5.987 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -7.281 4.067 7.937 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -5.628 3.646 8.340 1.00 0.00 H new ATOM 223 N LYS A 389 -4.956 1.971 3.820 1.00 0.00 N ATOM 224 CA LYS A 389 -5.151 0.974 2.774 1.00 0.00 C ATOM 225 C LYS A 389 -4.156 -0.170 2.940 1.00 0.00 C ATOM 226 O LYS A 389 -4.527 -1.342 2.894 1.00 0.00 O ATOM 227 CB LYS A 389 -4.995 1.614 1.393 1.00 0.00 C ATOM 228 CG LYS A 389 -6.139 1.296 0.443 1.00 0.00 C ATOM 229 CD LYS A 389 -6.332 -0.204 0.284 1.00 0.00 C ATOM 230 CE LYS A 389 -7.536 -0.699 1.071 1.00 0.00 C ATOM 231 NZ LYS A 389 -8.715 -0.933 0.192 1.00 0.00 N ATOM 0 H LYS A 389 -4.776 2.914 3.475 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.161 0.574 2.861 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -4.920 2.695 1.509 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.059 1.275 0.948 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.059 1.744 0.817 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -5.940 1.743 -0.531 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -6.462 -0.445 -0.771 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -5.436 -0.725 0.622 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -7.278 -1.624 1.586 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -7.794 0.031 1.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.571 -1.020 0.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -8.823 -0.133 -0.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -8.575 -1.809 -0.350 1.00 0.00 H new ATOM 245 N VAL A 390 -2.889 0.183 3.144 1.00 0.00 N ATOM 246 CA VAL A 390 -1.845 -0.814 3.330 1.00 0.00 C ATOM 247 C VAL A 390 -2.123 -1.650 4.574 1.00 0.00 C ATOM 248 O VAL A 390 -1.927 -2.864 4.574 1.00 0.00 O ATOM 249 CB VAL A 390 -0.452 -0.166 3.453 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.627 -1.230 3.584 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.177 0.732 2.257 1.00 0.00 C ATOM 0 H VAL A 390 -2.564 1.149 3.184 1.00 0.00 H new ATOM 0 HA VAL A 390 -1.850 -1.454 2.448 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.436 0.446 4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.602 -0.751 3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.439 -1.831 4.473 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.614 -1.872 2.703 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.811 1.182 2.359 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.213 0.141 1.342 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -0.931 1.518 2.211 1.00 0.00 H new ATOM 261 N GLN A 391 -2.595 -0.991 5.631 1.00 0.00 N ATOM 262 CA GLN A 391 -2.915 -1.681 6.876 1.00 0.00 C ATOM 263 C GLN A 391 -3.905 -2.809 6.609 1.00 0.00 C ATOM 264 O GLN A 391 -3.645 -3.973 6.926 1.00 0.00 O ATOM 265 CB GLN A 391 -3.497 -0.702 7.895 1.00 0.00 C ATOM 266 CG GLN A 391 -3.561 -1.261 9.308 1.00 0.00 C ATOM 267 CD GLN A 391 -3.124 -0.254 10.354 1.00 0.00 C ATOM 268 OE1 GLN A 391 -3.392 0.941 10.232 1.00 0.00 O ATOM 269 NE2 GLN A 391 -2.447 -0.733 11.390 1.00 0.00 N ATOM 0 H GLN A 391 -2.763 0.015 5.649 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.997 -2.104 7.285 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.894 0.206 7.899 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.501 -0.417 7.580 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -4.580 -1.582 9.522 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -2.928 -2.146 9.374 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -2.247 -1.731 11.451 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -2.127 -0.103 12.125 1.00 0.00 H new ATOM 278 N TYR A 392 -5.038 -2.460 6.002 1.00 0.00 N ATOM 279 CA TYR A 392 -6.058 -3.448 5.670 1.00 0.00 C ATOM 280 C TYR A 392 -5.462 -4.520 4.770 1.00 0.00 C ATOM 281 O TYR A 392 -5.760 -5.708 4.912 1.00 0.00 O ATOM 282 CB TYR A 392 -7.248 -2.780 4.976 1.00 0.00 C ATOM 283 CG TYR A 392 -7.659 -1.466 5.600 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.889 -1.363 6.966 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.816 -0.327 4.820 1.00 0.00 C ATOM 286 CE1 TYR A 392 -8.264 -0.163 7.538 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.189 0.878 5.385 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.413 0.955 6.745 1.00 0.00 C ATOM 289 OH TYR A 392 -8.785 2.152 7.310 1.00 0.00 O ATOM 0 H TYR A 392 -5.271 -1.504 5.732 1.00 0.00 H new ATOM 0 HA TYR A 392 -6.412 -3.909 6.592 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -6.998 -2.612 3.928 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.098 -3.462 4.995 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.773 -2.236 7.591 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.644 -0.384 3.755 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -8.440 -0.101 8.602 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.305 1.755 4.766 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.455 2.195 8.232 1.00 0.00 H new ATOM 299 N LEU A 393 -4.602 -4.091 3.850 1.00 0.00 N ATOM 300 CA LEU A 393 -3.944 -5.008 2.932 1.00 0.00 C ATOM 301 C LEU A 393 -3.051 -5.969 3.705 1.00 0.00 C ATOM 302 O LEU A 393 -3.054 -7.174 3.456 1.00 0.00 O ATOM 303 CB LEU A 393 -3.114 -4.232 1.907 1.00 0.00 C ATOM 304 CG LEU A 393 -3.856 -3.859 0.624 1.00 0.00 C ATOM 305 CD1 LEU A 393 -3.216 -2.641 -0.026 1.00 0.00 C ATOM 306 CD2 LEU A 393 -3.875 -5.038 -0.338 1.00 0.00 C ATOM 0 H LEU A 393 -4.346 -3.112 3.723 1.00 0.00 H new ATOM 0 HA LEU A 393 -4.707 -5.579 2.403 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -2.747 -3.319 2.375 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.240 -4.828 1.643 1.00 0.00 H new ATOM 0 HG LEU A 393 -4.886 -3.607 0.877 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -3.757 -2.389 -0.938 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -3.255 -1.798 0.664 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -2.177 -2.862 -0.270 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.407 -4.757 -1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -2.852 -5.320 -0.588 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.380 -5.883 0.131 1.00 0.00 H new ATOM 318 N GLU A 394 -2.297 -5.425 4.659 1.00 0.00 N ATOM 319 CA GLU A 394 -1.410 -6.234 5.487 1.00 0.00 C ATOM 320 C GLU A 394 -2.199 -7.350 6.159 1.00 0.00 C ATOM 321 O GLU A 394 -1.821 -8.520 6.096 1.00 0.00 O ATOM 322 CB GLU A 394 -0.723 -5.366 6.542 1.00 0.00 C ATOM 323 CG GLU A 394 0.371 -4.473 5.978 1.00 0.00 C ATOM 324 CD GLU A 394 1.762 -4.995 6.274 1.00 0.00 C ATOM 325 OE1 GLU A 394 2.309 -4.653 7.345 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.306 -5.745 5.438 1.00 0.00 O ATOM 0 H GLU A 394 -2.284 -4.428 4.876 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.644 -6.675 4.849 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -1.472 -4.744 7.032 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.294 -6.012 7.308 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.242 -4.385 4.899 1.00 0.00 H new ATOM 0 HG3 GLU A 394 0.267 -3.471 6.394 1.00 0.00 H new ATOM 333 N GLN A 395 -3.313 -6.979 6.784 1.00 0.00 N ATOM 334 CA GLN A 395 -4.170 -7.953 7.446 1.00 0.00 C ATOM 335 C GLN A 395 -4.644 -8.992 6.436 1.00 0.00 C ATOM 336 O GLN A 395 -4.659 -10.192 6.719 1.00 0.00 O ATOM 337 CB GLN A 395 -5.371 -7.259 8.092 1.00 0.00 C ATOM 338 CG GLN A 395 -4.986 -6.158 9.067 1.00 0.00 C ATOM 339 CD GLN A 395 -4.522 -6.701 10.403 1.00 0.00 C ATOM 340 OE1 GLN A 395 -3.632 -7.548 10.469 1.00 0.00 O ATOM 341 NE2 GLN A 395 -5.127 -6.214 11.483 1.00 0.00 N ATOM 0 H GLN A 395 -3.641 -6.015 6.845 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.598 -8.450 8.229 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -6.000 -6.836 7.309 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.971 -8.003 8.616 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -4.193 -5.551 8.630 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -5.841 -5.500 9.223 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -5.861 -5.512 11.384 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -4.857 -6.542 12.410 1.00 0.00 H new ATOM 350 N GLU A 396 -5.014 -8.518 5.249 1.00 0.00 N ATOM 351 CA GLU A 396 -5.472 -9.400 4.184 1.00 0.00 C ATOM 352 C GLU A 396 -4.358 -10.358 3.783 1.00 0.00 C ATOM 353 O GLU A 396 -4.609 -11.521 3.467 1.00 0.00 O ATOM 354 CB GLU A 396 -5.921 -8.582 2.972 1.00 0.00 C ATOM 355 CG GLU A 396 -6.416 -9.433 1.813 1.00 0.00 C ATOM 356 CD GLU A 396 -7.814 -9.975 2.044 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.788 -9.242 1.770 1.00 0.00 O ATOM 358 OE2 GLU A 396 -7.935 -11.131 2.499 1.00 0.00 O ATOM 0 H GLU A 396 -5.005 -7.528 5.002 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.321 -9.977 4.550 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -6.716 -7.902 3.278 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.088 -7.967 2.631 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -6.407 -8.838 0.900 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -5.729 -10.265 1.658 1.00 0.00 H new ATOM 365 N VAL A 397 -3.122 -9.865 3.813 1.00 0.00 N ATOM 366 CA VAL A 397 -1.968 -10.682 3.466 1.00 0.00 C ATOM 367 C VAL A 397 -1.800 -11.813 4.471 1.00 0.00 C ATOM 368 O VAL A 397 -1.618 -12.970 4.096 1.00 0.00 O ATOM 369 CB VAL A 397 -0.671 -9.847 3.426 1.00 0.00 C ATOM 370 CG1 VAL A 397 0.496 -10.695 2.943 1.00 0.00 C ATOM 371 CG2 VAL A 397 -0.850 -8.620 2.544 1.00 0.00 C ATOM 0 H VAL A 397 -2.897 -8.905 4.074 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.148 -11.091 2.472 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.449 -9.508 4.438 1.00 0.00 H new ATOM 0 HG11 VAL A 397 1.402 -10.089 2.921 1.00 0.00 H new ATOM 0 HG12 VAL A 397 0.639 -11.537 3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 397 0.285 -11.067 1.941 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.076 -8.045 2.529 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.099 -8.934 1.530 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -1.655 -8.001 2.940 1.00 0.00 H new ATOM 381 N GLU A 398 -1.874 -11.470 5.754 1.00 0.00 N ATOM 382 CA GLU A 398 -1.745 -12.459 6.815 1.00 0.00 C ATOM 383 C GLU A 398 -2.851 -13.502 6.703 1.00 0.00 C ATOM 384 O GLU A 398 -2.624 -14.691 6.927 1.00 0.00 O ATOM 385 CB GLU A 398 -1.801 -11.781 8.185 1.00 0.00 C ATOM 386 CG GLU A 398 -0.438 -11.363 8.713 1.00 0.00 C ATOM 387 CD GLU A 398 0.076 -12.287 9.798 1.00 0.00 C ATOM 388 OE1 GLU A 398 -0.436 -12.213 10.935 1.00 0.00 O ATOM 389 OE2 GLU A 398 0.992 -13.087 9.511 1.00 0.00 O ATOM 0 H GLU A 398 -2.022 -10.516 6.082 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.781 -12.956 6.709 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -2.442 -10.901 8.120 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -2.265 -12.461 8.899 1.00 0.00 H new ATOM 0 HG2 GLU A 398 0.276 -11.343 7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -0.500 -10.348 9.105 1.00 0.00 H new ATOM 396 N GLU A 399 -4.047 -13.044 6.343 1.00 0.00 N ATOM 397 CA GLU A 399 -5.192 -13.933 6.189 1.00 0.00 C ATOM 398 C GLU A 399 -5.177 -14.614 4.819 1.00 0.00 C ATOM 399 O GLU A 399 -5.861 -15.616 4.608 1.00 0.00 O ATOM 400 CB GLU A 399 -6.497 -13.155 6.370 1.00 0.00 C ATOM 401 CG GLU A 399 -7.018 -13.165 7.797 1.00 0.00 C ATOM 402 CD GLU A 399 -7.705 -14.468 8.157 1.00 0.00 C ATOM 403 OE1 GLU A 399 -7.137 -15.540 7.860 1.00 0.00 O ATOM 404 OE2 GLU A 399 -8.811 -14.416 8.736 1.00 0.00 O ATOM 0 H GLU A 399 -4.247 -12.062 6.153 1.00 0.00 H new ATOM 0 HA GLU A 399 -5.126 -14.703 6.957 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -6.341 -12.123 6.056 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -7.256 -13.577 5.712 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -6.189 -12.994 8.484 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -7.718 -12.340 7.930 1.00 0.00 H new ATOM 411 N PHE A 400 -4.392 -14.066 3.892 1.00 0.00 N ATOM 412 CA PHE A 400 -4.286 -14.619 2.543 1.00 0.00 C ATOM 413 C PHE A 400 -4.073 -16.131 2.588 1.00 0.00 C ATOM 414 O PHE A 400 -3.120 -16.614 3.197 1.00 0.00 O ATOM 415 CB PHE A 400 -3.135 -13.947 1.788 1.00 0.00 C ATOM 416 CG PHE A 400 -2.989 -14.413 0.365 1.00 0.00 C ATOM 417 CD1 PHE A 400 -3.831 -13.937 -0.628 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.005 -15.328 0.022 1.00 0.00 C ATOM 419 CE1 PHE A 400 -3.695 -14.363 -1.931 1.00 0.00 C ATOM 420 CE2 PHE A 400 -1.865 -15.758 -1.284 1.00 0.00 C ATOM 421 CZ PHE A 400 -2.711 -15.275 -2.262 1.00 0.00 C ATOM 0 H PHE A 400 -3.819 -13.237 4.052 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.221 -14.422 2.018 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.290 -12.868 1.793 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.203 -14.138 2.320 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.602 -13.224 -0.377 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.341 -15.709 0.784 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.358 -13.984 -2.695 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.095 -16.471 -1.539 1.00 0.00 H new ATOM 0 HZ PHE A 400 -2.604 -15.609 -3.283 1.00 0.00 H new ATOM 431 N VAL A 401 -4.972 -16.870 1.942 1.00 0.00 N ATOM 432 CA VAL A 401 -4.892 -18.328 1.907 1.00 0.00 C ATOM 433 C VAL A 401 -3.471 -18.800 1.600 1.00 0.00 C ATOM 434 O VAL A 401 -2.971 -19.737 2.222 1.00 0.00 O ATOM 435 CB VAL A 401 -5.860 -18.914 0.859 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.539 -18.377 -0.527 1.00 0.00 C ATOM 437 CG2 VAL A 401 -5.814 -20.435 0.875 1.00 0.00 C ATOM 0 H VAL A 401 -5.767 -16.481 1.434 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.178 -18.685 2.896 1.00 0.00 H new ATOM 0 HB VAL A 401 -6.873 -18.604 1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.233 -18.802 -1.252 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.634 -17.291 -0.528 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.519 -18.652 -0.797 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.504 -20.828 0.128 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -4.803 -20.771 0.646 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.102 -20.797 1.862 1.00 0.00 H new ATOM 447 N GLY A 402 -2.830 -18.143 0.640 1.00 0.00 N ATOM 448 CA GLY A 402 -1.474 -18.506 0.272 1.00 0.00 C ATOM 449 C GLY A 402 -1.369 -19.009 -1.157 1.00 0.00 C ATOM 450 O GLY A 402 -0.389 -19.660 -1.518 1.00 0.00 O ATOM 0 H GLY A 402 -3.225 -17.366 0.110 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.824 -17.640 0.397 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.112 -19.277 0.952 1.00 0.00 H new ATOM 454 N LYS A 403 -2.376 -18.708 -1.968 1.00 0.00 N ATOM 455 CA LYS A 403 -2.385 -19.137 -3.362 1.00 0.00 C ATOM 456 C LYS A 403 -3.110 -18.121 -4.240 1.00 0.00 C ATOM 457 O LYS A 403 -3.911 -17.324 -3.752 1.00 0.00 O ATOM 458 CB LYS A 403 -3.051 -20.508 -3.494 1.00 0.00 C ATOM 459 CG LYS A 403 -2.448 -21.569 -2.586 1.00 0.00 C ATOM 460 CD LYS A 403 -1.018 -21.893 -2.980 1.00 0.00 C ATOM 461 CE LYS A 403 -0.961 -23.015 -4.005 1.00 0.00 C ATOM 462 NZ LYS A 403 -1.329 -24.329 -3.409 1.00 0.00 N ATOM 0 H LYS A 403 -3.195 -18.170 -1.686 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.351 -19.210 -3.698 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -4.113 -20.410 -3.268 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -2.974 -20.841 -4.529 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -2.472 -21.221 -1.553 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -3.053 -22.475 -2.632 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -0.542 -21.002 -3.388 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -0.452 -22.180 -2.094 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -1.637 -22.788 -4.830 1.00 0.00 H new ATOM 0 HE3 LYS A 403 0.044 -23.074 -4.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -0.965 -25.097 -4.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -0.915 -24.407 -2.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -2.364 -24.403 -3.343 1.00 0.00 H new ATOM 476 N LYS A 404 -2.822 -18.158 -5.538 1.00 0.00 N ATOM 477 CA LYS A 404 -3.447 -17.240 -6.485 1.00 0.00 C ATOM 478 C LYS A 404 -4.731 -17.834 -7.059 1.00 0.00 C ATOM 479 O LYS A 404 -4.954 -17.806 -8.270 1.00 0.00 O ATOM 480 CB LYS A 404 -2.473 -16.907 -7.617 1.00 0.00 C ATOM 481 CG LYS A 404 -2.810 -15.620 -8.353 1.00 0.00 C ATOM 482 CD LYS A 404 -3.002 -15.858 -9.843 1.00 0.00 C ATOM 483 CE LYS A 404 -1.734 -16.392 -10.488 1.00 0.00 C ATOM 484 NZ LYS A 404 -0.609 -15.419 -10.394 1.00 0.00 N ATOM 0 H LYS A 404 -2.161 -18.812 -5.957 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.703 -16.325 -5.951 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -1.466 -16.828 -7.207 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -2.463 -17.731 -8.330 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -3.719 -15.188 -7.933 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.012 -14.894 -8.200 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -3.816 -16.566 -9.998 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -3.293 -14.926 -10.327 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.447 -17.326 -10.005 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.929 -16.621 -11.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 0.175 -15.735 -11.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -0.933 -14.482 -10.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -0.282 -15.360 -9.408 1.00 0.00 H new ATOM 498 N THR A 405 -5.573 -18.371 -6.181 1.00 0.00 N ATOM 499 CA THR A 405 -6.835 -18.970 -6.600 1.00 0.00 C ATOM 500 C THR A 405 -8.024 -18.207 -6.022 1.00 0.00 C ATOM 501 O THR A 405 -9.089 -18.145 -6.635 1.00 0.00 O ATOM 502 CB THR A 405 -6.896 -20.436 -6.165 1.00 0.00 C ATOM 503 OG1 THR A 405 -5.625 -21.050 -6.290 1.00 0.00 O ATOM 504 CG2 THR A 405 -7.883 -21.257 -6.965 1.00 0.00 C ATOM 0 H THR A 405 -5.404 -18.403 -5.176 1.00 0.00 H new ATOM 0 HA THR A 405 -6.888 -18.916 -7.687 1.00 0.00 H new ATOM 0 HB THR A 405 -7.224 -20.415 -5.126 1.00 0.00 H new ATOM 0 HG1 THR A 405 -5.684 -21.986 -6.006 1.00 0.00 H new ATOM 0 HG21 THR A 405 -7.876 -22.286 -6.605 1.00 0.00 H new ATOM 0 HG22 THR A 405 -8.883 -20.839 -6.849 1.00 0.00 H new ATOM 0 HG23 THR A 405 -7.602 -21.239 -8.018 1.00 0.00 H new ATOM 512 N ASP A 406 -7.833 -17.629 -4.841 1.00 0.00 N ATOM 513 CA ASP A 406 -8.891 -16.870 -4.182 1.00 0.00 C ATOM 514 C ASP A 406 -8.915 -15.427 -4.674 1.00 0.00 C ATOM 515 O ASP A 406 -7.996 -14.978 -5.359 1.00 0.00 O ATOM 516 CB ASP A 406 -8.700 -16.901 -2.665 1.00 0.00 C ATOM 517 CG ASP A 406 -9.991 -16.644 -1.913 1.00 0.00 C ATOM 518 OD1 ASP A 406 -10.312 -15.463 -1.671 1.00 0.00 O ATOM 519 OD2 ASP A 406 -10.683 -17.625 -1.569 1.00 0.00 O ATOM 0 H ASP A 406 -6.957 -17.671 -4.321 1.00 0.00 H new ATOM 0 HA ASP A 406 -9.845 -17.334 -4.431 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.299 -17.871 -2.372 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -7.961 -16.152 -2.379 1.00 0.00 H new ATOM 524 N LYS A 407 -9.973 -14.705 -4.321 1.00 0.00 N ATOM 525 CA LYS A 407 -10.121 -13.311 -4.726 1.00 0.00 C ATOM 526 C LYS A 407 -9.198 -12.400 -3.918 1.00 0.00 C ATOM 527 O LYS A 407 -8.973 -11.246 -4.288 1.00 0.00 O ATOM 528 CB LYS A 407 -11.572 -12.862 -4.560 1.00 0.00 C ATOM 529 CG LYS A 407 -12.090 -12.988 -3.138 1.00 0.00 C ATOM 530 CD LYS A 407 -12.021 -11.661 -2.399 1.00 0.00 C ATOM 531 CE LYS A 407 -12.977 -11.631 -1.218 1.00 0.00 C ATOM 532 NZ LYS A 407 -14.383 -11.401 -1.648 1.00 0.00 N ATOM 0 H LYS A 407 -10.742 -15.062 -3.754 1.00 0.00 H new ATOM 0 HA LYS A 407 -9.841 -13.236 -5.777 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -11.661 -11.824 -4.879 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -12.204 -13.454 -5.222 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -13.121 -13.343 -3.155 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -11.505 -13.735 -2.602 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -11.003 -11.491 -2.049 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -12.262 -10.849 -3.084 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -12.913 -12.574 -0.675 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -12.675 -10.844 -0.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -14.993 -11.320 -0.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -14.437 -10.523 -2.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -14.702 -12.200 -2.233 1.00 0.00 H new ATOM 546 N ALA A 408 -8.669 -12.919 -2.812 1.00 0.00 N ATOM 547 CA ALA A 408 -7.775 -12.148 -1.956 1.00 0.00 C ATOM 548 C ALA A 408 -6.638 -11.524 -2.759 1.00 0.00 C ATOM 549 O ALA A 408 -6.451 -10.309 -2.746 1.00 0.00 O ATOM 550 CB ALA A 408 -7.217 -13.030 -0.849 1.00 0.00 C ATOM 0 H ALA A 408 -8.845 -13.870 -2.489 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.353 -11.339 -1.509 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -6.551 -12.443 -0.217 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.037 -13.421 -0.247 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -6.662 -13.859 -1.289 1.00 0.00 H new ATOM 556 N TYR A 409 -5.881 -12.364 -3.460 1.00 0.00 N ATOM 557 CA TYR A 409 -4.764 -11.889 -4.268 1.00 0.00 C ATOM 558 C TYR A 409 -5.230 -10.853 -5.285 1.00 0.00 C ATOM 559 O TYR A 409 -4.542 -9.862 -5.537 1.00 0.00 O ATOM 560 CB TYR A 409 -4.090 -13.056 -4.983 1.00 0.00 C ATOM 561 CG TYR A 409 -2.643 -12.793 -5.338 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.740 -12.362 -4.374 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.181 -12.976 -6.635 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.418 -12.119 -4.693 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.859 -12.737 -6.961 1.00 0.00 C ATOM 566 CZ TYR A 409 0.018 -12.308 -5.988 1.00 0.00 C ATOM 567 OH TYR A 409 1.333 -12.068 -6.309 1.00 0.00 O ATOM 0 H TYR A 409 -6.021 -13.374 -3.484 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.042 -11.418 -3.601 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.145 -13.941 -4.349 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.644 -13.282 -5.894 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.077 -12.215 -3.359 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.865 -13.310 -7.401 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.271 -11.783 -3.932 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.515 -12.886 -7.974 1.00 0.00 H new ATOM 0 HH TYR A 409 1.476 -12.250 -7.261 1.00 0.00 H new ATOM 577 N TRP A 410 -6.407 -11.080 -5.862 1.00 0.00 N ATOM 578 CA TRP A 410 -6.964 -10.157 -6.845 1.00 0.00 C ATOM 579 C TRP A 410 -7.075 -8.759 -6.251 1.00 0.00 C ATOM 580 O TRP A 410 -6.401 -7.827 -6.693 1.00 0.00 O ATOM 581 CB TRP A 410 -8.342 -10.630 -7.307 1.00 0.00 C ATOM 582 CG TRP A 410 -8.338 -11.995 -7.925 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.252 -12.700 -8.360 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.480 -12.816 -8.181 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.651 -13.912 -8.869 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.016 -14.007 -8.770 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.853 -12.661 -7.967 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -9.875 -15.036 -9.148 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.705 -13.684 -8.342 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.214 -14.856 -8.926 1.00 0.00 C ATOM 0 H TRP A 410 -6.992 -11.893 -5.666 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.295 -10.130 -7.705 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.021 -10.630 -6.454 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.738 -9.916 -8.029 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.230 -12.355 -8.311 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.033 -14.625 -9.257 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.241 -11.759 -7.517 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.499 -15.942 -9.599 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.767 -13.576 -8.181 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -11.906 -15.636 -9.208 1.00 0.00 H new ATOM 601 N LEU A 411 -7.925 -8.623 -5.239 1.00 0.00 N ATOM 602 CA LEU A 411 -8.121 -7.343 -4.574 1.00 0.00 C ATOM 603 C LEU A 411 -6.815 -6.860 -3.952 1.00 0.00 C ATOM 604 O LEU A 411 -6.573 -5.659 -3.847 1.00 0.00 O ATOM 605 CB LEU A 411 -9.205 -7.462 -3.501 1.00 0.00 C ATOM 606 CG LEU A 411 -8.979 -8.565 -2.467 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.121 -8.057 -1.317 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.311 -9.090 -1.952 1.00 0.00 C ATOM 0 H LEU A 411 -8.489 -9.385 -4.862 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.443 -6.613 -5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.284 -6.508 -2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.162 -7.637 -3.992 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.448 -9.386 -2.949 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -7.972 -8.858 -0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.154 -7.731 -1.701 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.621 -7.218 -0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.133 -9.875 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -10.867 -8.276 -1.487 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -10.888 -9.496 -2.783 1.00 0.00 H new ATOM 620 N LEU A 412 -5.973 -7.809 -3.550 1.00 0.00 N ATOM 621 CA LEU A 412 -4.685 -7.484 -2.947 1.00 0.00 C ATOM 622 C LEU A 412 -3.861 -6.599 -3.881 1.00 0.00 C ATOM 623 O LEU A 412 -3.666 -5.410 -3.619 1.00 0.00 O ATOM 624 CB LEU A 412 -3.909 -8.767 -2.631 1.00 0.00 C ATOM 625 CG LEU A 412 -4.214 -9.401 -1.271 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.720 -10.839 -1.229 1.00 0.00 C ATOM 627 CD2 LEU A 412 -3.580 -8.586 -0.155 1.00 0.00 C ATOM 0 H LEU A 412 -6.160 -8.808 -3.631 1.00 0.00 H new ATOM 0 HA LEU A 412 -4.869 -6.940 -2.021 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.119 -9.500 -3.410 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -2.842 -8.548 -2.680 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.294 -9.406 -1.126 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -3.946 -11.273 -0.255 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -4.217 -11.417 -2.008 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.643 -10.859 -1.394 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -3.805 -9.048 0.806 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -2.500 -8.552 -0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -3.980 -7.572 -0.172 1.00 0.00 H new ATOM 639 N GLU A 413 -3.385 -7.190 -4.972 1.00 0.00 N ATOM 640 CA GLU A 413 -2.582 -6.464 -5.949 1.00 0.00 C ATOM 641 C GLU A 413 -3.374 -5.314 -6.564 1.00 0.00 C ATOM 642 O GLU A 413 -2.809 -4.283 -6.928 1.00 0.00 O ATOM 643 CB GLU A 413 -2.099 -7.411 -7.050 1.00 0.00 C ATOM 644 CG GLU A 413 -3.225 -8.003 -7.882 1.00 0.00 C ATOM 645 CD GLU A 413 -2.740 -8.569 -9.202 1.00 0.00 C ATOM 646 OE1 GLU A 413 -2.011 -9.582 -9.181 1.00 0.00 O ATOM 647 OE2 GLU A 413 -3.087 -7.997 -10.256 1.00 0.00 O ATOM 0 H GLU A 413 -3.542 -8.171 -5.202 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.718 -6.048 -5.431 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -1.417 -6.872 -7.708 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -1.529 -8.222 -6.596 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -3.717 -8.791 -7.312 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -3.973 -7.234 -8.074 1.00 0.00 H new ATOM 654 N GLU A 414 -4.687 -5.497 -6.681 1.00 0.00 N ATOM 655 CA GLU A 414 -5.553 -4.471 -7.255 1.00 0.00 C ATOM 656 C GLU A 414 -5.435 -3.163 -6.480 1.00 0.00 C ATOM 657 O GLU A 414 -4.916 -2.169 -6.993 1.00 0.00 O ATOM 658 CB GLU A 414 -7.008 -4.946 -7.261 1.00 0.00 C ATOM 659 CG GLU A 414 -7.462 -5.502 -8.601 1.00 0.00 C ATOM 660 CD GLU A 414 -6.538 -6.581 -9.130 1.00 0.00 C ATOM 661 OE1 GLU A 414 -5.407 -6.247 -9.541 1.00 0.00 O ATOM 662 OE2 GLU A 414 -6.946 -7.761 -9.134 1.00 0.00 O ATOM 0 H GLU A 414 -5.173 -6.344 -6.387 1.00 0.00 H new ATOM 0 HA GLU A 414 -5.233 -4.293 -8.282 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -7.134 -5.714 -6.497 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.654 -4.113 -6.985 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -8.468 -5.909 -8.499 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -7.519 -4.690 -9.326 1.00 0.00 H new ATOM 669 N MET A 415 -5.917 -3.165 -5.241 1.00 0.00 N ATOM 670 CA MET A 415 -5.860 -1.976 -4.401 1.00 0.00 C ATOM 671 C MET A 415 -4.414 -1.566 -4.145 1.00 0.00 C ATOM 672 O MET A 415 -4.114 -0.383 -3.982 1.00 0.00 O ATOM 673 CB MET A 415 -6.589 -2.217 -3.076 1.00 0.00 C ATOM 674 CG MET A 415 -5.884 -3.199 -2.157 1.00 0.00 C ATOM 675 SD MET A 415 -6.943 -3.786 -0.820 1.00 0.00 S ATOM 676 CE MET A 415 -8.365 -4.370 -1.740 1.00 0.00 C ATOM 0 H MET A 415 -6.350 -3.975 -4.798 1.00 0.00 H new ATOM 0 HA MET A 415 -6.360 -1.163 -4.928 1.00 0.00 H new ATOM 0 HB2 MET A 415 -6.703 -1.265 -2.557 1.00 0.00 H new ATOM 0 HB3 MET A 415 -7.592 -2.587 -3.286 1.00 0.00 H new ATOM 0 HG2 MET A 415 -5.537 -4.052 -2.741 1.00 0.00 H new ATOM 0 HG3 MET A 415 -5.000 -2.723 -1.732 1.00 0.00 H new ATOM 0 HE1 MET A 415 -8.782 -5.248 -1.247 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.120 -3.585 -1.781 1.00 0.00 H new ATOM 0 HE3 MET A 415 -8.060 -4.633 -2.753 1.00 0.00 H new ATOM 686 N LEU A 416 -3.517 -2.550 -4.115 1.00 0.00 N ATOM 687 CA LEU A 416 -2.102 -2.281 -3.886 1.00 0.00 C ATOM 688 C LEU A 416 -1.552 -1.354 -4.966 1.00 0.00 C ATOM 689 O LEU A 416 -1.032 -0.278 -4.671 1.00 0.00 O ATOM 690 CB LEU A 416 -1.307 -3.588 -3.868 1.00 0.00 C ATOM 691 CG LEU A 416 -1.300 -4.325 -2.527 1.00 0.00 C ATOM 692 CD1 LEU A 416 -0.941 -5.792 -2.722 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.332 -3.657 -1.561 1.00 0.00 C ATOM 0 H LEU A 416 -3.745 -3.536 -4.246 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.000 -1.791 -2.918 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.715 -4.254 -4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.277 -3.373 -4.152 1.00 0.00 H new ATOM 0 HG LEU A 416 -2.302 -4.276 -2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.942 -6.298 -1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -1.674 -6.262 -3.378 1.00 0.00 H new ATOM 0 HD13 LEU A 416 0.049 -5.868 -3.171 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.338 -4.192 -0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 416 0.673 -3.676 -1.982 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -0.637 -2.624 -1.397 1.00 0.00 H new ATOM 705 N THR A 417 -1.677 -1.781 -6.219 1.00 0.00 N ATOM 706 CA THR A 417 -1.200 -0.993 -7.348 1.00 0.00 C ATOM 707 C THR A 417 -1.935 0.341 -7.425 1.00 0.00 C ATOM 708 O THR A 417 -1.326 1.384 -7.662 1.00 0.00 O ATOM 709 CB THR A 417 -1.385 -1.767 -8.653 1.00 0.00 C ATOM 710 OG1 THR A 417 -0.820 -3.062 -8.553 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.756 -1.083 -9.848 1.00 0.00 C ATOM 0 H THR A 417 -2.105 -2.670 -6.477 1.00 0.00 H new ATOM 0 HA THR A 417 -0.138 -0.796 -7.200 1.00 0.00 H new ATOM 0 HB THR A 417 -2.463 -1.818 -8.808 1.00 0.00 H new ATOM 0 HG1 THR A 417 -1.430 -3.648 -8.059 1.00 0.00 H new ATOM 0 HG21 THR A 417 -0.924 -1.684 -10.741 1.00 0.00 H new ATOM 0 HG22 THR A 417 -1.206 -0.100 -9.983 1.00 0.00 H new ATOM 0 HG23 THR A 417 0.315 -0.972 -9.681 1.00 0.00 H new ATOM 719 N LYS A 418 -3.247 0.301 -7.217 1.00 0.00 N ATOM 720 CA LYS A 418 -4.060 1.511 -7.259 1.00 0.00 C ATOM 721 C LYS A 418 -3.657 2.469 -6.142 1.00 0.00 C ATOM 722 O LYS A 418 -3.557 3.678 -6.353 1.00 0.00 O ATOM 723 CB LYS A 418 -5.545 1.160 -7.135 1.00 0.00 C ATOM 724 CG LYS A 418 -6.473 2.302 -7.519 1.00 0.00 C ATOM 725 CD LYS A 418 -6.983 3.041 -6.294 1.00 0.00 C ATOM 726 CE LYS A 418 -8.382 2.586 -5.910 1.00 0.00 C ATOM 727 NZ LYS A 418 -8.484 1.103 -5.835 1.00 0.00 N ATOM 0 H LYS A 418 -3.768 -0.553 -7.018 1.00 0.00 H new ATOM 0 HA LYS A 418 -3.891 2.002 -8.217 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -5.761 0.299 -7.768 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -5.755 0.862 -6.108 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -5.945 2.998 -8.171 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -7.317 1.911 -8.087 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -6.303 2.875 -5.458 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -6.989 4.113 -6.491 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -8.652 3.017 -4.946 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -9.099 2.962 -6.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -9.388 0.839 -5.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -8.436 0.703 -6.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -7.699 0.729 -5.265 1.00 0.00 H new ATOM 741 N GLU A 419 -3.425 1.917 -4.955 1.00 0.00 N ATOM 742 CA GLU A 419 -3.030 2.719 -3.803 1.00 0.00 C ATOM 743 C GLU A 419 -1.719 3.449 -4.073 1.00 0.00 C ATOM 744 O GLU A 419 -1.661 4.677 -4.023 1.00 0.00 O ATOM 745 CB GLU A 419 -2.890 1.833 -2.563 1.00 0.00 C ATOM 746 CG GLU A 419 -2.502 2.600 -1.309 1.00 0.00 C ATOM 747 CD GLU A 419 -1.004 2.610 -1.073 1.00 0.00 C ATOM 748 OE1 GLU A 419 -0.307 3.420 -1.720 1.00 0.00 O ATOM 749 OE2 GLU A 419 -0.529 1.810 -0.241 1.00 0.00 O ATOM 0 H GLU A 419 -3.504 0.918 -4.766 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.807 3.462 -3.624 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -3.834 1.318 -2.386 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -2.140 1.066 -2.757 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -2.860 3.626 -1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -2.999 2.155 -0.447 1.00 0.00 H new ATOM 756 N LEU A 420 -0.669 2.685 -4.359 1.00 0.00 N ATOM 757 CA LEU A 420 0.641 3.266 -4.638 1.00 0.00 C ATOM 758 C LEU A 420 0.558 4.259 -5.793 1.00 0.00 C ATOM 759 O LEU A 420 1.192 5.317 -5.763 1.00 0.00 O ATOM 760 CB LEU A 420 1.656 2.167 -4.963 1.00 0.00 C ATOM 761 CG LEU A 420 1.213 1.167 -6.034 1.00 0.00 C ATOM 762 CD1 LEU A 420 1.626 1.649 -7.416 1.00 0.00 C ATOM 763 CD2 LEU A 420 1.796 -0.209 -5.749 1.00 0.00 C ATOM 0 H LEU A 420 -0.699 1.666 -4.404 1.00 0.00 H new ATOM 0 HA LEU A 420 0.972 3.799 -3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 420 2.584 2.637 -5.289 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.880 1.619 -4.048 1.00 0.00 H new ATOM 0 HG LEU A 420 0.126 1.091 -6.009 1.00 0.00 H new ATOM 0 HD11 LEU A 420 1.303 0.926 -8.165 1.00 0.00 H new ATOM 0 HD12 LEU A 420 1.161 2.614 -7.619 1.00 0.00 H new ATOM 0 HD13 LEU A 420 2.710 1.753 -7.456 1.00 0.00 H new ATOM 0 HD21 LEU A 420 1.472 -0.908 -6.520 1.00 0.00 H new ATOM 0 HD22 LEU A 420 2.884 -0.150 -5.748 1.00 0.00 H new ATOM 0 HD23 LEU A 420 1.450 -0.556 -4.775 1.00 0.00 H new ATOM 775 N LEU A 421 -0.233 3.917 -6.805 1.00 0.00 N ATOM 776 CA LEU A 421 -0.406 4.782 -7.967 1.00 0.00 C ATOM 777 C LEU A 421 -0.942 6.146 -7.546 1.00 0.00 C ATOM 778 O LEU A 421 -0.433 7.183 -7.969 1.00 0.00 O ATOM 779 CB LEU A 421 -1.355 4.135 -8.976 1.00 0.00 C ATOM 780 CG LEU A 421 -1.445 4.845 -10.328 1.00 0.00 C ATOM 781 CD1 LEU A 421 -0.102 4.812 -11.038 1.00 0.00 C ATOM 782 CD2 LEU A 421 -2.523 4.209 -11.192 1.00 0.00 C ATOM 0 H LEU A 421 -0.764 3.047 -6.844 1.00 0.00 H new ATOM 0 HA LEU A 421 0.567 4.921 -8.437 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -1.036 3.106 -9.144 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -2.352 4.092 -8.538 1.00 0.00 H new ATOM 0 HG LEU A 421 -1.714 5.887 -10.153 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -0.185 5.322 -11.998 1.00 0.00 H new ATOM 0 HD12 LEU A 421 0.646 5.314 -10.424 1.00 0.00 H new ATOM 0 HD13 LEU A 421 0.198 3.777 -11.202 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -2.574 4.726 -12.150 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -2.283 3.159 -11.359 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -3.486 4.285 -10.687 1.00 0.00 H new ATOM 794 N GLU A 422 -1.973 6.135 -6.704 1.00 0.00 N ATOM 795 CA GLU A 422 -2.575 7.370 -6.219 1.00 0.00 C ATOM 796 C GLU A 422 -1.635 8.083 -5.253 1.00 0.00 C ATOM 797 O GLU A 422 -1.625 9.312 -5.173 1.00 0.00 O ATOM 798 CB GLU A 422 -3.910 7.077 -5.531 1.00 0.00 C ATOM 799 CG GLU A 422 -5.085 6.998 -6.491 1.00 0.00 C ATOM 800 CD GLU A 422 -5.685 8.357 -6.792 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.398 8.898 -5.921 1.00 0.00 O ATOM 802 OE2 GLU A 422 -5.442 8.882 -7.901 1.00 0.00 O ATOM 0 H GLU A 422 -2.407 5.285 -6.345 1.00 0.00 H new ATOM 0 HA GLU A 422 -2.754 8.022 -7.074 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.831 6.135 -4.989 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.107 7.854 -4.792 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.758 6.535 -7.422 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.853 6.352 -6.066 1.00 0.00 H new ATOM 809 N LEU A 423 -0.847 7.301 -4.521 1.00 0.00 N ATOM 810 CA LEU A 423 0.101 7.853 -3.562 1.00 0.00 C ATOM 811 C LEU A 423 1.136 8.724 -4.264 1.00 0.00 C ATOM 812 O LEU A 423 1.433 9.834 -3.820 1.00 0.00 O ATOM 813 CB LEU A 423 0.800 6.725 -2.799 1.00 0.00 C ATOM 814 CG LEU A 423 1.945 7.168 -1.886 1.00 0.00 C ATOM 815 CD1 LEU A 423 2.053 6.249 -0.680 1.00 0.00 C ATOM 816 CD2 LEU A 423 3.258 7.200 -2.654 1.00 0.00 C ATOM 0 H LEU A 423 -0.847 6.282 -4.575 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.451 8.473 -2.856 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.058 6.201 -2.196 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.189 6.007 -3.521 1.00 0.00 H new ATOM 0 HG LEU A 423 1.731 8.176 -1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.873 6.580 -0.043 1.00 0.00 H new ATOM 0 HD12 LEU A 423 1.121 6.278 -0.116 1.00 0.00 H new ATOM 0 HD13 LEU A 423 2.243 5.229 -1.015 1.00 0.00 H new ATOM 0 HD21 LEU A 423 4.061 7.517 -1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 423 3.478 6.205 -3.040 1.00 0.00 H new ATOM 0 HD23 LEU A 423 3.177 7.901 -3.485 1.00 0.00 H new ATOM 828 N ASP A 424 1.681 8.214 -5.362 1.00 0.00 N ATOM 829 CA ASP A 424 2.686 8.941 -6.131 1.00 0.00 C ATOM 830 C ASP A 424 2.173 10.318 -6.549 1.00 0.00 C ATOM 831 O ASP A 424 2.959 11.218 -6.844 1.00 0.00 O ATOM 832 CB ASP A 424 3.090 8.138 -7.367 1.00 0.00 C ATOM 833 CG ASP A 424 4.481 8.490 -7.857 1.00 0.00 C ATOM 834 OD1 ASP A 424 4.904 9.650 -7.660 1.00 0.00 O ATOM 835 OD2 ASP A 424 5.148 7.608 -8.436 1.00 0.00 O ATOM 0 H ASP A 424 1.444 7.297 -5.741 1.00 0.00 H new ATOM 0 HA ASP A 424 3.559 9.081 -5.493 1.00 0.00 H new ATOM 0 HB2 ASP A 424 3.048 7.074 -7.135 1.00 0.00 H new ATOM 0 HB3 ASP A 424 2.370 8.319 -8.165 1.00 0.00 H new ATOM 840 N SER A 425 0.852 10.476 -6.577 1.00 0.00 N ATOM 841 CA SER A 425 0.244 11.744 -6.965 1.00 0.00 C ATOM 842 C SER A 425 -0.074 12.605 -5.744 1.00 0.00 C ATOM 843 O SER A 425 -0.967 13.450 -5.790 1.00 0.00 O ATOM 844 CB SER A 425 -1.032 11.494 -7.772 1.00 0.00 C ATOM 845 OG SER A 425 -0.733 10.953 -9.047 1.00 0.00 O ATOM 0 H SER A 425 0.184 9.743 -6.336 1.00 0.00 H new ATOM 0 HA SER A 425 0.962 12.283 -7.583 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.682 10.810 -7.227 1.00 0.00 H new ATOM 0 HB3 SER A 425 -1.580 12.429 -7.890 1.00 0.00 H new ATOM 0 HG SER A 425 -1.565 10.801 -9.541 1.00 0.00 H new ATOM 851 N VAL A 426 0.663 12.393 -4.656 1.00 0.00 N ATOM 852 CA VAL A 426 0.450 13.163 -3.436 1.00 0.00 C ATOM 853 C VAL A 426 1.158 14.513 -3.515 1.00 0.00 C ATOM 854 O VAL A 426 2.362 14.581 -3.759 1.00 0.00 O ATOM 855 CB VAL A 426 0.943 12.400 -2.187 1.00 0.00 C ATOM 856 CG1 VAL A 426 2.440 12.137 -2.265 1.00 0.00 C ATOM 857 CG2 VAL A 426 0.596 13.168 -0.920 1.00 0.00 C ATOM 0 H VAL A 426 1.408 11.699 -4.595 1.00 0.00 H new ATOM 0 HA VAL A 426 -0.624 13.322 -3.344 1.00 0.00 H new ATOM 0 HB VAL A 426 0.434 11.437 -2.155 1.00 0.00 H new ATOM 0 HG11 VAL A 426 2.762 11.599 -1.374 1.00 0.00 H new ATOM 0 HG12 VAL A 426 2.659 11.538 -3.149 1.00 0.00 H new ATOM 0 HG13 VAL A 426 2.973 13.086 -2.328 1.00 0.00 H new ATOM 0 HG21 VAL A 426 0.951 12.615 -0.050 1.00 0.00 H new ATOM 0 HG22 VAL A 426 1.073 14.148 -0.946 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -0.485 13.292 -0.854 1.00 0.00 H new ATOM 867 N GLU A 427 0.397 15.585 -3.316 1.00 0.00 N ATOM 868 CA GLU A 427 0.947 16.935 -3.373 1.00 0.00 C ATOM 869 C GLU A 427 1.921 17.182 -2.227 1.00 0.00 C ATOM 870 O GLU A 427 1.606 17.895 -1.273 1.00 0.00 O ATOM 871 CB GLU A 427 -0.183 17.968 -3.330 1.00 0.00 C ATOM 872 CG GLU A 427 0.120 19.233 -4.116 1.00 0.00 C ATOM 873 CD GLU A 427 -1.131 19.886 -4.674 1.00 0.00 C ATOM 874 OE1 GLU A 427 -2.068 20.138 -3.888 1.00 0.00 O ATOM 875 OE2 GLU A 427 -1.173 20.142 -5.894 1.00 0.00 O ATOM 0 H GLU A 427 -0.602 15.545 -3.114 1.00 0.00 H new ATOM 0 HA GLU A 427 1.492 17.037 -4.311 1.00 0.00 H new ATOM 0 HB2 GLU A 427 -1.093 17.515 -3.723 1.00 0.00 H new ATOM 0 HB3 GLU A 427 -0.382 18.234 -2.292 1.00 0.00 H new ATOM 0 HG2 GLU A 427 0.639 19.942 -3.471 1.00 0.00 H new ATOM 0 HG3 GLU A 427 0.797 18.994 -4.936 1.00 0.00 H new ATOM 882 N THR A 428 3.108 16.593 -2.327 1.00 0.00 N ATOM 883 CA THR A 428 4.131 16.751 -1.299 1.00 0.00 C ATOM 884 C THR A 428 5.140 17.824 -1.698 1.00 0.00 C ATOM 885 O THR A 428 6.209 17.518 -2.226 1.00 0.00 O ATOM 886 CB THR A 428 4.850 15.424 -1.055 1.00 0.00 C ATOM 887 OG1 THR A 428 3.926 14.410 -0.699 1.00 0.00 O ATOM 888 CG2 THR A 428 5.894 15.500 0.039 1.00 0.00 C ATOM 0 H THR A 428 3.386 16.001 -3.110 1.00 0.00 H new ATOM 0 HA THR A 428 3.639 17.063 -0.378 1.00 0.00 H new ATOM 0 HB THR A 428 5.350 15.190 -1.995 1.00 0.00 H new ATOM 0 HG1 THR A 428 4.377 13.540 -0.705 1.00 0.00 H new ATOM 0 HG21 THR A 428 6.366 14.525 0.160 1.00 0.00 H new ATOM 0 HG22 THR A 428 6.650 16.238 -0.230 1.00 0.00 H new ATOM 0 HG23 THR A 428 5.419 15.792 0.976 1.00 0.00 H new ATOM 896 N GLY A 429 4.793 19.081 -1.441 1.00 0.00 N ATOM 897 CA GLY A 429 5.679 20.178 -1.779 1.00 0.00 C ATOM 898 C GLY A 429 7.025 20.073 -1.089 1.00 0.00 C ATOM 899 O GLY A 429 8.050 19.861 -1.739 1.00 0.00 O ATOM 0 H GLY A 429 3.914 19.359 -1.005 1.00 0.00 H new ATOM 0 HA2 GLY A 429 5.829 20.200 -2.858 1.00 0.00 H new ATOM 0 HA3 GLY A 429 5.206 21.121 -1.503 1.00 0.00 H new ATOM 903 N GLY A 430 7.023 20.218 0.232 1.00 0.00 N ATOM 904 CA GLY A 430 8.259 20.134 0.989 1.00 0.00 C ATOM 905 C GLY A 430 8.018 19.899 2.466 1.00 0.00 C ATOM 906 O GLY A 430 8.605 20.573 3.313 1.00 0.00 O ATOM 0 H GLY A 430 6.188 20.392 0.792 1.00 0.00 H new ATOM 0 HA2 GLY A 430 8.871 19.325 0.591 1.00 0.00 H new ATOM 0 HA3 GLY A 430 8.825 21.056 0.858 1.00 0.00 H new ATOM 910 N GLN A 431 7.150 18.941 2.778 1.00 0.00 N ATOM 911 CA GLN A 431 6.832 18.618 4.163 1.00 0.00 C ATOM 912 C GLN A 431 7.638 17.416 4.643 1.00 0.00 C ATOM 913 O GLN A 431 7.630 16.359 4.011 1.00 0.00 O ATOM 914 CB GLN A 431 5.335 18.338 4.313 1.00 0.00 C ATOM 915 CG GLN A 431 4.738 18.887 5.597 1.00 0.00 C ATOM 916 CD GLN A 431 4.900 20.389 5.719 1.00 0.00 C ATOM 917 OE1 GLN A 431 5.238 21.069 4.750 1.00 0.00 O ATOM 918 NE2 GLN A 431 4.659 20.915 6.915 1.00 0.00 N ATOM 0 H GLN A 431 6.655 18.375 2.089 1.00 0.00 H new ATOM 0 HA GLN A 431 7.097 19.477 4.779 1.00 0.00 H new ATOM 0 HB2 GLN A 431 4.806 18.770 3.463 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.170 17.261 4.277 1.00 0.00 H new ATOM 0 HG2 GLN A 431 3.678 18.635 5.637 1.00 0.00 H new ATOM 0 HG3 GLN A 431 5.213 18.403 6.450 1.00 0.00 H new ATOM 0 HE21 GLN A 431 4.381 20.313 7.690 1.00 0.00 H new ATOM 0 HE22 GLN A 431 4.752 21.921 7.058 1.00 0.00 H new ATOM 927 N ASP A 432 8.332 17.584 5.763 1.00 0.00 N ATOM 928 CA ASP A 432 9.143 16.511 6.329 1.00 0.00 C ATOM 929 C ASP A 432 8.277 15.312 6.696 1.00 0.00 C ATOM 930 O ASP A 432 8.632 14.168 6.413 1.00 0.00 O ATOM 931 CB ASP A 432 9.895 17.010 7.563 1.00 0.00 C ATOM 932 CG ASP A 432 11.286 16.415 7.674 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.413 15.179 7.556 1.00 0.00 O ATOM 934 OD2 ASP A 432 12.247 17.186 7.877 1.00 0.00 O ATOM 0 H ASP A 432 8.350 18.453 6.297 1.00 0.00 H new ATOM 0 HA ASP A 432 9.865 16.197 5.575 1.00 0.00 H new ATOM 0 HB2 ASP A 432 9.970 18.097 7.524 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.324 16.761 8.458 1.00 0.00 H new ATOM 939 N SER A 433 7.139 15.582 7.329 1.00 0.00 N ATOM 940 CA SER A 433 6.221 14.526 7.736 1.00 0.00 C ATOM 941 C SER A 433 5.735 13.731 6.527 1.00 0.00 C ATOM 942 O SER A 433 5.778 12.501 6.523 1.00 0.00 O ATOM 943 CB SER A 433 5.026 15.120 8.484 1.00 0.00 C ATOM 944 OG SER A 433 5.263 15.151 9.881 1.00 0.00 O ATOM 0 H SER A 433 6.831 16.524 7.571 1.00 0.00 H new ATOM 0 HA SER A 433 6.757 13.850 8.401 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.832 16.130 8.122 1.00 0.00 H new ATOM 0 HB3 SER A 433 4.133 14.530 8.276 1.00 0.00 H new ATOM 0 HG SER A 433 4.485 15.536 10.336 1.00 0.00 H new ATOM 950 N VAL A 434 5.274 14.444 5.505 1.00 0.00 N ATOM 951 CA VAL A 434 4.783 13.802 4.292 1.00 0.00 C ATOM 952 C VAL A 434 5.895 13.026 3.598 1.00 0.00 C ATOM 953 O VAL A 434 5.658 11.968 3.015 1.00 0.00 O ATOM 954 CB VAL A 434 4.190 14.829 3.307 1.00 0.00 C ATOM 955 CG1 VAL A 434 3.524 14.123 2.136 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.203 15.744 4.018 1.00 0.00 C ATOM 0 H VAL A 434 5.230 15.463 5.492 1.00 0.00 H new ATOM 0 HA VAL A 434 3.995 13.112 4.595 1.00 0.00 H new ATOM 0 HB VAL A 434 5.003 15.442 2.918 1.00 0.00 H new ATOM 0 HG11 VAL A 434 3.111 14.864 1.451 1.00 0.00 H new ATOM 0 HG12 VAL A 434 4.261 13.515 1.611 1.00 0.00 H new ATOM 0 HG13 VAL A 434 2.722 13.484 2.505 1.00 0.00 H new ATOM 0 HG21 VAL A 434 2.795 16.462 3.307 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.392 15.149 4.438 1.00 0.00 H new ATOM 0 HG23 VAL A 434 3.714 16.278 4.819 1.00 0.00 H new ATOM 966 N ARG A 435 7.113 13.555 3.668 1.00 0.00 N ATOM 967 CA ARG A 435 8.264 12.906 3.052 1.00 0.00 C ATOM 968 C ARG A 435 8.512 11.544 3.690 1.00 0.00 C ATOM 969 O ARG A 435 8.550 10.521 3.002 1.00 0.00 O ATOM 970 CB ARG A 435 9.510 13.784 3.190 1.00 0.00 C ATOM 971 CG ARG A 435 10.475 13.656 2.023 1.00 0.00 C ATOM 972 CD ARG A 435 11.922 13.682 2.489 1.00 0.00 C ATOM 973 NE ARG A 435 12.532 14.999 2.311 1.00 0.00 N ATOM 974 CZ ARG A 435 13.846 15.212 2.300 1.00 0.00 C ATOM 975 NH1 ARG A 435 14.690 14.200 2.459 1.00 0.00 N ATOM 976 NH2 ARG A 435 14.317 16.440 2.132 1.00 0.00 N ATOM 0 H ARG A 435 7.328 14.431 4.145 1.00 0.00 H new ATOM 0 HA ARG A 435 8.051 12.763 1.993 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.202 14.825 3.284 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.030 13.521 4.111 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.280 12.726 1.489 1.00 0.00 H new ATOM 0 HG3 ARG A 435 10.304 14.470 1.318 1.00 0.00 H new ATOM 0 HD2 ARG A 435 11.969 13.400 3.541 1.00 0.00 H new ATOM 0 HD3 ARG A 435 12.495 12.939 1.934 1.00 0.00 H new ATOM 0 HE ARG A 435 11.914 15.801 2.188 1.00 0.00 H new ATOM 0 HH11 ARG A 435 14.333 13.254 2.590 1.00 0.00 H new ATOM 0 HH12 ARG A 435 15.696 14.369 2.450 1.00 0.00 H new ATOM 0 HH21 ARG A 435 13.673 17.221 2.011 1.00 0.00 H new ATOM 0 HH22 ARG A 435 15.324 16.603 2.124 1.00 0.00 H new ATOM 990 N GLN A 436 8.671 11.536 5.010 1.00 0.00 N ATOM 991 CA GLN A 436 8.905 10.297 5.741 1.00 0.00 C ATOM 992 C GLN A 436 7.761 9.316 5.502 1.00 0.00 C ATOM 993 O GLN A 436 7.984 8.123 5.297 1.00 0.00 O ATOM 994 CB GLN A 436 9.052 10.577 7.238 1.00 0.00 C ATOM 995 CG GLN A 436 7.876 11.333 7.837 1.00 0.00 C ATOM 996 CD GLN A 436 7.979 11.474 9.343 1.00 0.00 C ATOM 997 OE1 GLN A 436 8.547 12.443 9.849 1.00 0.00 O ATOM 998 NE2 GLN A 436 7.432 10.505 10.067 1.00 0.00 N ATOM 0 H GLN A 436 8.642 12.372 5.594 1.00 0.00 H new ATOM 0 HA GLN A 436 9.831 9.853 5.377 1.00 0.00 H new ATOM 0 HB2 GLN A 436 9.171 9.631 7.766 1.00 0.00 H new ATOM 0 HB3 GLN A 436 9.964 11.151 7.403 1.00 0.00 H new ATOM 0 HG2 GLN A 436 7.818 12.324 7.386 1.00 0.00 H new ATOM 0 HG3 GLN A 436 6.950 10.815 7.587 1.00 0.00 H new ATOM 0 HE21 GLN A 436 6.971 9.721 9.605 1.00 0.00 H new ATOM 0 HE22 GLN A 436 7.472 10.545 11.085 1.00 0.00 H new ATOM 1007 N ALA A 437 6.536 9.834 5.518 1.00 0.00 N ATOM 1008 CA ALA A 437 5.359 9.009 5.289 1.00 0.00 C ATOM 1009 C ALA A 437 5.366 8.455 3.869 1.00 0.00 C ATOM 1010 O ALA A 437 4.930 7.330 3.626 1.00 0.00 O ATOM 1011 CB ALA A 437 4.092 9.812 5.541 1.00 0.00 C ATOM 0 H ALA A 437 6.335 10.820 5.687 1.00 0.00 H new ATOM 0 HA ALA A 437 5.382 8.171 5.986 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.221 9.181 5.366 1.00 0.00 H new ATOM 0 HB2 ALA A 437 4.083 10.164 6.573 1.00 0.00 H new ATOM 0 HB3 ALA A 437 4.063 10.667 4.866 1.00 0.00 H new ATOM 1017 N ARG A 438 5.878 9.253 2.937 1.00 0.00 N ATOM 1018 CA ARG A 438 5.955 8.844 1.542 1.00 0.00 C ATOM 1019 C ARG A 438 6.875 7.639 1.391 1.00 0.00 C ATOM 1020 O ARG A 438 6.468 6.598 0.878 1.00 0.00 O ATOM 1021 CB ARG A 438 6.460 10.000 0.675 1.00 0.00 C ATOM 1022 CG ARG A 438 6.130 9.842 -0.801 1.00 0.00 C ATOM 1023 CD ARG A 438 7.064 10.667 -1.672 1.00 0.00 C ATOM 1024 NE ARG A 438 7.383 9.989 -2.926 1.00 0.00 N ATOM 1025 CZ ARG A 438 8.257 8.989 -3.027 1.00 0.00 C ATOM 1026 NH1 ARG A 438 8.900 8.548 -1.952 1.00 0.00 N ATOM 1027 NH2 ARG A 438 8.489 8.428 -4.207 1.00 0.00 N ATOM 0 H ARG A 438 6.245 10.186 3.124 1.00 0.00 H new ATOM 0 HA ARG A 438 4.955 8.566 1.210 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.027 10.932 1.038 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.541 10.085 0.790 1.00 0.00 H new ATOM 0 HG2 ARG A 438 6.203 8.791 -1.081 1.00 0.00 H new ATOM 0 HG3 ARG A 438 5.099 10.148 -0.979 1.00 0.00 H new ATOM 0 HD2 ARG A 438 6.602 11.630 -1.888 1.00 0.00 H new ATOM 0 HD3 ARG A 438 7.985 10.870 -1.125 1.00 0.00 H new ATOM 0 HE ARG A 438 6.909 10.300 -3.774 1.00 0.00 H new ATOM 0 HH11 ARG A 438 8.726 8.975 -1.042 1.00 0.00 H new ATOM 0 HH12 ARG A 438 9.568 7.782 -2.036 1.00 0.00 H new ATOM 0 HH21 ARG A 438 7.998 8.763 -5.036 1.00 0.00 H new ATOM 0 HH22 ARG A 438 9.158 7.662 -4.285 1.00 0.00 H new ATOM 1041 N LYS A 439 8.114 7.786 1.853 1.00 0.00 N ATOM 1042 CA LYS A 439 9.090 6.702 1.780 1.00 0.00 C ATOM 1043 C LYS A 439 8.592 5.487 2.556 1.00 0.00 C ATOM 1044 O LYS A 439 8.814 4.343 2.155 1.00 0.00 O ATOM 1045 CB LYS A 439 10.440 7.162 2.334 1.00 0.00 C ATOM 1046 CG LYS A 439 11.573 6.187 2.059 1.00 0.00 C ATOM 1047 CD LYS A 439 12.881 6.912 1.791 1.00 0.00 C ATOM 1048 CE LYS A 439 13.753 6.966 3.035 1.00 0.00 C ATOM 1049 NZ LYS A 439 15.197 7.101 2.697 1.00 0.00 N ATOM 0 H LYS A 439 8.465 8.643 2.281 1.00 0.00 H new ATOM 0 HA LYS A 439 9.218 6.422 0.734 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.691 8.130 1.900 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.351 7.309 3.410 1.00 0.00 H new ATOM 0 HG2 LYS A 439 11.694 5.519 2.912 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.318 5.565 1.201 1.00 0.00 H new ATOM 0 HD2 LYS A 439 13.420 6.408 0.989 1.00 0.00 H new ATOM 0 HD3 LYS A 439 12.673 7.925 1.447 1.00 0.00 H new ATOM 0 HE2 LYS A 439 13.446 7.807 3.657 1.00 0.00 H new ATOM 0 HE3 LYS A 439 13.601 6.061 3.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 15.757 7.134 3.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 15.497 6.286 2.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 15.347 7.977 2.157 1.00 0.00 H new ATOM 1063 N GLU A 440 7.907 5.743 3.666 1.00 0.00 N ATOM 1064 CA GLU A 440 7.368 4.671 4.491 1.00 0.00 C ATOM 1065 C GLU A 440 6.343 3.865 3.702 1.00 0.00 C ATOM 1066 O GLU A 440 6.328 2.635 3.755 1.00 0.00 O ATOM 1067 CB GLU A 440 6.724 5.242 5.756 1.00 0.00 C ATOM 1068 CG GLU A 440 6.131 4.182 6.671 1.00 0.00 C ATOM 1069 CD GLU A 440 5.786 4.723 8.044 1.00 0.00 C ATOM 1070 OE1 GLU A 440 6.721 5.082 8.791 1.00 0.00 O ATOM 1071 OE2 GLU A 440 4.583 4.785 8.373 1.00 0.00 O ATOM 0 H GLU A 440 7.713 6.682 4.013 1.00 0.00 H new ATOM 0 HA GLU A 440 8.187 4.014 4.783 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.472 5.810 6.309 1.00 0.00 H new ATOM 0 HB3 GLU A 440 5.939 5.942 5.469 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.233 3.771 6.210 1.00 0.00 H new ATOM 0 HG3 GLU A 440 6.840 3.360 6.776 1.00 0.00 H new ATOM 1078 N ALA A 441 5.492 4.570 2.963 1.00 0.00 N ATOM 1079 CA ALA A 441 4.468 3.926 2.152 1.00 0.00 C ATOM 1080 C ALA A 441 5.100 3.113 1.030 1.00 0.00 C ATOM 1081 O ALA A 441 4.888 1.905 0.931 1.00 0.00 O ATOM 1082 CB ALA A 441 3.512 4.964 1.584 1.00 0.00 C ATOM 0 H ALA A 441 5.492 5.589 2.910 1.00 0.00 H new ATOM 0 HA ALA A 441 3.904 3.245 2.790 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.752 4.467 0.980 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.031 5.502 2.401 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.066 5.668 0.963 1.00 0.00 H new ATOM 1088 N VAL A 442 5.887 3.782 0.189 1.00 0.00 N ATOM 1089 CA VAL A 442 6.562 3.122 -0.924 1.00 0.00 C ATOM 1090 C VAL A 442 7.250 1.841 -0.462 1.00 0.00 C ATOM 1091 O VAL A 442 7.153 0.799 -1.111 1.00 0.00 O ATOM 1092 CB VAL A 442 7.605 4.046 -1.579 1.00 0.00 C ATOM 1093 CG1 VAL A 442 6.924 5.150 -2.373 1.00 0.00 C ATOM 1094 CG2 VAL A 442 8.527 4.630 -0.527 1.00 0.00 C ATOM 0 H VAL A 442 6.072 4.783 0.259 1.00 0.00 H new ATOM 0 HA VAL A 442 5.796 2.877 -1.660 1.00 0.00 H new ATOM 0 HB VAL A 442 8.204 3.454 -2.271 1.00 0.00 H new ATOM 0 HG11 VAL A 442 7.680 5.791 -2.827 1.00 0.00 H new ATOM 0 HG12 VAL A 442 6.306 4.708 -3.154 1.00 0.00 H new ATOM 0 HG13 VAL A 442 6.297 5.744 -1.707 1.00 0.00 H new ATOM 0 HG21 VAL A 442 9.259 5.281 -1.005 1.00 0.00 H new ATOM 0 HG22 VAL A 442 7.942 5.207 0.190 1.00 0.00 H new ATOM 0 HG23 VAL A 442 9.044 3.823 -0.008 1.00 0.00 H new ATOM 1104 N CYS A 443 7.937 1.924 0.674 1.00 0.00 N ATOM 1105 CA CYS A 443 8.627 0.768 1.229 1.00 0.00 C ATOM 1106 C CYS A 443 7.618 -0.293 1.653 1.00 0.00 C ATOM 1107 O CYS A 443 7.809 -1.483 1.404 1.00 0.00 O ATOM 1108 CB CYS A 443 9.487 1.182 2.425 1.00 0.00 C ATOM 1109 SG CYS A 443 11.190 1.614 1.995 1.00 0.00 S ATOM 0 H CYS A 443 8.029 2.777 1.225 1.00 0.00 H new ATOM 0 HA CYS A 443 9.277 0.351 0.460 1.00 0.00 H new ATOM 0 HB2 CYS A 443 9.020 2.035 2.917 1.00 0.00 H new ATOM 0 HB3 CYS A 443 9.502 0.366 3.148 1.00 0.00 H new ATOM 0 HG CYS A 443 11.837 1.952 3.071 1.00 0.00 H new ATOM 1115 N LYS A 444 6.539 0.154 2.289 1.00 0.00 N ATOM 1116 CA LYS A 444 5.487 -0.743 2.749 1.00 0.00 C ATOM 1117 C LYS A 444 4.783 -1.405 1.569 1.00 0.00 C ATOM 1118 O LYS A 444 4.756 -2.629 1.464 1.00 0.00 O ATOM 1119 CB LYS A 444 4.469 0.023 3.598 1.00 0.00 C ATOM 1120 CG LYS A 444 3.900 -0.793 4.747 1.00 0.00 C ATOM 1121 CD LYS A 444 3.613 0.078 5.959 1.00 0.00 C ATOM 1122 CE LYS A 444 3.702 -0.717 7.251 1.00 0.00 C ATOM 1123 NZ LYS A 444 2.931 -0.077 8.352 1.00 0.00 N ATOM 0 H LYS A 444 6.371 1.138 2.498 1.00 0.00 H new ATOM 0 HA LYS A 444 5.948 -1.520 3.359 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.943 0.919 3.999 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.651 0.355 2.959 1.00 0.00 H new ATOM 0 HG2 LYS A 444 2.982 -1.285 4.426 1.00 0.00 H new ATOM 0 HG3 LYS A 444 4.604 -1.579 5.021 1.00 0.00 H new ATOM 0 HD2 LYS A 444 4.322 0.905 5.990 1.00 0.00 H new ATOM 0 HD3 LYS A 444 2.618 0.515 5.867 1.00 0.00 H new ATOM 0 HE2 LYS A 444 3.325 -1.726 7.083 1.00 0.00 H new ATOM 0 HE3 LYS A 444 4.747 -0.812 7.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 3.018 -0.650 9.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 3.307 0.876 8.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 1.929 -0.009 8.081 1.00 0.00 H new ATOM 1137 N ILE A 445 4.218 -0.591 0.678 1.00 0.00 N ATOM 1138 CA ILE A 445 3.522 -1.115 -0.495 1.00 0.00 C ATOM 1139 C ILE A 445 4.406 -2.107 -1.244 1.00 0.00 C ATOM 1140 O ILE A 445 3.966 -3.201 -1.599 1.00 0.00 O ATOM 1141 CB ILE A 445 3.085 0.009 -1.455 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.275 0.902 -1.812 1.00 0.00 C ATOM 1143 CG2 ILE A 445 1.968 0.832 -0.833 1.00 0.00 C ATOM 1144 CD1 ILE A 445 4.967 0.501 -3.096 1.00 0.00 C ATOM 0 H ILE A 445 4.228 0.427 0.745 1.00 0.00 H new ATOM 0 HA ILE A 445 2.627 -1.622 -0.135 1.00 0.00 H new ATOM 0 HB ILE A 445 2.710 -0.445 -2.372 1.00 0.00 H new ATOM 0 HG12 ILE A 445 3.932 1.933 -1.900 1.00 0.00 H new ATOM 0 HG13 ILE A 445 4.997 0.875 -0.996 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.670 1.622 -1.523 1.00 0.00 H new ATOM 0 HG22 ILE A 445 1.113 0.188 -0.628 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.319 1.277 0.098 1.00 0.00 H new ATOM 0 HD11 ILE A 445 5.800 1.177 -3.287 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.341 -0.519 -3.005 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.259 0.555 -3.923 1.00 0.00 H new ATOM 1156 N GLN A 446 5.662 -1.726 -1.460 1.00 0.00 N ATOM 1157 CA GLN A 446 6.608 -2.598 -2.143 1.00 0.00 C ATOM 1158 C GLN A 446 6.937 -3.793 -1.256 1.00 0.00 C ATOM 1159 O GLN A 446 7.158 -4.904 -1.741 1.00 0.00 O ATOM 1160 CB GLN A 446 7.888 -1.833 -2.489 1.00 0.00 C ATOM 1161 CG GLN A 446 8.873 -2.640 -3.320 1.00 0.00 C ATOM 1162 CD GLN A 446 8.443 -2.774 -4.767 1.00 0.00 C ATOM 1163 OE1 GLN A 446 7.304 -2.468 -5.119 1.00 0.00 O ATOM 1164 NE2 GLN A 446 9.357 -3.231 -5.616 1.00 0.00 N ATOM 0 H GLN A 446 6.045 -0.825 -1.174 1.00 0.00 H new ATOM 0 HA GLN A 446 6.156 -2.951 -3.070 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.624 -0.926 -3.033 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.375 -1.520 -1.566 1.00 0.00 H new ATOM 0 HG2 GLN A 446 9.853 -2.164 -3.279 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.982 -3.633 -2.884 1.00 0.00 H new ATOM 0 HE21 GLN A 446 10.289 -3.473 -5.280 1.00 0.00 H new ATOM 0 HE22 GLN A 446 9.126 -3.340 -6.604 1.00 0.00 H new ATOM 1173 N ALA A 447 6.952 -3.552 0.052 1.00 0.00 N ATOM 1174 CA ALA A 447 7.235 -4.597 1.025 1.00 0.00 C ATOM 1175 C ALA A 447 6.131 -5.649 1.017 1.00 0.00 C ATOM 1176 O ALA A 447 6.399 -6.846 0.903 1.00 0.00 O ATOM 1177 CB ALA A 447 7.384 -3.991 2.413 1.00 0.00 C ATOM 0 H ALA A 447 6.770 -2.636 0.462 1.00 0.00 H new ATOM 0 HA ALA A 447 8.172 -5.084 0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 447 7.596 -4.781 3.134 1.00 0.00 H new ATOM 0 HB2 ALA A 447 8.204 -3.273 2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 447 6.459 -3.485 2.690 1.00 0.00 H new ATOM 1183 N ILE A 448 4.891 -5.190 1.131 1.00 0.00 N ATOM 1184 CA ILE A 448 3.738 -6.080 1.131 1.00 0.00 C ATOM 1185 C ILE A 448 3.623 -6.808 -0.205 1.00 0.00 C ATOM 1186 O ILE A 448 3.276 -7.988 -0.252 1.00 0.00 O ATOM 1187 CB ILE A 448 2.433 -5.306 1.407 1.00 0.00 C ATOM 1188 CG1 ILE A 448 1.240 -6.262 1.466 1.00 0.00 C ATOM 1189 CG2 ILE A 448 2.209 -4.239 0.346 1.00 0.00 C ATOM 1190 CD1 ILE A 448 0.027 -5.667 2.149 1.00 0.00 C ATOM 0 H ILE A 448 4.658 -4.201 1.225 1.00 0.00 H new ATOM 0 HA ILE A 448 3.887 -6.808 1.929 1.00 0.00 H new ATOM 0 HB ILE A 448 2.526 -4.814 2.375 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.969 -6.556 0.452 1.00 0.00 H new ATOM 0 HG13 ILE A 448 1.536 -7.169 1.993 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.283 -3.704 0.558 1.00 0.00 H new ATOM 0 HG22 ILE A 448 3.043 -3.538 0.353 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.139 -4.710 -0.635 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -0.782 -6.398 2.156 1.00 0.00 H new ATOM 0 HD12 ILE A 448 0.282 -5.398 3.174 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.294 -4.776 1.609 1.00 0.00 H new ATOM 1202 N LEU A 449 3.924 -6.098 -1.287 1.00 0.00 N ATOM 1203 CA LEU A 449 3.863 -6.680 -2.622 1.00 0.00 C ATOM 1204 C LEU A 449 4.836 -7.848 -2.739 1.00 0.00 C ATOM 1205 O LEU A 449 4.464 -8.941 -3.168 1.00 0.00 O ATOM 1206 CB LEU A 449 4.180 -5.619 -3.681 1.00 0.00 C ATOM 1207 CG LEU A 449 3.021 -5.272 -4.616 1.00 0.00 C ATOM 1208 CD1 LEU A 449 1.812 -4.807 -3.819 1.00 0.00 C ATOM 1209 CD2 LEU A 449 3.446 -4.205 -5.614 1.00 0.00 C ATOM 0 H LEU A 449 4.212 -5.120 -1.265 1.00 0.00 H new ATOM 0 HA LEU A 449 2.852 -7.051 -2.791 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.504 -4.709 -3.176 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.020 -5.967 -4.282 1.00 0.00 H new ATOM 0 HG LEU A 449 2.742 -6.170 -5.168 1.00 0.00 H new ATOM 0 HD11 LEU A 449 0.998 -4.565 -4.502 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.495 -5.601 -3.143 1.00 0.00 H new ATOM 0 HD13 LEU A 449 2.076 -3.922 -3.241 1.00 0.00 H new ATOM 0 HD21 LEU A 449 2.610 -3.969 -6.272 1.00 0.00 H new ATOM 0 HD22 LEU A 449 3.751 -3.306 -5.078 1.00 0.00 H new ATOM 0 HD23 LEU A 449 4.282 -4.574 -6.208 1.00 0.00 H new ATOM 1221 N GLU A 450 6.084 -7.609 -2.348 1.00 0.00 N ATOM 1222 CA GLU A 450 7.111 -8.642 -2.403 1.00 0.00 C ATOM 1223 C GLU A 450 6.727 -9.828 -1.525 1.00 0.00 C ATOM 1224 O GLU A 450 6.872 -10.983 -1.925 1.00 0.00 O ATOM 1225 CB GLU A 450 8.460 -8.075 -1.955 1.00 0.00 C ATOM 1226 CG GLU A 450 9.655 -8.820 -2.529 1.00 0.00 C ATOM 1227 CD GLU A 450 10.977 -8.180 -2.153 1.00 0.00 C ATOM 1228 OE1 GLU A 450 11.219 -7.030 -2.572 1.00 0.00 O ATOM 1229 OE2 GLU A 450 11.769 -8.830 -1.440 1.00 0.00 O ATOM 0 H GLU A 450 6.408 -6.710 -1.990 1.00 0.00 H new ATOM 0 HA GLU A 450 7.196 -8.985 -3.434 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.520 -7.027 -2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.513 -8.104 -0.867 1.00 0.00 H new ATOM 0 HG2 GLU A 450 9.641 -9.851 -2.174 1.00 0.00 H new ATOM 0 HG3 GLU A 450 9.569 -8.856 -3.615 1.00 0.00 H new ATOM 1236 N LYS A 451 6.233 -9.533 -0.325 1.00 0.00 N ATOM 1237 CA LYS A 451 5.821 -10.575 0.609 1.00 0.00 C ATOM 1238 C LYS A 451 4.738 -11.454 -0.005 1.00 0.00 C ATOM 1239 O LYS A 451 4.773 -12.679 0.119 1.00 0.00 O ATOM 1240 CB LYS A 451 5.312 -9.950 1.910 1.00 0.00 C ATOM 1241 CG LYS A 451 5.352 -10.900 3.096 1.00 0.00 C ATOM 1242 CD LYS A 451 5.190 -10.155 4.411 1.00 0.00 C ATOM 1243 CE LYS A 451 5.565 -11.032 5.596 1.00 0.00 C ATOM 1244 NZ LYS A 451 4.396 -11.798 6.111 1.00 0.00 N ATOM 0 H LYS A 451 6.109 -8.582 0.022 1.00 0.00 H new ATOM 0 HA LYS A 451 6.688 -11.197 0.829 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.912 -9.069 2.140 1.00 0.00 H new ATOM 0 HB3 LYS A 451 4.287 -9.608 1.763 1.00 0.00 H new ATOM 0 HG2 LYS A 451 4.559 -11.642 2.997 1.00 0.00 H new ATOM 0 HG3 LYS A 451 6.298 -11.442 3.098 1.00 0.00 H new ATOM 0 HD2 LYS A 451 5.816 -9.262 4.405 1.00 0.00 H new ATOM 0 HD3 LYS A 451 4.158 -9.820 4.516 1.00 0.00 H new ATOM 0 HE2 LYS A 451 6.352 -11.726 5.300 1.00 0.00 H new ATOM 0 HE3 LYS A 451 5.972 -10.410 6.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 4.213 -11.530 7.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 3.558 -11.583 5.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 4.599 -12.817 6.060 1.00 0.00 H new ATOM 1258 N LEU A 452 3.776 -10.821 -0.669 1.00 0.00 N ATOM 1259 CA LEU A 452 2.683 -11.545 -1.306 1.00 0.00 C ATOM 1260 C LEU A 452 3.208 -12.439 -2.425 1.00 0.00 C ATOM 1261 O LEU A 452 2.833 -13.607 -2.528 1.00 0.00 O ATOM 1262 CB LEU A 452 1.646 -10.564 -1.860 1.00 0.00 C ATOM 1263 CG LEU A 452 0.233 -10.725 -1.297 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.746 -9.839 -2.053 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.208 -12.181 -1.360 1.00 0.00 C ATOM 0 H LEU A 452 3.732 -9.808 -0.780 1.00 0.00 H new ATOM 0 HA LEU A 452 2.207 -12.175 -0.554 1.00 0.00 H new ATOM 0 HB2 LEU A 452 1.986 -9.548 -1.659 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.604 -10.678 -2.943 1.00 0.00 H new ATOM 0 HG LEU A 452 0.244 -10.415 -0.252 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.746 -9.966 -1.639 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.443 -8.796 -1.956 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.751 -10.119 -3.107 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.216 -12.274 -0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.201 -12.519 -2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.477 -12.794 -0.774 1.00 0.00 H new ATOM 1277 N GLU A 453 4.079 -11.882 -3.261 1.00 0.00 N ATOM 1278 CA GLU A 453 4.656 -12.630 -4.372 1.00 0.00 C ATOM 1279 C GLU A 453 5.404 -13.860 -3.869 1.00 0.00 C ATOM 1280 O GLU A 453 5.320 -14.936 -4.463 1.00 0.00 O ATOM 1281 CB GLU A 453 5.603 -11.736 -5.176 1.00 0.00 C ATOM 1282 CG GLU A 453 4.887 -10.689 -6.013 1.00 0.00 C ATOM 1283 CD GLU A 453 5.506 -10.516 -7.386 1.00 0.00 C ATOM 1284 OE1 GLU A 453 6.696 -10.859 -7.549 1.00 0.00 O ATOM 1285 OE2 GLU A 453 4.801 -10.037 -8.298 1.00 0.00 O ATOM 0 H GLU A 453 4.400 -10.916 -3.190 1.00 0.00 H new ATOM 0 HA GLU A 453 3.843 -12.961 -5.018 1.00 0.00 H new ATOM 0 HB2 GLU A 453 6.287 -11.236 -4.490 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.210 -12.361 -5.832 1.00 0.00 H new ATOM 0 HG2 GLU A 453 3.840 -10.972 -6.124 1.00 0.00 H new ATOM 0 HG3 GLU A 453 4.906 -9.734 -5.487 1.00 0.00 H new ATOM 1292 N LYS A 454 6.133 -13.695 -2.770 1.00 0.00 N ATOM 1293 CA LYS A 454 6.894 -14.792 -2.186 1.00 0.00 C ATOM 1294 C LYS A 454 5.963 -15.849 -1.601 1.00 0.00 C ATOM 1295 O LYS A 454 6.197 -17.048 -1.748 1.00 0.00 O ATOM 1296 CB LYS A 454 7.835 -14.268 -1.100 1.00 0.00 C ATOM 1297 CG LYS A 454 9.058 -15.143 -0.879 1.00 0.00 C ATOM 1298 CD LYS A 454 10.278 -14.314 -0.513 1.00 0.00 C ATOM 1299 CE LYS A 454 11.525 -15.176 -0.398 1.00 0.00 C ATOM 1300 NZ LYS A 454 12.691 -14.403 0.110 1.00 0.00 N ATOM 0 H LYS A 454 6.212 -12.812 -2.266 1.00 0.00 H new ATOM 0 HA LYS A 454 7.485 -15.252 -2.978 1.00 0.00 H new ATOM 0 HB2 LYS A 454 8.161 -13.263 -1.368 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.284 -14.185 -0.163 1.00 0.00 H new ATOM 0 HG2 LYS A 454 8.854 -15.862 -0.085 1.00 0.00 H new ATOM 0 HG3 LYS A 454 9.264 -15.716 -1.783 1.00 0.00 H new ATOM 0 HD2 LYS A 454 10.435 -13.544 -1.268 1.00 0.00 H new ATOM 0 HD3 LYS A 454 10.100 -13.802 0.433 1.00 0.00 H new ATOM 0 HE2 LYS A 454 11.326 -16.014 0.270 1.00 0.00 H new ATOM 0 HE3 LYS A 454 11.766 -15.597 -1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 13.520 -15.027 0.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 12.897 -13.618 -0.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 12.471 -14.022 1.053 1.00 0.00 H new ATOM 1314 N LYS A 455 4.904 -15.395 -0.938 1.00 0.00 N ATOM 1315 CA LYS A 455 3.935 -16.301 -0.332 1.00 0.00 C ATOM 1316 C LYS A 455 3.059 -16.953 -1.398 1.00 0.00 C ATOM 1317 O LYS A 455 2.667 -18.113 -1.268 1.00 0.00 O ATOM 1318 CB LYS A 455 3.061 -15.549 0.672 1.00 0.00 C ATOM 1319 CG LYS A 455 3.616 -15.554 2.088 1.00 0.00 C ATOM 1320 CD LYS A 455 2.524 -15.317 3.117 1.00 0.00 C ATOM 1321 CE LYS A 455 3.060 -14.595 4.343 1.00 0.00 C ATOM 1322 NZ LYS A 455 2.076 -13.623 4.891 1.00 0.00 N ATOM 0 H LYS A 455 4.695 -14.405 -0.807 1.00 0.00 H new ATOM 0 HA LYS A 455 4.485 -17.084 0.190 1.00 0.00 H new ATOM 0 HB2 LYS A 455 2.946 -14.517 0.340 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.066 -15.994 0.679 1.00 0.00 H new ATOM 0 HG2 LYS A 455 4.102 -16.509 2.286 1.00 0.00 H new ATOM 0 HG3 LYS A 455 4.380 -14.782 2.183 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.722 -14.730 2.669 1.00 0.00 H new ATOM 0 HD3 LYS A 455 2.091 -16.272 3.416 1.00 0.00 H new ATOM 0 HE2 LYS A 455 3.315 -15.325 5.111 1.00 0.00 H new ATOM 0 HE3 LYS A 455 3.980 -14.072 4.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 2.176 -13.574 5.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 2.251 -12.683 4.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 1.112 -13.932 4.650 1.00 0.00 H new ATOM 1336 N GLY A 456 2.755 -16.198 -2.450 1.00 0.00 N ATOM 1337 CA GLY A 456 1.928 -16.719 -3.523 1.00 0.00 C ATOM 1338 C GLY A 456 2.728 -17.495 -4.549 1.00 0.00 C ATOM 1339 O GLY A 456 2.503 -18.717 -4.679 1.00 0.00 O ATOM 1340 OXT GLY A 456 3.582 -16.882 -5.223 1.00 0.00 O ATOM 0 H GLY A 456 3.067 -15.235 -2.578 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.158 -17.366 -3.102 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.416 -15.893 -4.016 1.00 0.00 H new