USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=12 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 Single : A 379 SER OG : rot 33:sc= -1.8 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=-0.00545 X(o=-0.0054,f=0) USER MOD Single : A 389 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.186) USER MOD Single : A 391 GLN : amide:sc= -0.428 K(o=-0.43,f=-3.6!) USER MOD Single : A 392 TYR OH : rot 15:sc= -1.92 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot -33:sc= 0.659 USER MOD Single : A 407 LYS NZ :NH3+ -137:sc= -0.188 (180deg=-0.958) USER MOD Single : A 409 TYR OH : rot 180:sc= -0.572 USER MOD Single : A 415 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot 33:sc= 1 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 THR OG1 : rot 180:sc= 0.587 USER MOD Single : A 431 GLN : amide:sc= -1.55 K(o=-1.6,f=-13!) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 439 LYS NZ :NH3+ -156:sc= -0.0404 (180deg=-0.299) 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= -0.123 X(o=-0.12,f=-0.015) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 -0.450 17.482 1.856 1.00 0.00 N ATOM 44 CA SER A 379 -1.105 16.402 1.128 1.00 0.00 C ATOM 45 C SER A 379 -1.042 15.094 1.916 1.00 0.00 C ATOM 46 O SER A 379 -1.413 14.035 1.406 1.00 0.00 O ATOM 47 CB SER A 379 -0.457 16.218 -0.245 1.00 0.00 C ATOM 48 OG SER A 379 -0.824 17.263 -1.128 1.00 0.00 O ATOM 0 HA SER A 379 -2.153 16.672 0.994 1.00 0.00 H new ATOM 0 HB2 SER A 379 0.627 16.193 -0.138 1.00 0.00 H new ATOM 0 HB3 SER A 379 -0.758 15.259 -0.667 1.00 0.00 H new ATOM 0 HG SER A 379 -0.945 18.093 -0.621 1.00 0.00 H new ATOM 54 N ILE A 380 -0.564 15.171 3.160 1.00 0.00 N ATOM 55 CA ILE A 380 -0.441 13.998 4.024 1.00 0.00 C ATOM 56 C ILE A 380 -1.656 13.078 3.909 1.00 0.00 C ATOM 57 O ILE A 380 -1.537 11.862 4.047 1.00 0.00 O ATOM 58 CB ILE A 380 -0.260 14.411 5.501 1.00 0.00 C ATOM 59 CG1 ILE A 380 -0.008 13.179 6.377 1.00 0.00 C ATOM 60 CG2 ILE A 380 -1.478 15.181 5.993 1.00 0.00 C ATOM 61 CD1 ILE A 380 1.421 13.062 6.859 1.00 0.00 C ATOM 0 H ILE A 380 -0.254 16.041 3.593 1.00 0.00 H new ATOM 0 HA ILE A 380 0.443 13.456 3.687 1.00 0.00 H new ATOM 0 HB ILE A 380 0.610 15.064 5.572 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.672 13.215 7.240 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -0.267 12.283 5.813 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -1.333 15.464 7.036 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -1.610 16.078 5.388 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -2.365 14.553 5.908 1.00 0.00 H new ATOM 0 HD11 ILE A 380 1.526 12.167 7.473 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.090 12.994 6.001 1.00 0.00 H new ATOM 0 HD13 ILE A 380 1.678 13.940 7.451 1.00 0.00 H new ATOM 73 N LYS A 381 -2.822 13.663 3.649 1.00 0.00 N ATOM 74 CA LYS A 381 -4.054 12.886 3.512 1.00 0.00 C ATOM 75 C LYS A 381 -3.831 11.660 2.631 1.00 0.00 C ATOM 76 O LYS A 381 -4.475 10.624 2.812 1.00 0.00 O ATOM 77 CB LYS A 381 -5.165 13.758 2.922 1.00 0.00 C ATOM 78 CG LYS A 381 -6.011 14.457 3.972 1.00 0.00 C ATOM 79 CD LYS A 381 -6.844 15.574 3.362 1.00 0.00 C ATOM 80 CE LYS A 381 -6.192 16.931 3.570 1.00 0.00 C ATOM 81 NZ LYS A 381 -6.673 17.936 2.580 1.00 0.00 N ATOM 0 H LYS A 381 -2.941 14.669 3.529 1.00 0.00 H new ATOM 0 HA LYS A 381 -4.353 12.547 4.504 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -4.719 14.508 2.269 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.811 13.138 2.301 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.668 13.732 4.453 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -5.365 14.866 4.749 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.974 15.391 2.295 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -7.838 15.574 3.809 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -6.404 17.285 4.579 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -5.110 16.830 3.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -6.205 18.848 2.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -6.448 17.611 1.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -7.702 18.052 2.675 1.00 0.00 H new ATOM 95 N LYS A 382 -2.910 11.783 1.680 1.00 0.00 N ATOM 96 CA LYS A 382 -2.595 10.688 0.772 1.00 0.00 C ATOM 97 C LYS A 382 -1.888 9.554 1.507 1.00 0.00 C ATOM 98 O LYS A 382 -2.327 8.406 1.461 1.00 0.00 O ATOM 99 CB LYS A 382 -1.719 11.190 -0.379 1.00 0.00 C ATOM 100 CG LYS A 382 -2.054 10.556 -1.720 1.00 0.00 C ATOM 101 CD LYS A 382 -3.138 11.333 -2.448 1.00 0.00 C ATOM 102 CE LYS A 382 -4.505 10.697 -2.258 1.00 0.00 C ATOM 103 NZ LYS A 382 -5.582 11.720 -2.131 1.00 0.00 N ATOM 0 H LYS A 382 -2.368 12.632 1.519 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.532 10.304 0.368 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.826 12.272 -0.461 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -0.674 10.990 -0.143 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -1.157 10.514 -2.338 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -2.383 9.528 -1.566 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -3.159 12.359 -2.082 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.902 11.379 -3.511 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -4.722 10.044 -3.104 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -4.493 10.070 -1.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -6.498 11.245 -2.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -5.389 12.327 -1.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -5.611 12.302 -2.992 1.00 0.00 H new ATOM 117 N ILE A 383 -0.792 9.881 2.187 1.00 0.00 N ATOM 118 CA ILE A 383 -0.033 8.881 2.929 1.00 0.00 C ATOM 119 C ILE A 383 -0.891 8.241 4.020 1.00 0.00 C ATOM 120 O ILE A 383 -0.681 7.086 4.389 1.00 0.00 O ATOM 121 CB ILE A 383 1.250 9.478 3.551 1.00 0.00 C ATOM 122 CG1 ILE A 383 0.924 10.344 4.773 1.00 0.00 C ATOM 123 CG2 ILE A 383 2.006 10.292 2.510 1.00 0.00 C ATOM 124 CD1 ILE A 383 1.431 9.762 6.076 1.00 0.00 C ATOM 0 H ILE A 383 -0.412 10.826 2.239 1.00 0.00 H new ATOM 0 HA ILE A 383 0.263 8.113 2.215 1.00 0.00 H new ATOM 0 HB ILE A 383 1.881 8.654 3.885 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.357 11.334 4.633 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.156 10.475 4.838 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.908 10.708 2.958 1.00 0.00 H new ATOM 0 HG22 ILE A 383 2.280 9.649 1.674 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.372 11.103 2.151 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.166 10.426 6.899 1.00 0.00 H new ATOM 0 HD12 ILE A 383 0.978 8.784 6.238 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.515 9.657 6.030 1.00 0.00 H new ATOM 136 N ILE A 384 -1.862 8.997 4.523 1.00 0.00 N ATOM 137 CA ILE A 384 -2.755 8.500 5.563 1.00 0.00 C ATOM 138 C ILE A 384 -3.715 7.464 4.992 1.00 0.00 C ATOM 139 O ILE A 384 -3.788 6.334 5.477 1.00 0.00 O ATOM 140 CB ILE A 384 -3.565 9.642 6.207 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.628 10.749 6.697 1.00 0.00 C ATOM 142 CG2 ILE A 384 -4.413 9.114 7.357 1.00 0.00 C ATOM 143 CD1 ILE A 384 -3.295 12.103 6.803 1.00 0.00 C ATOM 0 H ILE A 384 -2.050 9.955 4.227 1.00 0.00 H new ATOM 0 HA ILE A 384 -2.133 8.040 6.331 1.00 0.00 H new ATOM 0 HB ILE A 384 -4.232 10.060 5.453 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -2.230 10.472 7.673 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -1.780 10.823 6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -4.978 9.935 7.799 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -5.104 8.358 6.983 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.765 8.671 8.113 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -2.572 12.838 7.156 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -3.668 12.402 5.824 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -4.126 12.045 7.506 1.00 0.00 H new ATOM 155 N HIS A 385 -4.444 7.853 3.948 1.00 0.00 N ATOM 156 CA HIS A 385 -5.391 6.952 3.302 1.00 0.00 C ATOM 157 C HIS A 385 -4.688 5.677 2.855 1.00 0.00 C ATOM 158 O HIS A 385 -5.212 4.574 3.016 1.00 0.00 O ATOM 159 CB HIS A 385 -6.045 7.640 2.102 1.00 0.00 C ATOM 160 CG HIS A 385 -7.413 7.118 1.786 1.00 0.00 C ATOM 161 ND1 HIS A 385 -8.412 7.904 1.250 1.00 0.00 N ATOM 162 CD2 HIS A 385 -7.945 5.882 1.931 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.501 7.172 1.081 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.243 5.942 1.486 1.00 0.00 N ATOM 0 H HIS A 385 -4.396 8.784 3.534 1.00 0.00 H new ATOM 0 HA HIS A 385 -6.166 6.691 4.022 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -6.110 8.710 2.298 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.406 7.514 1.228 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -7.442 5.010 2.324 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -10.441 7.521 0.680 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -9.901 5.163 1.471 1.00 0.00 H new ATOM 173 N VAL A 386 -3.490 5.838 2.299 1.00 0.00 N ATOM 174 CA VAL A 386 -2.705 4.701 1.838 1.00 0.00 C ATOM 175 C VAL A 386 -2.272 3.837 3.014 1.00 0.00 C ATOM 176 O VAL A 386 -2.357 2.611 2.960 1.00 0.00 O ATOM 177 CB VAL A 386 -1.454 5.156 1.062 1.00 0.00 C ATOM 178 CG1 VAL A 386 -0.731 3.956 0.465 1.00 0.00 C ATOM 179 CG2 VAL A 386 -1.828 6.154 -0.023 1.00 0.00 C ATOM 0 H VAL A 386 -3.044 6.744 2.158 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.341 4.121 1.170 1.00 0.00 H new ATOM 0 HB VAL A 386 -0.778 5.651 1.759 1.00 0.00 H new ATOM 0 HG11 VAL A 386 0.150 4.296 -0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -0.425 3.281 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -1.399 3.431 -0.218 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.930 6.462 -0.559 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -2.525 5.689 -0.720 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -2.297 7.027 0.431 1.00 0.00 H new ATOM 189 N LEU A 387 -1.816 4.484 4.083 1.00 0.00 N ATOM 190 CA LEU A 387 -1.375 3.773 5.277 1.00 0.00 C ATOM 191 C LEU A 387 -2.470 2.838 5.781 1.00 0.00 C ATOM 192 O LEU A 387 -2.228 1.653 6.019 1.00 0.00 O ATOM 193 CB LEU A 387 -0.989 4.766 6.375 1.00 0.00 C ATOM 194 CG LEU A 387 0.468 5.233 6.342 1.00 0.00 C ATOM 195 CD1 LEU A 387 0.687 6.367 7.329 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.405 4.074 6.642 1.00 0.00 C ATOM 0 H LEU A 387 -1.743 5.499 4.146 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.501 3.177 5.016 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.637 5.639 6.298 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.186 4.308 7.344 1.00 0.00 H new ATOM 0 HG LEU A 387 0.689 5.603 5.341 1.00 0.00 H new ATOM 0 HD11 LEU A 387 1.729 6.686 7.292 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.041 7.206 7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 387 0.449 6.024 8.336 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.437 4.424 6.614 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.184 3.674 7.632 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.267 3.292 5.895 1.00 0.00 H new ATOM 208 N GLU A 388 -3.675 3.375 5.934 1.00 0.00 N ATOM 209 CA GLU A 388 -4.808 2.585 6.401 1.00 0.00 C ATOM 210 C GLU A 388 -5.110 1.457 5.420 1.00 0.00 C ATOM 211 O GLU A 388 -5.216 0.291 5.807 1.00 0.00 O ATOM 212 CB GLU A 388 -6.040 3.475 6.578 1.00 0.00 C ATOM 213 CG GLU A 388 -6.484 3.618 8.025 1.00 0.00 C ATOM 214 CD GLU A 388 -5.698 4.676 8.774 1.00 0.00 C ATOM 215 OE1 GLU A 388 -4.452 4.662 8.691 1.00 0.00 O ATOM 216 OE2 GLU A 388 -6.330 5.520 9.445 1.00 0.00 O ATOM 0 H GLU A 388 -3.892 4.353 5.742 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.551 2.148 7.366 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.825 4.464 6.173 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.863 3.063 5.993 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -7.544 3.871 8.053 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.371 2.660 8.532 1.00 0.00 H new ATOM 223 N LYS A 389 -5.245 1.812 4.144 1.00 0.00 N ATOM 224 CA LYS A 389 -5.529 0.830 3.104 1.00 0.00 C ATOM 225 C LYS A 389 -4.459 -0.257 3.083 1.00 0.00 C ATOM 226 O LYS A 389 -4.768 -1.447 3.166 1.00 0.00 O ATOM 227 CB LYS A 389 -5.612 1.515 1.737 1.00 0.00 C ATOM 228 CG LYS A 389 -6.937 1.288 1.026 1.00 0.00 C ATOM 229 CD LYS A 389 -7.143 -0.182 0.689 1.00 0.00 C ATOM 230 CE LYS A 389 -8.397 -0.735 1.348 1.00 0.00 C ATOM 231 NZ LYS A 389 -8.583 -2.184 1.061 1.00 0.00 N ATOM 0 H LYS A 389 -5.162 2.771 3.807 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.490 0.364 3.325 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.456 2.586 1.866 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.802 1.149 1.106 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.755 1.636 1.657 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -6.967 1.880 0.111 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -7.216 -0.302 -0.392 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -6.276 -0.756 1.015 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -8.338 -0.583 2.426 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -9.267 -0.181 0.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.286 -2.580 1.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -8.916 -2.304 0.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -7.677 -2.681 1.182 1.00 0.00 H new ATOM 245 N VAL A 390 -3.201 0.160 2.981 1.00 0.00 N ATOM 246 CA VAL A 390 -2.086 -0.780 2.959 1.00 0.00 C ATOM 247 C VAL A 390 -2.084 -1.639 4.220 1.00 0.00 C ATOM 248 O VAL A 390 -1.705 -2.809 4.185 1.00 0.00 O ATOM 249 CB VAL A 390 -0.732 -0.053 2.838 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.413 -1.052 2.744 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.734 0.877 1.633 1.00 0.00 C ATOM 0 H VAL A 390 -2.929 1.141 2.912 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.218 -1.415 2.083 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.584 0.546 3.736 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.358 -0.515 2.659 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.428 -1.674 3.639 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.274 -1.683 1.866 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.229 1.383 1.562 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.907 0.297 0.726 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.525 1.618 1.747 1.00 0.00 H new ATOM 261 N GLN A 391 -2.520 -1.053 5.331 1.00 0.00 N ATOM 262 CA GLN A 391 -2.581 -1.772 6.599 1.00 0.00 C ATOM 263 C GLN A 391 -3.529 -2.959 6.481 1.00 0.00 C ATOM 264 O GLN A 391 -3.134 -4.109 6.684 1.00 0.00 O ATOM 265 CB GLN A 391 -3.042 -0.840 7.719 1.00 0.00 C ATOM 266 CG GLN A 391 -2.895 -1.440 9.109 1.00 0.00 C ATOM 267 CD GLN A 391 -4.035 -1.059 10.032 1.00 0.00 C ATOM 268 OE1 GLN A 391 -5.024 -0.464 9.603 1.00 0.00 O ATOM 269 NE2 GLN A 391 -3.906 -1.404 11.308 1.00 0.00 N ATOM 0 H GLN A 391 -2.836 -0.084 5.379 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.583 -2.138 6.841 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.469 0.086 7.669 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.087 -0.577 7.554 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -2.845 -2.526 9.028 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.953 -1.109 9.546 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -3.069 -1.896 11.621 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -4.644 -1.177 11.975 1.00 0.00 H new ATOM 278 N TYR A 392 -4.781 -2.672 6.131 1.00 0.00 N ATOM 279 CA TYR A 392 -5.782 -3.719 5.965 1.00 0.00 C ATOM 280 C TYR A 392 -5.329 -4.704 4.894 1.00 0.00 C ATOM 281 O TYR A 392 -5.360 -5.919 5.094 1.00 0.00 O ATOM 282 CB TYR A 392 -7.137 -3.117 5.582 1.00 0.00 C ATOM 283 CG TYR A 392 -7.471 -1.842 6.324 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.482 -1.805 7.713 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.777 -0.675 5.634 1.00 0.00 C ATOM 286 CE1 TYR A 392 -7.786 -0.641 8.393 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.083 0.492 6.307 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.086 0.503 7.687 1.00 0.00 C ATOM 289 OH TYR A 392 -8.391 1.664 8.360 1.00 0.00 O ATOM 0 H TYR A 392 -5.124 -1.727 5.958 1.00 0.00 H new ATOM 0 HA TYR A 392 -5.894 -4.244 6.913 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -7.145 -2.915 4.511 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.918 -3.853 5.773 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.249 -2.700 8.270 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.776 -0.681 4.554 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.788 -0.628 9.473 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.319 1.391 5.756 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.123 1.578 9.299 1.00 0.00 H new ATOM 299 N LEU A 393 -4.893 -4.162 3.760 1.00 0.00 N ATOM 300 CA LEU A 393 -4.416 -4.981 2.655 1.00 0.00 C ATOM 301 C LEU A 393 -3.246 -5.849 3.108 1.00 0.00 C ATOM 302 O LEU A 393 -3.105 -6.995 2.683 1.00 0.00 O ATOM 303 CB LEU A 393 -3.993 -4.092 1.482 1.00 0.00 C ATOM 304 CG LEU A 393 -4.863 -4.215 0.231 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.969 -2.873 -0.478 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.303 -5.276 -0.706 1.00 0.00 C ATOM 0 H LEU A 393 -4.861 -3.158 3.584 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.227 -5.631 2.326 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -4.002 -3.053 1.812 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.964 -4.333 1.216 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.864 -4.521 0.535 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.592 -2.979 -1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -5.417 -2.141 0.194 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.974 -2.536 -0.770 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.935 -5.350 -1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.291 -5.001 -1.004 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.281 -6.238 -0.194 1.00 0.00 H new ATOM 318 N GLU A 394 -2.416 -5.293 3.988 1.00 0.00 N ATOM 319 CA GLU A 394 -1.265 -6.016 4.513 1.00 0.00 C ATOM 320 C GLU A 394 -1.728 -7.253 5.272 1.00 0.00 C ATOM 321 O GLU A 394 -1.289 -8.371 4.993 1.00 0.00 O ATOM 322 CB GLU A 394 -0.442 -5.111 5.433 1.00 0.00 C ATOM 323 CG GLU A 394 0.745 -4.462 4.742 1.00 0.00 C ATOM 324 CD GLU A 394 1.696 -3.798 5.719 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.661 -4.153 6.915 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.476 -2.923 5.287 1.00 0.00 O ATOM 0 H GLU A 394 -2.521 -4.345 4.351 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.637 -6.327 3.678 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -1.089 -4.331 5.836 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.084 -5.697 6.280 1.00 0.00 H new ATOM 0 HG2 GLU A 394 1.285 -5.217 4.170 1.00 0.00 H new ATOM 0 HG3 GLU A 394 0.385 -3.720 4.030 1.00 0.00 H new ATOM 333 N GLN A 395 -2.631 -7.048 6.227 1.00 0.00 N ATOM 334 CA GLN A 395 -3.166 -8.151 7.015 1.00 0.00 C ATOM 335 C GLN A 395 -3.779 -9.207 6.103 1.00 0.00 C ATOM 336 O GLN A 395 -3.618 -10.407 6.324 1.00 0.00 O ATOM 337 CB GLN A 395 -4.215 -7.641 8.006 1.00 0.00 C ATOM 338 CG GLN A 395 -4.751 -8.720 8.933 1.00 0.00 C ATOM 339 CD GLN A 395 -5.657 -8.164 10.012 1.00 0.00 C ATOM 340 OE1 GLN A 395 -6.532 -7.341 9.741 1.00 0.00 O ATOM 341 NE2 GLN A 395 -5.453 -8.612 11.246 1.00 0.00 N ATOM 0 H GLN A 395 -3.006 -6.132 6.472 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.347 -8.603 7.574 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -3.778 -6.842 8.606 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.046 -7.205 7.451 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -5.300 -9.457 8.347 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -3.915 -9.242 9.399 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -4.716 -9.294 11.426 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -6.033 -8.274 12.014 1.00 0.00 H new ATOM 350 N GLU A 396 -4.478 -8.748 5.067 1.00 0.00 N ATOM 351 CA GLU A 396 -5.108 -9.650 4.113 1.00 0.00 C ATOM 352 C GLU A 396 -4.061 -10.515 3.421 1.00 0.00 C ATOM 353 O GLU A 396 -4.090 -11.741 3.525 1.00 0.00 O ATOM 354 CB GLU A 396 -5.901 -8.857 3.072 1.00 0.00 C ATOM 355 CG GLU A 396 -6.782 -7.777 3.673 1.00 0.00 C ATOM 356 CD GLU A 396 -8.236 -7.913 3.262 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.940 -8.766 3.841 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.670 -7.164 2.361 1.00 0.00 O ATOM 0 H GLU A 396 -4.621 -7.758 4.869 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.793 -10.299 4.659 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.205 -8.398 2.370 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.523 -9.545 2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -6.710 -7.818 4.760 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.412 -6.799 3.366 1.00 0.00 H new ATOM 365 N VAL A 397 -3.134 -9.871 2.716 1.00 0.00 N ATOM 366 CA VAL A 397 -2.077 -10.592 2.013 1.00 0.00 C ATOM 367 C VAL A 397 -1.360 -11.558 2.952 1.00 0.00 C ATOM 368 O VAL A 397 -0.908 -12.625 2.534 1.00 0.00 O ATOM 369 CB VAL A 397 -1.044 -9.631 1.389 1.00 0.00 C ATOM 370 CG1 VAL A 397 -1.710 -8.712 0.378 1.00 0.00 C ATOM 371 CG2 VAL A 397 -0.338 -8.819 2.464 1.00 0.00 C ATOM 0 H VAL A 397 -3.093 -8.857 2.617 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.558 -11.152 1.211 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.296 -10.230 0.870 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -0.965 -8.042 -0.051 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -2.160 -9.309 -0.415 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -2.483 -8.125 0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 397 0.385 -8.149 1.998 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.071 -8.233 3.018 1.00 0.00 H new ATOM 0 HG23 VAL A 397 0.179 -9.492 3.148 1.00 0.00 H new ATOM 381 N GLU A 398 -1.264 -11.178 4.221 1.00 0.00 N ATOM 382 CA GLU A 398 -0.607 -12.012 5.219 1.00 0.00 C ATOM 383 C GLU A 398 -1.477 -13.212 5.578 1.00 0.00 C ATOM 384 O GLU A 398 -0.970 -14.301 5.847 1.00 0.00 O ATOM 385 CB GLU A 398 -0.299 -11.195 6.475 1.00 0.00 C ATOM 386 CG GLU A 398 1.022 -10.450 6.409 1.00 0.00 C ATOM 387 CD GLU A 398 1.681 -10.308 7.768 1.00 0.00 C ATOM 388 OE1 GLU A 398 1.534 -11.230 8.597 1.00 0.00 O ATOM 389 OE2 GLU A 398 2.343 -9.275 8.001 1.00 0.00 O ATOM 0 H GLU A 398 -1.633 -10.298 4.582 1.00 0.00 H new ATOM 0 HA GLU A 398 0.329 -12.377 4.795 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -1.103 -10.477 6.637 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -0.288 -11.861 7.338 1.00 0.00 H new ATOM 0 HG2 GLU A 398 1.698 -10.976 5.735 1.00 0.00 H new ATOM 0 HG3 GLU A 398 0.856 -9.460 5.985 1.00 0.00 H new ATOM 396 N GLU A 399 -2.790 -13.004 5.579 1.00 0.00 N ATOM 397 CA GLU A 399 -3.733 -14.069 5.906 1.00 0.00 C ATOM 398 C GLU A 399 -4.299 -14.724 4.645 1.00 0.00 C ATOM 399 O GLU A 399 -5.145 -15.613 4.729 1.00 0.00 O ATOM 400 CB GLU A 399 -4.876 -13.518 6.762 1.00 0.00 C ATOM 401 CG GLU A 399 -4.446 -13.125 8.168 1.00 0.00 C ATOM 402 CD GLU A 399 -5.205 -13.881 9.243 1.00 0.00 C ATOM 403 OE1 GLU A 399 -5.573 -15.048 8.999 1.00 0.00 O ATOM 404 OE2 GLU A 399 -5.428 -13.304 10.328 1.00 0.00 O ATOM 0 H GLU A 399 -3.225 -12.109 5.357 1.00 0.00 H new ATOM 0 HA GLU A 399 -3.192 -14.830 6.469 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.305 -12.648 6.265 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -5.664 -14.268 6.828 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -3.378 -13.312 8.283 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -4.599 -12.055 8.305 1.00 0.00 H new ATOM 411 N PHE A 400 -3.830 -14.283 3.477 1.00 0.00 N ATOM 412 CA PHE A 400 -4.294 -14.828 2.201 1.00 0.00 C ATOM 413 C PHE A 400 -4.351 -16.356 2.243 1.00 0.00 C ATOM 414 O PHE A 400 -3.550 -16.998 2.923 1.00 0.00 O ATOM 415 CB PHE A 400 -3.378 -14.361 1.063 1.00 0.00 C ATOM 416 CG PHE A 400 -3.724 -14.953 -0.275 1.00 0.00 C ATOM 417 CD1 PHE A 400 -4.934 -14.662 -0.888 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.841 -15.805 -0.919 1.00 0.00 C ATOM 419 CE1 PHE A 400 -5.254 -15.212 -2.113 1.00 0.00 C ATOM 420 CE2 PHE A 400 -3.158 -16.359 -2.144 1.00 0.00 C ATOM 421 CZ PHE A 400 -4.368 -16.062 -2.740 1.00 0.00 C ATOM 0 H PHE A 400 -3.128 -13.548 3.389 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.303 -14.458 2.020 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.426 -13.274 0.993 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.348 -14.619 1.309 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -5.633 -13.998 -0.402 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.893 -16.039 -0.457 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -6.199 -14.976 -2.580 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -2.461 -17.023 -2.635 1.00 0.00 H new ATOM 0 HZ PHE A 400 -4.620 -16.495 -3.697 1.00 0.00 H new ATOM 431 N VAL A 401 -5.311 -16.927 1.521 1.00 0.00 N ATOM 432 CA VAL A 401 -5.487 -18.378 1.477 1.00 0.00 C ATOM 433 C VAL A 401 -4.161 -19.102 1.239 1.00 0.00 C ATOM 434 O VAL A 401 -3.789 -19.996 1.999 1.00 0.00 O ATOM 435 CB VAL A 401 -6.505 -18.783 0.388 1.00 0.00 C ATOM 436 CG1 VAL A 401 -6.150 -18.145 -0.946 1.00 0.00 C ATOM 437 CG2 VAL A 401 -6.591 -20.299 0.260 1.00 0.00 C ATOM 0 H VAL A 401 -5.982 -16.406 0.956 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.872 -18.679 2.451 1.00 0.00 H new ATOM 0 HB VAL A 401 -7.486 -18.415 0.689 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.880 -18.444 -1.698 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -6.158 -17.060 -0.844 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -5.157 -18.473 -1.254 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -7.314 -20.558 -0.513 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -5.613 -20.697 -0.010 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.907 -20.727 1.211 1.00 0.00 H new ATOM 447 N GLY A 402 -3.451 -18.714 0.185 1.00 0.00 N ATOM 448 CA GLY A 402 -2.178 -19.343 -0.122 1.00 0.00 C ATOM 449 C GLY A 402 -1.985 -19.583 -1.606 1.00 0.00 C ATOM 450 O GLY A 402 -0.865 -19.517 -2.111 1.00 0.00 O ATOM 0 H GLY A 402 -3.733 -17.977 -0.461 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -1.368 -18.714 0.248 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -2.111 -20.294 0.407 1.00 0.00 H new ATOM 454 N LYS A 403 -3.079 -19.864 -2.308 1.00 0.00 N ATOM 455 CA LYS A 403 -3.020 -20.115 -3.744 1.00 0.00 C ATOM 456 C LYS A 403 -3.681 -18.980 -4.519 1.00 0.00 C ATOM 457 O LYS A 403 -4.807 -18.586 -4.218 1.00 0.00 O ATOM 458 CB LYS A 403 -3.699 -21.444 -4.081 1.00 0.00 C ATOM 459 CG LYS A 403 -2.732 -22.614 -4.176 1.00 0.00 C ATOM 460 CD LYS A 403 -3.043 -23.501 -5.370 1.00 0.00 C ATOM 461 CE LYS A 403 -4.413 -24.146 -5.244 1.00 0.00 C ATOM 462 NZ LYS A 403 -4.334 -25.507 -4.645 1.00 0.00 N ATOM 0 H LYS A 403 -4.015 -19.923 -1.907 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.971 -20.169 -4.036 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -4.448 -21.663 -3.320 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -4.228 -21.342 -5.029 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -1.712 -22.238 -4.257 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -2.783 -23.204 -3.261 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -3.001 -22.909 -6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -2.282 -24.276 -5.457 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -5.056 -23.516 -4.629 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -4.876 -24.209 -6.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -5.289 -25.912 -4.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -3.742 -26.116 -5.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -3.916 -25.444 -3.695 1.00 0.00 H new ATOM 476 N LYS A 404 -2.971 -18.459 -5.515 1.00 0.00 N ATOM 477 CA LYS A 404 -3.484 -17.364 -6.334 1.00 0.00 C ATOM 478 C LYS A 404 -4.647 -17.822 -7.211 1.00 0.00 C ATOM 479 O LYS A 404 -4.562 -17.790 -8.440 1.00 0.00 O ATOM 480 CB LYS A 404 -2.366 -16.786 -7.205 1.00 0.00 C ATOM 481 CG LYS A 404 -2.789 -15.571 -8.014 1.00 0.00 C ATOM 482 CD LYS A 404 -1.597 -14.709 -8.390 1.00 0.00 C ATOM 483 CE LYS A 404 -1.739 -14.143 -9.794 1.00 0.00 C ATOM 484 NZ LYS A 404 -1.101 -12.803 -9.920 1.00 0.00 N ATOM 0 H LYS A 404 -2.038 -18.777 -5.775 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.853 -16.589 -5.662 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -1.525 -16.512 -6.567 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -2.011 -17.560 -7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -3.304 -15.896 -8.918 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -3.500 -14.979 -7.438 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.498 -13.892 -7.676 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -0.684 -15.301 -8.326 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.286 -14.829 -10.510 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -2.796 -14.067 -10.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -1.220 -12.452 -10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -1.550 -12.141 -9.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -0.087 -12.879 -9.701 1.00 0.00 H new ATOM 498 N THR A 405 -5.732 -18.246 -6.574 1.00 0.00 N ATOM 499 CA THR A 405 -6.914 -18.708 -7.295 1.00 0.00 C ATOM 500 C THR A 405 -8.199 -18.143 -6.683 1.00 0.00 C ATOM 501 O THR A 405 -9.295 -18.404 -7.178 1.00 0.00 O ATOM 502 CB THR A 405 -6.969 -20.236 -7.297 1.00 0.00 C ATOM 503 OG1 THR A 405 -8.057 -20.697 -8.078 1.00 0.00 O ATOM 504 CG2 THR A 405 -7.111 -20.832 -5.914 1.00 0.00 C ATOM 0 H THR A 405 -5.819 -18.280 -5.558 1.00 0.00 H new ATOM 0 HA THR A 405 -6.839 -18.347 -8.321 1.00 0.00 H new ATOM 0 HB THR A 405 -6.016 -20.559 -7.717 1.00 0.00 H new ATOM 0 HG1 THR A 405 -8.801 -20.064 -8.008 1.00 0.00 H new ATOM 0 HG21 THR A 405 -7.144 -21.919 -5.988 1.00 0.00 H new ATOM 0 HG22 THR A 405 -6.260 -20.535 -5.301 1.00 0.00 H new ATOM 0 HG23 THR A 405 -8.032 -20.472 -5.455 1.00 0.00 H new ATOM 512 N ASP A 406 -8.061 -17.369 -5.605 1.00 0.00 N ATOM 513 CA ASP A 406 -9.212 -16.776 -4.937 1.00 0.00 C ATOM 514 C ASP A 406 -9.324 -15.291 -5.269 1.00 0.00 C ATOM 515 O ASP A 406 -8.359 -14.668 -5.712 1.00 0.00 O ATOM 516 CB ASP A 406 -9.101 -16.975 -3.422 1.00 0.00 C ATOM 517 CG ASP A 406 -10.237 -16.317 -2.662 1.00 0.00 C ATOM 518 OD1 ASP A 406 -11.379 -16.333 -3.168 1.00 0.00 O ATOM 519 OD2 ASP A 406 -9.984 -15.786 -1.560 1.00 0.00 O ATOM 0 H ASP A 406 -7.163 -17.141 -5.179 1.00 0.00 H new ATOM 0 HA ASP A 406 -10.113 -17.274 -5.294 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -9.090 -18.042 -3.199 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -8.152 -16.567 -3.074 1.00 0.00 H new ATOM 524 N LYS A 407 -10.508 -14.727 -5.049 1.00 0.00 N ATOM 525 CA LYS A 407 -10.746 -13.313 -5.323 1.00 0.00 C ATOM 526 C LYS A 407 -9.817 -12.431 -4.496 1.00 0.00 C ATOM 527 O LYS A 407 -9.492 -11.311 -4.894 1.00 0.00 O ATOM 528 CB LYS A 407 -12.204 -12.955 -5.026 1.00 0.00 C ATOM 529 CG LYS A 407 -13.170 -13.380 -6.119 1.00 0.00 C ATOM 530 CD LYS A 407 -13.088 -14.873 -6.387 1.00 0.00 C ATOM 531 CE LYS A 407 -14.265 -15.355 -7.222 1.00 0.00 C ATOM 532 NZ LYS A 407 -15.570 -14.987 -6.606 1.00 0.00 N ATOM 0 H LYS A 407 -11.318 -15.227 -4.682 1.00 0.00 H new ATOM 0 HA LYS A 407 -10.540 -13.135 -6.378 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.501 -13.424 -4.088 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -12.283 -11.877 -4.882 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -14.187 -13.117 -5.829 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.948 -12.832 -7.035 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -12.156 -15.100 -6.905 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -13.067 -15.413 -5.440 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -14.201 -14.925 -8.222 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -14.210 -16.438 -7.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -16.223 -15.794 -6.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -15.424 -14.735 -5.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -15.976 -14.174 -7.112 1.00 0.00 H new ATOM 546 N ALA A 408 -9.394 -12.941 -3.344 1.00 0.00 N ATOM 547 CA ALA A 408 -8.503 -12.202 -2.456 1.00 0.00 C ATOM 548 C ALA A 408 -7.281 -11.678 -3.203 1.00 0.00 C ATOM 549 O ALA A 408 -7.104 -10.471 -3.351 1.00 0.00 O ATOM 550 CB ALA A 408 -8.075 -13.079 -1.291 1.00 0.00 C ATOM 0 H ALA A 408 -9.655 -13.866 -3.002 1.00 0.00 H new ATOM 0 HA ALA A 408 -9.051 -11.342 -2.071 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -7.410 -12.515 -0.636 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.955 -13.394 -0.730 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.552 -13.957 -1.670 1.00 0.00 H new ATOM 556 N TYR A 409 -6.440 -12.594 -3.673 1.00 0.00 N ATOM 557 CA TYR A 409 -5.232 -12.226 -4.405 1.00 0.00 C ATOM 558 C TYR A 409 -5.541 -11.189 -5.484 1.00 0.00 C ATOM 559 O TYR A 409 -4.804 -10.219 -5.658 1.00 0.00 O ATOM 560 CB TYR A 409 -4.594 -13.468 -5.029 1.00 0.00 C ATOM 561 CG TYR A 409 -3.084 -13.399 -5.134 1.00 0.00 C ATOM 562 CD1 TYR A 409 -2.449 -12.246 -5.581 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.293 -14.488 -4.786 1.00 0.00 C ATOM 564 CE1 TYR A 409 -1.072 -12.182 -5.679 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.916 -14.432 -4.881 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.310 -13.277 -5.328 1.00 0.00 C ATOM 567 OH TYR A 409 1.061 -13.215 -5.424 1.00 0.00 O ATOM 0 H TYR A 409 -6.573 -13.599 -3.560 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.528 -11.783 -3.701 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.867 -14.341 -4.436 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -5.011 -13.616 -6.025 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -3.042 -11.386 -5.856 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.764 -15.394 -4.435 1.00 0.00 H new ATOM 0 HE1 TYR A 409 -0.595 -11.279 -6.029 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.317 -15.288 -4.607 1.00 0.00 H new ATOM 0 HH TYR A 409 1.448 -14.069 -5.138 1.00 0.00 H new ATOM 577 N TRP A 410 -6.647 -11.390 -6.196 1.00 0.00 N ATOM 578 CA TRP A 410 -7.052 -10.457 -7.243 1.00 0.00 C ATOM 579 C TRP A 410 -7.129 -9.038 -6.690 1.00 0.00 C ATOM 580 O TRP A 410 -6.366 -8.159 -7.092 1.00 0.00 O ATOM 581 CB TRP A 410 -8.412 -10.853 -7.822 1.00 0.00 C ATOM 582 CG TRP A 410 -8.472 -12.265 -8.316 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.425 -13.122 -8.498 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.650 -12.981 -8.698 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.882 -14.331 -8.969 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.246 -14.268 -9.099 1.00 0.00 C ATOM 587 CE3 TRP A 410 -11.008 -12.657 -8.738 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -10.153 -15.231 -9.535 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.908 -13.612 -9.170 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.477 -14.887 -9.564 1.00 0.00 C ATOM 0 H TRP A 410 -7.274 -12.184 -6.068 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.304 -10.494 -8.035 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.176 -10.713 -7.058 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.656 -10.180 -8.644 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.390 -12.885 -8.301 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.302 -15.141 -9.186 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.348 -11.677 -8.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.823 -16.213 -9.839 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.961 -13.373 -9.205 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -12.205 -15.612 -9.897 1.00 0.00 H new ATOM 601 N LEU A 411 -8.054 -8.829 -5.760 1.00 0.00 N ATOM 602 CA LEU A 411 -8.232 -7.520 -5.143 1.00 0.00 C ATOM 603 C LEU A 411 -6.982 -7.115 -4.365 1.00 0.00 C ATOM 604 O LEU A 411 -6.702 -5.928 -4.200 1.00 0.00 O ATOM 605 CB LEU A 411 -9.452 -7.525 -4.217 1.00 0.00 C ATOM 606 CG LEU A 411 -9.479 -8.642 -3.172 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.637 -8.263 -1.964 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.910 -8.943 -2.753 1.00 0.00 C ATOM 0 H LEU A 411 -8.691 -9.548 -5.417 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.397 -6.790 -5.936 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.499 -6.566 -3.700 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.351 -7.601 -4.829 1.00 0.00 H new ATOM 0 HG LEU A 411 -9.054 -9.542 -3.617 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.668 -9.069 -1.231 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.606 -8.096 -2.277 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -9.032 -7.351 -1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.911 -9.740 -2.009 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.360 -8.047 -2.326 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -11.485 -9.258 -3.623 1.00 0.00 H new ATOM 620 N LEU A 412 -6.228 -8.107 -3.898 1.00 0.00 N ATOM 621 CA LEU A 412 -5.003 -7.847 -3.150 1.00 0.00 C ATOM 622 C LEU A 412 -4.035 -7.018 -3.988 1.00 0.00 C ATOM 623 O LEU A 412 -3.787 -5.848 -3.697 1.00 0.00 O ATOM 624 CB LEU A 412 -4.332 -9.164 -2.736 1.00 0.00 C ATOM 625 CG LEU A 412 -4.872 -9.822 -1.461 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.961 -10.957 -1.021 1.00 0.00 C ATOM 627 CD2 LEU A 412 -5.020 -8.798 -0.346 1.00 0.00 C ATOM 0 H LEU A 412 -6.444 -9.096 -4.024 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.266 -7.288 -2.252 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.432 -9.873 -3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -3.266 -8.979 -2.602 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.857 -10.233 -1.681 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -4.359 -11.413 -0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -3.907 -11.707 -1.810 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.963 -10.566 -0.822 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -5.405 -9.287 0.549 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -4.048 -8.355 -0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -5.713 -8.017 -0.659 1.00 0.00 H new ATOM 639 N GLU A 413 -3.497 -7.638 -5.036 1.00 0.00 N ATOM 640 CA GLU A 413 -2.561 -6.963 -5.926 1.00 0.00 C ATOM 641 C GLU A 413 -3.214 -5.754 -6.588 1.00 0.00 C ATOM 642 O GLU A 413 -2.611 -4.686 -6.686 1.00 0.00 O ATOM 643 CB GLU A 413 -2.055 -7.932 -6.996 1.00 0.00 C ATOM 644 CG GLU A 413 -0.675 -7.582 -7.529 1.00 0.00 C ATOM 645 CD GLU A 413 -0.252 -8.472 -8.682 1.00 0.00 C ATOM 646 OE1 GLU A 413 0.016 -9.668 -8.441 1.00 0.00 O ATOM 647 OE2 GLU A 413 -0.193 -7.973 -9.825 1.00 0.00 O ATOM 0 H GLU A 413 -3.694 -8.606 -5.288 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.717 -6.616 -5.330 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -2.030 -8.939 -6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -2.763 -7.947 -7.825 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -0.669 -6.542 -7.856 1.00 0.00 H new ATOM 0 HG3 GLU A 413 0.054 -7.667 -6.723 1.00 0.00 H new ATOM 654 N GLU A 414 -4.455 -5.928 -7.040 1.00 0.00 N ATOM 655 CA GLU A 414 -5.190 -4.847 -7.689 1.00 0.00 C ATOM 656 C GLU A 414 -5.219 -3.605 -6.804 1.00 0.00 C ATOM 657 O GLU A 414 -4.709 -2.547 -7.179 1.00 0.00 O ATOM 658 CB GLU A 414 -6.617 -5.293 -8.011 1.00 0.00 C ATOM 659 CG GLU A 414 -7.336 -4.378 -8.989 1.00 0.00 C ATOM 660 CD GLU A 414 -7.158 -4.813 -10.431 1.00 0.00 C ATOM 661 OE1 GLU A 414 -6.935 -6.019 -10.665 1.00 0.00 O ATOM 662 OE2 GLU A 414 -7.241 -3.946 -11.326 1.00 0.00 O ATOM 0 H GLU A 414 -4.970 -6.805 -6.968 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.678 -4.598 -8.619 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -6.589 -6.301 -8.424 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.190 -5.343 -7.085 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -8.399 -4.357 -8.748 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -6.963 -3.361 -8.871 1.00 0.00 H new ATOM 669 N MET A 415 -5.812 -3.744 -5.623 1.00 0.00 N ATOM 670 CA MET A 415 -5.900 -2.636 -4.680 1.00 0.00 C ATOM 671 C MET A 415 -4.508 -2.118 -4.335 1.00 0.00 C ATOM 672 O MET A 415 -4.313 -0.922 -4.125 1.00 0.00 O ATOM 673 CB MET A 415 -6.629 -3.073 -3.407 1.00 0.00 C ATOM 674 CG MET A 415 -7.393 -1.948 -2.728 1.00 0.00 C ATOM 675 SD MET A 415 -8.780 -1.355 -3.715 1.00 0.00 S ATOM 676 CE MET A 415 -10.077 -2.469 -3.178 1.00 0.00 C ATOM 0 H MET A 415 -6.238 -4.611 -5.297 1.00 0.00 H new ATOM 0 HA MET A 415 -6.467 -1.831 -5.149 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.324 -3.876 -3.653 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.903 -3.484 -2.705 1.00 0.00 H new ATOM 0 HG2 MET A 415 -7.761 -2.295 -1.763 1.00 0.00 H new ATOM 0 HG3 MET A 415 -6.713 -1.120 -2.530 1.00 0.00 H new ATOM 0 HE1 MET A 415 -11.003 -2.229 -3.701 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.790 -3.496 -3.402 1.00 0.00 H new ATOM 0 HE3 MET A 415 -10.228 -2.361 -2.104 1.00 0.00 H new ATOM 686 N LEU A 416 -3.540 -3.030 -4.285 1.00 0.00 N ATOM 687 CA LEU A 416 -2.162 -2.665 -3.976 1.00 0.00 C ATOM 688 C LEU A 416 -1.641 -1.641 -4.980 1.00 0.00 C ATOM 689 O LEU A 416 -1.207 -0.552 -4.604 1.00 0.00 O ATOM 690 CB LEU A 416 -1.267 -3.910 -3.983 1.00 0.00 C ATOM 691 CG LEU A 416 -0.437 -4.122 -2.716 1.00 0.00 C ATOM 692 CD1 LEU A 416 0.272 -2.836 -2.317 1.00 0.00 C ATOM 693 CD2 LEU A 416 -1.316 -4.623 -1.582 1.00 0.00 C ATOM 0 H LEU A 416 -3.685 -4.025 -4.454 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.140 -2.220 -2.981 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.894 -4.788 -4.138 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.590 -3.847 -4.835 1.00 0.00 H new ATOM 0 HG LEU A 416 0.320 -4.878 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 416 0.857 -3.008 -1.413 1.00 0.00 H new ATOM 0 HD12 LEU A 416 0.934 -2.520 -3.123 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -0.467 -2.057 -2.128 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.709 -4.768 -0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -2.096 -3.890 -1.376 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -1.774 -5.570 -1.868 1.00 0.00 H new ATOM 705 N THR A 417 -1.693 -1.998 -6.260 1.00 0.00 N ATOM 706 CA THR A 417 -1.233 -1.111 -7.321 1.00 0.00 C ATOM 707 C THR A 417 -1.996 0.209 -7.288 1.00 0.00 C ATOM 708 O THR A 417 -1.403 1.282 -7.392 1.00 0.00 O ATOM 709 CB THR A 417 -1.404 -1.780 -8.686 1.00 0.00 C ATOM 710 OG1 THR A 417 -2.594 -2.547 -8.721 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.256 -2.694 -9.052 1.00 0.00 C ATOM 0 H THR A 417 -2.050 -2.896 -6.587 1.00 0.00 H new ATOM 0 HA THR A 417 -0.175 -0.905 -7.158 1.00 0.00 H new ATOM 0 HB THR A 417 -1.439 -0.963 -9.407 1.00 0.00 H new ATOM 0 HG1 THR A 417 -3.274 -2.122 -8.158 1.00 0.00 H new ATOM 0 HG21 THR A 417 -0.441 -3.136 -10.031 1.00 0.00 H new ATOM 0 HG22 THR A 417 0.670 -2.121 -9.081 1.00 0.00 H new ATOM 0 HG23 THR A 417 -0.169 -3.485 -8.307 1.00 0.00 H new ATOM 719 N LYS A 418 -3.315 0.120 -7.136 1.00 0.00 N ATOM 720 CA LYS A 418 -4.157 1.309 -7.084 1.00 0.00 C ATOM 721 C LYS A 418 -3.724 2.226 -5.944 1.00 0.00 C ATOM 722 O LYS A 418 -3.600 3.439 -6.121 1.00 0.00 O ATOM 723 CB LYS A 418 -5.625 0.913 -6.907 1.00 0.00 C ATOM 724 CG LYS A 418 -6.379 0.776 -8.218 1.00 0.00 C ATOM 725 CD LYS A 418 -6.979 2.101 -8.656 1.00 0.00 C ATOM 726 CE LYS A 418 -7.430 2.056 -10.109 1.00 0.00 C ATOM 727 NZ LYS A 418 -7.852 3.396 -10.600 1.00 0.00 N ATOM 0 H LYS A 418 -3.821 -0.761 -7.047 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.046 1.848 -8.025 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -5.675 -0.033 -6.368 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.122 1.660 -6.288 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -5.704 0.408 -8.991 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -7.171 0.035 -8.108 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -7.828 2.346 -8.018 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -6.244 2.895 -8.527 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -6.617 1.681 -10.730 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -8.258 1.355 -10.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -8.152 3.323 -11.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -8.645 3.743 -10.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -7.054 4.059 -10.527 1.00 0.00 H new ATOM 741 N GLU A 419 -3.487 1.637 -4.777 1.00 0.00 N ATOM 742 CA GLU A 419 -3.061 2.397 -3.608 1.00 0.00 C ATOM 743 C GLU A 419 -1.741 3.108 -3.879 1.00 0.00 C ATOM 744 O GLU A 419 -1.582 4.288 -3.564 1.00 0.00 O ATOM 745 CB GLU A 419 -2.918 1.474 -2.397 1.00 0.00 C ATOM 746 CG GLU A 419 -4.237 1.168 -1.706 1.00 0.00 C ATOM 747 CD GLU A 419 -5.004 2.423 -1.329 1.00 0.00 C ATOM 748 OE1 GLU A 419 -4.480 3.217 -0.521 1.00 0.00 O ATOM 749 OE2 GLU A 419 -6.126 2.609 -1.842 1.00 0.00 O ATOM 0 H GLU A 419 -3.583 0.634 -4.616 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.822 3.147 -3.394 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -2.459 0.538 -2.716 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -2.239 1.933 -1.679 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -4.853 0.554 -2.363 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -4.045 0.581 -0.808 1.00 0.00 H new ATOM 756 N LEU A 420 -0.796 2.385 -4.472 1.00 0.00 N ATOM 757 CA LEU A 420 0.511 2.949 -4.791 1.00 0.00 C ATOM 758 C LEU A 420 0.365 4.168 -5.695 1.00 0.00 C ATOM 759 O LEU A 420 0.946 5.223 -5.435 1.00 0.00 O ATOM 760 CB LEU A 420 1.393 1.899 -5.468 1.00 0.00 C ATOM 761 CG LEU A 420 2.883 1.989 -5.128 1.00 0.00 C ATOM 762 CD1 LEU A 420 3.656 0.879 -5.822 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.435 3.351 -5.516 1.00 0.00 C ATOM 0 H LEU A 420 -0.911 1.408 -4.741 1.00 0.00 H new ATOM 0 HA LEU A 420 0.984 3.261 -3.860 1.00 0.00 H new ATOM 0 HB2 LEU A 420 1.032 0.909 -5.190 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.276 1.990 -6.548 1.00 0.00 H new ATOM 0 HG LEU A 420 3.000 1.865 -4.051 1.00 0.00 H new ATOM 0 HD11 LEU A 420 4.713 0.959 -5.569 1.00 0.00 H new ATOM 0 HD12 LEU A 420 3.276 -0.089 -5.494 1.00 0.00 H new ATOM 0 HD13 LEU A 420 3.533 0.970 -6.901 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.495 3.398 -5.267 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.306 3.504 -6.588 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.900 4.129 -4.972 1.00 0.00 H new ATOM 775 N LEU A 421 -0.422 4.018 -6.758 1.00 0.00 N ATOM 776 CA LEU A 421 -0.650 5.108 -7.699 1.00 0.00 C ATOM 777 C LEU A 421 -1.250 6.317 -6.988 1.00 0.00 C ATOM 778 O LEU A 421 -0.833 7.453 -7.215 1.00 0.00 O ATOM 779 CB LEU A 421 -1.578 4.652 -8.826 1.00 0.00 C ATOM 780 CG LEU A 421 -1.337 5.330 -10.177 1.00 0.00 C ATOM 781 CD1 LEU A 421 -0.236 4.614 -10.945 1.00 0.00 C ATOM 782 CD2 LEU A 421 -2.621 5.363 -10.991 1.00 0.00 C ATOM 0 H LEU A 421 -0.911 3.153 -6.988 1.00 0.00 H new ATOM 0 HA LEU A 421 0.311 5.396 -8.126 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -1.469 3.575 -8.953 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -2.609 4.835 -8.524 1.00 0.00 H new ATOM 0 HG LEU A 421 -1.017 6.356 -9.996 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -0.079 5.110 -11.903 1.00 0.00 H new ATOM 0 HD12 LEU A 421 0.687 4.641 -10.367 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -0.527 3.578 -11.117 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -2.432 5.848 -11.949 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -2.969 4.344 -11.163 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -3.383 5.920 -10.446 1.00 0.00 H new ATOM 794 N GLU A 422 -2.226 6.062 -6.123 1.00 0.00 N ATOM 795 CA GLU A 422 -2.881 7.128 -5.373 1.00 0.00 C ATOM 796 C GLU A 422 -1.913 7.765 -4.380 1.00 0.00 C ATOM 797 O GLU A 422 -2.038 8.942 -4.044 1.00 0.00 O ATOM 798 CB GLU A 422 -4.105 6.584 -4.634 1.00 0.00 C ATOM 799 CG GLU A 422 -5.390 6.666 -5.443 1.00 0.00 C ATOM 800 CD GLU A 422 -6.575 7.109 -4.608 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.371 7.883 -3.651 1.00 0.00 O ATOM 802 OE2 GLU A 422 -7.708 6.680 -4.912 1.00 0.00 O ATOM 0 H GLU A 422 -2.581 5.127 -5.924 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.204 7.892 -6.080 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.922 5.544 -4.362 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.234 7.139 -3.705 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -5.251 7.363 -6.269 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.603 5.691 -5.881 1.00 0.00 H new ATOM 809 N LEU A 423 -0.948 6.977 -3.915 1.00 0.00 N ATOM 810 CA LEU A 423 0.045 7.462 -2.961 1.00 0.00 C ATOM 811 C LEU A 423 1.030 8.408 -3.638 1.00 0.00 C ATOM 812 O LEU A 423 1.411 9.433 -3.072 1.00 0.00 O ATOM 813 CB LEU A 423 0.795 6.284 -2.336 1.00 0.00 C ATOM 814 CG LEU A 423 1.942 6.664 -1.397 1.00 0.00 C ATOM 815 CD1 LEU A 423 1.411 7.000 -0.013 1.00 0.00 C ATOM 816 CD2 LEU A 423 2.962 5.538 -1.324 1.00 0.00 C ATOM 0 H LEU A 423 -0.832 6.000 -4.183 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.475 8.011 -2.176 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.082 5.673 -1.783 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.194 5.662 -3.137 1.00 0.00 H new ATOM 0 HG LEU A 423 2.436 7.550 -1.795 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.242 7.268 0.640 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.719 7.839 -0.083 1.00 0.00 H new ATOM 0 HD13 LEU A 423 0.891 6.134 0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 423 3.772 5.823 -0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 423 2.481 4.635 -0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 423 3.366 5.348 -2.318 1.00 0.00 H new ATOM 828 N ASP A 424 1.443 8.055 -4.850 1.00 0.00 N ATOM 829 CA ASP A 424 2.388 8.870 -5.607 1.00 0.00 C ATOM 830 C ASP A 424 1.788 10.230 -5.970 1.00 0.00 C ATOM 831 O ASP A 424 2.507 11.143 -6.375 1.00 0.00 O ATOM 832 CB ASP A 424 2.818 8.137 -6.879 1.00 0.00 C ATOM 833 CG ASP A 424 3.422 6.777 -6.586 1.00 0.00 C ATOM 834 OD1 ASP A 424 3.211 6.260 -5.469 1.00 0.00 O ATOM 835 OD2 ASP A 424 4.106 6.229 -7.476 1.00 0.00 O ATOM 0 H ASP A 424 1.138 7.209 -5.331 1.00 0.00 H new ATOM 0 HA ASP A 424 3.259 9.041 -4.975 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.955 8.015 -7.534 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.544 8.746 -7.418 1.00 0.00 H new ATOM 840 N SER A 425 0.471 10.359 -5.828 1.00 0.00 N ATOM 841 CA SER A 425 -0.212 11.608 -6.148 1.00 0.00 C ATOM 842 C SER A 425 0.092 12.693 -5.115 1.00 0.00 C ATOM 843 O SER A 425 -0.128 13.877 -5.369 1.00 0.00 O ATOM 844 CB SER A 425 -1.722 11.378 -6.231 1.00 0.00 C ATOM 845 OG SER A 425 -2.121 11.078 -7.557 1.00 0.00 O ATOM 0 H SER A 425 -0.142 9.616 -5.494 1.00 0.00 H new ATOM 0 HA SER A 425 0.156 11.949 -7.115 1.00 0.00 H new ATOM 0 HB2 SER A 425 -2.005 10.560 -5.569 1.00 0.00 H new ATOM 0 HB3 SER A 425 -2.248 12.267 -5.882 1.00 0.00 H new ATOM 0 HG SER A 425 -3.090 10.934 -7.582 1.00 0.00 H new ATOM 851 N VAL A 426 0.595 12.286 -3.951 1.00 0.00 N ATOM 852 CA VAL A 426 0.921 13.234 -2.890 1.00 0.00 C ATOM 853 C VAL A 426 1.866 14.325 -3.394 1.00 0.00 C ATOM 854 O VAL A 426 2.603 14.124 -4.360 1.00 0.00 O ATOM 855 CB VAL A 426 1.563 12.527 -1.678 1.00 0.00 C ATOM 856 CG1 VAL A 426 2.890 11.890 -2.062 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.741 13.501 -0.524 1.00 0.00 C ATOM 0 H VAL A 426 0.785 11.311 -3.720 1.00 0.00 H new ATOM 0 HA VAL A 426 -0.018 13.690 -2.576 1.00 0.00 H new ATOM 0 HB VAL A 426 0.893 11.732 -1.352 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.323 11.398 -1.191 1.00 0.00 H new ATOM 0 HG12 VAL A 426 2.726 11.155 -2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.573 12.660 -2.420 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.195 12.984 0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.386 14.322 -0.837 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.769 13.896 -0.228 1.00 0.00 H new ATOM 867 N GLU A 427 1.834 15.479 -2.736 1.00 0.00 N ATOM 868 CA GLU A 427 2.682 16.602 -3.121 1.00 0.00 C ATOM 869 C GLU A 427 4.156 16.291 -2.873 1.00 0.00 C ATOM 870 O GLU A 427 4.931 16.141 -3.817 1.00 0.00 O ATOM 871 CB GLU A 427 2.276 17.861 -2.348 1.00 0.00 C ATOM 872 CG GLU A 427 1.337 18.772 -3.121 1.00 0.00 C ATOM 873 CD GLU A 427 0.093 18.053 -3.605 1.00 0.00 C ATOM 874 OE1 GLU A 427 0.234 17.017 -4.289 1.00 0.00 O ATOM 875 OE2 GLU A 427 -1.022 18.524 -3.300 1.00 0.00 O ATOM 0 H GLU A 427 1.231 15.661 -1.934 1.00 0.00 H new ATOM 0 HA GLU A 427 2.545 16.776 -4.188 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.796 17.566 -1.415 1.00 0.00 H new ATOM 0 HB3 GLU A 427 3.174 18.419 -2.082 1.00 0.00 H new ATOM 0 HG2 GLU A 427 1.045 19.609 -2.486 1.00 0.00 H new ATOM 0 HG3 GLU A 427 1.866 19.191 -3.977 1.00 0.00 H new ATOM 882 N THR A 428 4.532 16.203 -1.599 1.00 0.00 N ATOM 883 CA THR A 428 5.915 15.915 -1.217 1.00 0.00 C ATOM 884 C THR A 428 6.902 16.744 -2.035 1.00 0.00 C ATOM 885 O THR A 428 7.934 16.240 -2.481 1.00 0.00 O ATOM 886 CB THR A 428 6.220 14.423 -1.381 1.00 0.00 C ATOM 887 OG1 THR A 428 7.528 14.127 -0.927 1.00 0.00 O ATOM 888 CG2 THR A 428 6.113 13.940 -2.812 1.00 0.00 C ATOM 0 H THR A 428 3.897 16.327 -0.811 1.00 0.00 H new ATOM 0 HA THR A 428 6.030 16.187 -0.168 1.00 0.00 H new ATOM 0 HB THR A 428 5.466 13.909 -0.785 1.00 0.00 H new ATOM 0 HG1 THR A 428 7.704 13.169 -1.039 1.00 0.00 H new ATOM 0 HG21 THR A 428 6.342 12.875 -2.855 1.00 0.00 H new ATOM 0 HG22 THR A 428 5.100 14.108 -3.178 1.00 0.00 H new ATOM 0 HG23 THR A 428 6.820 14.488 -3.435 1.00 0.00 H new ATOM 896 N GLY A 429 6.578 18.017 -2.230 1.00 0.00 N ATOM 897 CA GLY A 429 7.443 18.896 -2.994 1.00 0.00 C ATOM 898 C GLY A 429 8.183 19.888 -2.117 1.00 0.00 C ATOM 899 O GLY A 429 8.523 20.984 -2.560 1.00 0.00 O ATOM 0 H GLY A 429 5.730 18.457 -1.872 1.00 0.00 H new ATOM 0 HA2 GLY A 429 8.165 18.297 -3.549 1.00 0.00 H new ATOM 0 HA3 GLY A 429 6.847 19.439 -3.728 1.00 0.00 H new ATOM 903 N GLY A 430 8.433 19.499 -0.872 1.00 0.00 N ATOM 904 CA GLY A 430 9.135 20.373 0.050 1.00 0.00 C ATOM 905 C GLY A 430 8.553 20.328 1.450 1.00 0.00 C ATOM 906 O GLY A 430 8.378 21.364 2.090 1.00 0.00 O ATOM 0 H GLY A 430 8.163 18.595 -0.485 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.186 20.087 0.088 1.00 0.00 H new ATOM 0 HA3 GLY A 430 9.096 21.396 -0.323 1.00 0.00 H new ATOM 910 N GLN A 431 8.253 19.124 1.924 1.00 0.00 N ATOM 911 CA GLN A 431 7.687 18.947 3.257 1.00 0.00 C ATOM 912 C GLN A 431 8.314 17.745 3.958 1.00 0.00 C ATOM 913 O GLN A 431 8.224 16.616 3.476 1.00 0.00 O ATOM 914 CB GLN A 431 6.170 18.770 3.170 1.00 0.00 C ATOM 915 CG GLN A 431 5.402 19.609 4.178 1.00 0.00 C ATOM 916 CD GLN A 431 5.576 19.114 5.600 1.00 0.00 C ATOM 917 OE1 GLN A 431 6.694 18.867 6.052 1.00 0.00 O ATOM 918 NE2 GLN A 431 4.467 18.965 6.316 1.00 0.00 N ATOM 0 H GLN A 431 8.392 18.256 1.406 1.00 0.00 H new ATOM 0 HA GLN A 431 7.907 19.840 3.841 1.00 0.00 H new ATOM 0 HB2 GLN A 431 5.839 19.031 2.165 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.926 17.719 3.323 1.00 0.00 H new ATOM 0 HG2 GLN A 431 5.737 20.644 4.114 1.00 0.00 H new ATOM 0 HG3 GLN A 431 4.343 19.600 3.921 1.00 0.00 H new ATOM 0 HE21 GLN A 431 3.560 19.181 5.902 1.00 0.00 H new ATOM 0 HE22 GLN A 431 4.522 18.634 7.279 1.00 0.00 H new ATOM 927 N ASP A 432 8.950 17.996 5.097 1.00 0.00 N ATOM 928 CA ASP A 432 9.592 16.934 5.864 1.00 0.00 C ATOM 929 C ASP A 432 8.587 15.855 6.250 1.00 0.00 C ATOM 930 O ASP A 432 8.901 14.664 6.229 1.00 0.00 O ATOM 931 CB ASP A 432 10.248 17.511 7.121 1.00 0.00 C ATOM 932 CG ASP A 432 11.046 16.471 7.884 1.00 0.00 C ATOM 933 OD1 ASP A 432 10.430 15.666 8.613 1.00 0.00 O ATOM 934 OD2 ASP A 432 12.288 16.462 7.752 1.00 0.00 O ATOM 0 H ASP A 432 9.035 18.925 5.510 1.00 0.00 H new ATOM 0 HA ASP A 432 10.359 16.480 5.237 1.00 0.00 H new ATOM 0 HB2 ASP A 432 10.904 18.335 6.840 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.478 17.925 7.772 1.00 0.00 H new ATOM 939 N SER A 433 7.378 16.277 6.603 1.00 0.00 N ATOM 940 CA SER A 433 6.327 15.345 6.994 1.00 0.00 C ATOM 941 C SER A 433 5.981 14.402 5.846 1.00 0.00 C ATOM 942 O SER A 433 6.108 13.184 5.968 1.00 0.00 O ATOM 943 CB SER A 433 5.077 16.109 7.436 1.00 0.00 C ATOM 944 OG SER A 433 4.248 15.302 8.254 1.00 0.00 O ATOM 0 H SER A 433 7.101 17.259 6.626 1.00 0.00 H new ATOM 0 HA SER A 433 6.696 14.751 7.830 1.00 0.00 H new ATOM 0 HB2 SER A 433 5.369 17.006 7.982 1.00 0.00 H new ATOM 0 HB3 SER A 433 4.519 16.437 6.559 1.00 0.00 H new ATOM 0 HG SER A 433 3.457 15.814 8.524 1.00 0.00 H new ATOM 950 N VAL A 434 5.543 14.975 4.729 1.00 0.00 N ATOM 951 CA VAL A 434 5.179 14.188 3.558 1.00 0.00 C ATOM 952 C VAL A 434 6.347 13.328 3.089 1.00 0.00 C ATOM 953 O VAL A 434 6.160 12.184 2.677 1.00 0.00 O ATOM 954 CB VAL A 434 4.717 15.084 2.396 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.169 14.241 1.257 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.676 16.085 2.873 1.00 0.00 C ATOM 0 H VAL A 434 5.432 15.982 4.611 1.00 0.00 H new ATOM 0 HA VAL A 434 4.353 13.543 3.857 1.00 0.00 H new ATOM 0 HB VAL A 434 5.579 15.639 2.026 1.00 0.00 H new ATOM 0 HG11 VAL A 434 3.847 14.892 0.444 1.00 0.00 H new ATOM 0 HG12 VAL A 434 4.946 13.568 0.896 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.320 13.657 1.612 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.362 16.710 2.037 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.813 15.551 3.271 1.00 0.00 H new ATOM 0 HG23 VAL A 434 4.106 16.713 3.653 1.00 0.00 H new ATOM 966 N ARG A 435 7.552 13.884 3.157 1.00 0.00 N ATOM 967 CA ARG A 435 8.750 13.163 2.742 1.00 0.00 C ATOM 968 C ARG A 435 8.912 11.882 3.553 1.00 0.00 C ATOM 969 O ARG A 435 9.057 10.793 2.995 1.00 0.00 O ATOM 970 CB ARG A 435 9.988 14.047 2.899 1.00 0.00 C ATOM 971 CG ARG A 435 10.418 14.725 1.609 1.00 0.00 C ATOM 972 CD ARG A 435 9.352 15.680 1.097 1.00 0.00 C ATOM 973 NE ARG A 435 9.465 15.906 -0.342 1.00 0.00 N ATOM 974 CZ ARG A 435 10.434 16.624 -0.905 1.00 0.00 C ATOM 975 NH1 ARG A 435 11.374 17.187 -0.156 1.00 0.00 N ATOM 976 NH2 ARG A 435 10.463 16.780 -2.222 1.00 0.00 N ATOM 0 H ARG A 435 7.725 14.831 3.495 1.00 0.00 H new ATOM 0 HA ARG A 435 8.642 12.897 1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.787 14.810 3.651 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.813 13.440 3.273 1.00 0.00 H new ATOM 0 HG2 ARG A 435 11.347 15.271 1.776 1.00 0.00 H new ATOM 0 HG3 ARG A 435 10.625 13.969 0.851 1.00 0.00 H new ATOM 0 HD2 ARG A 435 8.365 15.277 1.324 1.00 0.00 H new ATOM 0 HD3 ARG A 435 9.436 16.632 1.621 1.00 0.00 H new ATOM 0 HE ARG A 435 8.760 15.489 -0.951 1.00 0.00 H new ATOM 0 HH11 ARG A 435 11.356 17.071 0.857 1.00 0.00 H new ATOM 0 HH12 ARG A 435 12.114 17.736 -0.594 1.00 0.00 H new ATOM 0 HH21 ARG A 435 9.743 16.350 -2.802 1.00 0.00 H new ATOM 0 HH22 ARG A 435 11.205 17.330 -2.654 1.00 0.00 H new ATOM 990 N GLN A 436 8.877 12.019 4.876 1.00 0.00 N ATOM 991 CA GLN A 436 9.010 10.870 5.765 1.00 0.00 C ATOM 992 C GLN A 436 7.929 9.838 5.462 1.00 0.00 C ATOM 993 O GLN A 436 8.215 8.650 5.311 1.00 0.00 O ATOM 994 CB GLN A 436 8.918 11.312 7.226 1.00 0.00 C ATOM 995 CG GLN A 436 9.148 10.184 8.219 1.00 0.00 C ATOM 996 CD GLN A 436 9.478 10.691 9.610 1.00 0.00 C ATOM 997 OE1 GLN A 436 8.611 10.752 10.481 1.00 0.00 O ATOM 998 NE2 GLN A 436 10.735 11.057 9.824 1.00 0.00 N ATOM 0 H GLN A 436 8.758 12.912 5.354 1.00 0.00 H new ATOM 0 HA GLN A 436 9.987 10.416 5.598 1.00 0.00 H new ATOM 0 HB2 GLN A 436 9.651 12.098 7.406 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.934 11.747 7.404 1.00 0.00 H new ATOM 0 HG2 GLN A 436 8.256 9.559 8.266 1.00 0.00 H new ATOM 0 HG3 GLN A 436 9.962 9.552 7.864 1.00 0.00 H new ATOM 0 HE21 GLN A 436 11.421 10.989 9.072 1.00 0.00 H new ATOM 0 HE22 GLN A 436 11.016 11.406 10.740 1.00 0.00 H new ATOM 1007 N ALA A 437 6.688 10.304 5.366 1.00 0.00 N ATOM 1008 CA ALA A 437 5.564 9.427 5.070 1.00 0.00 C ATOM 1009 C ALA A 437 5.711 8.819 3.681 1.00 0.00 C ATOM 1010 O ALA A 437 5.324 7.673 3.448 1.00 0.00 O ATOM 1011 CB ALA A 437 4.253 10.190 5.182 1.00 0.00 C ATOM 0 H ALA A 437 6.437 11.285 5.489 1.00 0.00 H new ATOM 0 HA ALA A 437 5.557 8.617 5.799 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.422 9.521 4.958 1.00 0.00 H new ATOM 0 HB2 ALA A 437 4.143 10.578 6.195 1.00 0.00 H new ATOM 0 HB3 ALA A 437 4.253 11.019 4.474 1.00 0.00 H new ATOM 1017 N ARG A 438 6.281 9.592 2.761 1.00 0.00 N ATOM 1018 CA ARG A 438 6.489 9.130 1.395 1.00 0.00 C ATOM 1019 C ARG A 438 7.383 7.896 1.381 1.00 0.00 C ATOM 1020 O ARG A 438 7.010 6.851 0.847 1.00 0.00 O ATOM 1021 CB ARG A 438 7.113 10.240 0.545 1.00 0.00 C ATOM 1022 CG ARG A 438 7.421 9.818 -0.883 1.00 0.00 C ATOM 1023 CD ARG A 438 6.188 9.272 -1.584 1.00 0.00 C ATOM 1024 NE ARG A 438 6.254 9.459 -3.032 1.00 0.00 N ATOM 1025 CZ ARG A 438 5.505 8.783 -3.901 1.00 0.00 C ATOM 1026 NH1 ARG A 438 4.635 7.877 -3.474 1.00 0.00 N ATOM 1027 NH2 ARG A 438 5.628 9.014 -5.201 1.00 0.00 N ATOM 0 H ARG A 438 6.607 10.542 2.938 1.00 0.00 H new ATOM 0 HA ARG A 438 5.520 8.866 0.970 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.435 11.093 0.524 1.00 0.00 H new ATOM 0 HB3 ARG A 438 8.034 10.576 1.022 1.00 0.00 H new ATOM 0 HG2 ARG A 438 7.809 10.671 -1.440 1.00 0.00 H new ATOM 0 HG3 ARG A 438 8.203 9.059 -0.878 1.00 0.00 H new ATOM 0 HD2 ARG A 438 6.084 8.210 -1.360 1.00 0.00 H new ATOM 0 HD3 ARG A 438 5.299 9.769 -1.194 1.00 0.00 H new ATOM 0 HE ARG A 438 6.912 10.147 -3.398 1.00 0.00 H new ATOM 0 HH11 ARG A 438 4.537 7.695 -2.475 1.00 0.00 H new ATOM 0 HH12 ARG A 438 4.064 7.362 -4.145 1.00 0.00 H new ATOM 0 HH21 ARG A 438 6.296 9.709 -5.535 1.00 0.00 H new ATOM 0 HH22 ARG A 438 5.055 8.497 -5.867 1.00 0.00 H new ATOM 1041 N LYS A 439 8.563 8.020 1.982 1.00 0.00 N ATOM 1042 CA LYS A 439 9.505 6.910 2.048 1.00 0.00 C ATOM 1043 C LYS A 439 8.880 5.731 2.788 1.00 0.00 C ATOM 1044 O LYS A 439 8.954 4.588 2.335 1.00 0.00 O ATOM 1045 CB LYS A 439 10.795 7.344 2.747 1.00 0.00 C ATOM 1046 CG LYS A 439 11.857 7.863 1.793 1.00 0.00 C ATOM 1047 CD LYS A 439 12.950 8.616 2.533 1.00 0.00 C ATOM 1048 CE LYS A 439 12.742 10.120 2.452 1.00 0.00 C ATOM 1049 NZ LYS A 439 12.941 10.634 1.069 1.00 0.00 N ATOM 0 H LYS A 439 8.888 8.877 2.429 1.00 0.00 H new ATOM 0 HA LYS A 439 9.746 6.601 1.031 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.561 8.121 3.475 1.00 0.00 H new ATOM 0 HB3 LYS A 439 11.200 6.498 3.303 1.00 0.00 H new ATOM 0 HG2 LYS A 439 12.295 7.028 1.246 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.396 8.520 1.056 1.00 0.00 H new ATOM 0 HD2 LYS A 439 12.964 8.305 3.578 1.00 0.00 H new ATOM 0 HD3 LYS A 439 13.921 8.358 2.110 1.00 0.00 H new ATOM 0 HE2 LYS A 439 11.735 10.366 2.789 1.00 0.00 H new ATOM 0 HE3 LYS A 439 13.436 10.619 3.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 13.194 11.642 1.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 13.706 10.102 0.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 12.062 10.518 0.526 1.00 0.00 H new ATOM 1063 N GLU A 440 8.259 6.022 3.927 1.00 0.00 N ATOM 1064 CA GLU A 440 7.611 4.992 4.728 1.00 0.00 C ATOM 1065 C GLU A 440 6.521 4.297 3.919 1.00 0.00 C ATOM 1066 O GLU A 440 6.374 3.075 3.974 1.00 0.00 O ATOM 1067 CB GLU A 440 7.015 5.604 5.998 1.00 0.00 C ATOM 1068 CG GLU A 440 6.313 4.594 6.893 1.00 0.00 C ATOM 1069 CD GLU A 440 5.154 5.201 7.657 1.00 0.00 C ATOM 1070 OE1 GLU A 440 5.401 6.076 8.515 1.00 0.00 O ATOM 1071 OE2 GLU A 440 3.999 4.803 7.400 1.00 0.00 O ATOM 0 H GLU A 440 8.191 6.963 4.315 1.00 0.00 H new ATOM 0 HA GLU A 440 8.360 4.253 5.013 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.810 6.088 6.565 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.305 6.382 5.717 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.949 3.766 6.285 1.00 0.00 H new ATOM 0 HG3 GLU A 440 7.032 4.179 7.599 1.00 0.00 H new ATOM 1078 N ALA A 441 5.762 5.086 3.164 1.00 0.00 N ATOM 1079 CA ALA A 441 4.690 4.549 2.335 1.00 0.00 C ATOM 1080 C ALA A 441 5.250 3.613 1.272 1.00 0.00 C ATOM 1081 O ALA A 441 4.692 2.548 1.012 1.00 0.00 O ATOM 1082 CB ALA A 441 3.903 5.679 1.690 1.00 0.00 C ATOM 0 H ALA A 441 5.870 6.099 3.110 1.00 0.00 H new ATOM 0 HA ALA A 441 4.016 3.977 2.972 1.00 0.00 H new ATOM 0 HB1 ALA A 441 3.106 5.262 1.074 1.00 0.00 H new ATOM 0 HB2 ALA A 441 3.470 6.310 2.466 1.00 0.00 H new ATOM 0 HB3 ALA A 441 4.568 6.276 1.067 1.00 0.00 H new ATOM 1088 N VAL A 442 6.363 4.017 0.663 1.00 0.00 N ATOM 1089 CA VAL A 442 7.004 3.212 -0.368 1.00 0.00 C ATOM 1090 C VAL A 442 7.488 1.885 0.208 1.00 0.00 C ATOM 1091 O VAL A 442 7.356 0.835 -0.422 1.00 0.00 O ATOM 1092 CB VAL A 442 8.199 3.952 -1.000 1.00 0.00 C ATOM 1093 CG1 VAL A 442 8.745 3.172 -2.185 1.00 0.00 C ATOM 1094 CG2 VAL A 442 7.796 5.360 -1.417 1.00 0.00 C ATOM 0 H VAL A 442 6.837 4.897 0.867 1.00 0.00 H new ATOM 0 HA VAL A 442 6.258 3.026 -1.140 1.00 0.00 H new ATOM 0 HB VAL A 442 8.989 4.032 -0.253 1.00 0.00 H new ATOM 0 HG11 VAL A 442 9.588 3.711 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 442 9.075 2.188 -1.852 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.964 3.057 -2.936 1.00 0.00 H new ATOM 0 HG21 VAL A 442 8.653 5.867 -1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 442 6.988 5.306 -2.146 1.00 0.00 H new ATOM 0 HG23 VAL A 442 7.459 5.916 -0.542 1.00 0.00 H new ATOM 1104 N CYS A 443 8.043 1.941 1.414 1.00 0.00 N ATOM 1105 CA CYS A 443 8.537 0.742 2.079 1.00 0.00 C ATOM 1106 C CYS A 443 7.388 -0.215 2.370 1.00 0.00 C ATOM 1107 O CYS A 443 7.493 -1.418 2.132 1.00 0.00 O ATOM 1108 CB CYS A 443 9.253 1.112 3.380 1.00 0.00 C ATOM 1109 SG CYS A 443 11.029 1.394 3.192 1.00 0.00 S ATOM 0 H CYS A 443 8.162 2.801 1.949 1.00 0.00 H new ATOM 0 HA CYS A 443 9.246 0.247 1.416 1.00 0.00 H new ATOM 0 HB2 CYS A 443 8.795 2.012 3.791 1.00 0.00 H new ATOM 0 HB3 CYS A 443 9.098 0.315 4.107 1.00 0.00 H new ATOM 0 HG CYS A 443 11.544 1.703 4.345 1.00 0.00 H new ATOM 1115 N LYS A 444 6.289 0.332 2.881 1.00 0.00 N ATOM 1116 CA LYS A 444 5.110 -0.463 3.203 1.00 0.00 C ATOM 1117 C LYS A 444 4.525 -1.104 1.950 1.00 0.00 C ATOM 1118 O LYS A 444 4.445 -2.328 1.850 1.00 0.00 O ATOM 1119 CB LYS A 444 4.054 0.408 3.886 1.00 0.00 C ATOM 1120 CG LYS A 444 4.437 0.841 5.292 1.00 0.00 C ATOM 1121 CD LYS A 444 4.529 -0.350 6.234 1.00 0.00 C ATOM 1122 CE LYS A 444 4.492 0.088 7.688 1.00 0.00 C ATOM 1123 NZ LYS A 444 3.734 -0.871 8.538 1.00 0.00 N ATOM 0 H LYS A 444 6.191 1.327 3.081 1.00 0.00 H new ATOM 0 HA LYS A 444 5.414 -1.257 3.885 1.00 0.00 H new ATOM 0 HB2 LYS A 444 3.878 1.295 3.277 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.114 -0.142 3.928 1.00 0.00 H new ATOM 0 HG2 LYS A 444 5.395 1.361 5.266 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.700 1.549 5.670 1.00 0.00 H new ATOM 0 HD2 LYS A 444 3.704 -1.035 6.038 1.00 0.00 H new ATOM 0 HD3 LYS A 444 5.451 -0.898 6.041 1.00 0.00 H new ATOM 0 HE2 LYS A 444 5.510 0.181 8.065 1.00 0.00 H new ATOM 0 HE3 LYS A 444 4.035 1.075 7.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 3.732 -0.536 9.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 2.755 -0.941 8.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 4.185 -1.807 8.492 1.00 0.00 H new ATOM 1137 N ILE A 445 4.114 -0.272 0.992 1.00 0.00 N ATOM 1138 CA ILE A 445 3.540 -0.775 -0.253 1.00 0.00 C ATOM 1139 C ILE A 445 4.429 -1.852 -0.865 1.00 0.00 C ATOM 1140 O ILE A 445 3.954 -2.930 -1.225 1.00 0.00 O ATOM 1141 CB ILE A 445 3.323 0.355 -1.283 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.590 1.198 -1.434 1.00 0.00 C ATOM 1143 CG2 ILE A 445 2.146 1.225 -0.873 1.00 0.00 C ATOM 1144 CD1 ILE A 445 5.419 0.833 -2.646 1.00 0.00 C ATOM 0 H ILE A 445 4.168 0.745 1.055 1.00 0.00 H new ATOM 0 HA ILE A 445 2.570 -1.204 -0.002 1.00 0.00 H new ATOM 0 HB ILE A 445 3.099 -0.097 -2.249 1.00 0.00 H new ATOM 0 HG12 ILE A 445 4.311 2.250 -1.498 1.00 0.00 H new ATOM 0 HG13 ILE A 445 5.201 1.084 -0.539 1.00 0.00 H new ATOM 0 HG21 ILE A 445 2.005 2.017 -1.609 1.00 0.00 H new ATOM 0 HG22 ILE A 445 1.244 0.615 -0.819 1.00 0.00 H new ATOM 0 HG23 ILE A 445 2.343 1.668 0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 445 6.301 1.471 -2.689 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.729 -0.210 -2.574 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.825 0.974 -3.549 1.00 0.00 H new ATOM 1156 N GLN A 446 5.723 -1.565 -0.959 1.00 0.00 N ATOM 1157 CA GLN A 446 6.673 -2.524 -1.505 1.00 0.00 C ATOM 1158 C GLN A 446 6.797 -3.717 -0.566 1.00 0.00 C ATOM 1159 O GLN A 446 6.972 -4.856 -1.003 1.00 0.00 O ATOM 1160 CB GLN A 446 8.040 -1.868 -1.707 1.00 0.00 C ATOM 1161 CG GLN A 446 8.830 -2.453 -2.867 1.00 0.00 C ATOM 1162 CD GLN A 446 8.400 -1.887 -4.207 1.00 0.00 C ATOM 1163 OE1 GLN A 446 8.040 -2.629 -5.121 1.00 0.00 O ATOM 1164 NE2 GLN A 446 8.437 -0.566 -4.330 1.00 0.00 N ATOM 0 H GLN A 446 6.136 -0.680 -0.665 1.00 0.00 H new ATOM 0 HA GLN A 446 6.309 -2.867 -2.474 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.900 -0.800 -1.875 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.623 -1.973 -0.792 1.00 0.00 H new ATOM 0 HG2 GLN A 446 9.891 -2.255 -2.716 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.706 -3.536 -2.877 1.00 0.00 H new ATOM 0 HE21 GLN A 446 8.742 0.011 -3.546 1.00 0.00 H new ATOM 0 HE22 GLN A 446 8.160 -0.128 -5.208 1.00 0.00 H new ATOM 1173 N ALA A 447 6.688 -3.443 0.730 1.00 0.00 N ATOM 1174 CA ALA A 447 6.771 -4.482 1.747 1.00 0.00 C ATOM 1175 C ALA A 447 5.606 -5.455 1.609 1.00 0.00 C ATOM 1176 O ALA A 447 5.799 -6.669 1.535 1.00 0.00 O ATOM 1177 CB ALA A 447 6.783 -3.857 3.134 1.00 0.00 C ATOM 0 H ALA A 447 6.541 -2.504 1.101 1.00 0.00 H new ATOM 0 HA ALA A 447 7.699 -5.036 1.607 1.00 0.00 H new ATOM 0 HB1 ALA A 447 6.845 -4.643 3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.644 -3.196 3.228 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.868 -3.284 3.283 1.00 0.00 H new ATOM 1183 N ILE A 448 4.395 -4.909 1.566 1.00 0.00 N ATOM 1184 CA ILE A 448 3.194 -5.717 1.426 1.00 0.00 C ATOM 1185 C ILE A 448 3.202 -6.463 0.096 1.00 0.00 C ATOM 1186 O ILE A 448 2.750 -7.605 0.009 1.00 0.00 O ATOM 1187 CB ILE A 448 1.920 -4.851 1.521 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.667 -5.720 1.419 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.922 -3.783 0.438 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.620 -4.937 1.531 1.00 0.00 C ATOM 0 H ILE A 448 4.222 -3.906 1.627 1.00 0.00 H new ATOM 0 HA ILE A 448 3.188 -6.436 2.245 1.00 0.00 H new ATOM 0 HB ILE A 448 1.912 -4.357 2.492 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.679 -6.250 0.467 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.693 -6.475 2.205 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.017 -3.181 0.519 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.796 -3.143 0.560 1.00 0.00 H new ATOM 0 HG23 ILE A 448 1.955 -4.259 -0.542 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.468 -5.617 1.450 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.654 -4.428 2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.668 -4.200 0.729 1.00 0.00 H new ATOM 1202 N LEU A 449 3.727 -5.811 -0.938 1.00 0.00 N ATOM 1203 CA LEU A 449 3.803 -6.415 -2.261 1.00 0.00 C ATOM 1204 C LEU A 449 4.697 -7.649 -2.232 1.00 0.00 C ATOM 1205 O LEU A 449 4.345 -8.698 -2.770 1.00 0.00 O ATOM 1206 CB LEU A 449 4.335 -5.404 -3.281 1.00 0.00 C ATOM 1207 CG LEU A 449 3.465 -5.220 -4.525 1.00 0.00 C ATOM 1208 CD1 LEU A 449 2.326 -4.255 -4.240 1.00 0.00 C ATOM 1209 CD2 LEU A 449 4.306 -4.727 -5.694 1.00 0.00 C ATOM 0 H LEU A 449 4.105 -4.865 -0.883 1.00 0.00 H new ATOM 0 HA LEU A 449 2.799 -6.717 -2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.446 -4.438 -2.788 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.330 -5.718 -3.596 1.00 0.00 H new ATOM 0 HG LEU A 449 3.037 -6.186 -4.793 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.717 -4.136 -5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.709 -4.649 -3.432 1.00 0.00 H new ATOM 0 HD13 LEU A 449 2.734 -3.287 -3.947 1.00 0.00 H new ATOM 0 HD21 LEU A 449 3.671 -4.601 -6.571 1.00 0.00 H new ATOM 0 HD22 LEU A 449 4.762 -3.771 -5.436 1.00 0.00 H new ATOM 0 HD23 LEU A 449 5.087 -5.455 -5.913 1.00 0.00 H new ATOM 1221 N GLU A 450 5.855 -7.514 -1.593 1.00 0.00 N ATOM 1222 CA GLU A 450 6.802 -8.617 -1.485 1.00 0.00 C ATOM 1223 C GLU A 450 6.220 -9.749 -0.644 1.00 0.00 C ATOM 1224 O GLU A 450 6.401 -10.925 -0.958 1.00 0.00 O ATOM 1225 CB GLU A 450 8.115 -8.131 -0.868 1.00 0.00 C ATOM 1226 CG GLU A 450 9.196 -9.199 -0.818 1.00 0.00 C ATOM 1227 CD GLU A 450 10.489 -8.691 -0.212 1.00 0.00 C ATOM 1228 OE1 GLU A 450 11.263 -8.028 -0.933 1.00 0.00 O ATOM 1229 OE2 GLU A 450 10.728 -8.957 0.984 1.00 0.00 O ATOM 0 H GLU A 450 6.160 -6.651 -1.142 1.00 0.00 H new ATOM 0 HA GLU A 450 6.999 -8.996 -2.488 1.00 0.00 H new ATOM 0 HB2 GLU A 450 8.483 -7.280 -1.441 1.00 0.00 H new ATOM 0 HB3 GLU A 450 7.921 -7.774 0.144 1.00 0.00 H new ATOM 0 HG2 GLU A 450 8.836 -10.048 -0.237 1.00 0.00 H new ATOM 0 HG3 GLU A 450 9.390 -9.562 -1.827 1.00 0.00 H new ATOM 1236 N LYS A 451 5.522 -9.383 0.426 1.00 0.00 N ATOM 1237 CA LYS A 451 4.911 -10.366 1.316 1.00 0.00 C ATOM 1238 C LYS A 451 3.747 -11.076 0.630 1.00 0.00 C ATOM 1239 O LYS A 451 3.520 -12.267 0.846 1.00 0.00 O ATOM 1240 CB LYS A 451 4.426 -9.691 2.598 1.00 0.00 C ATOM 1241 CG LYS A 451 5.486 -9.616 3.686 1.00 0.00 C ATOM 1242 CD LYS A 451 5.282 -8.401 4.579 1.00 0.00 C ATOM 1243 CE LYS A 451 6.249 -8.403 5.751 1.00 0.00 C ATOM 1244 NZ LYS A 451 6.722 -7.030 6.081 1.00 0.00 N ATOM 0 H LYS A 451 5.365 -8.413 0.699 1.00 0.00 H new ATOM 0 HA LYS A 451 5.668 -11.109 1.568 1.00 0.00 H new ATOM 0 HB2 LYS A 451 4.088 -8.682 2.362 1.00 0.00 H new ATOM 0 HB3 LYS A 451 3.563 -10.235 2.981 1.00 0.00 H new ATOM 0 HG2 LYS A 451 5.454 -10.523 4.290 1.00 0.00 H new ATOM 0 HG3 LYS A 451 6.475 -9.572 3.230 1.00 0.00 H new ATOM 0 HD2 LYS A 451 5.419 -7.491 3.994 1.00 0.00 H new ATOM 0 HD3 LYS A 451 4.258 -8.389 4.951 1.00 0.00 H new ATOM 0 HE2 LYS A 451 5.762 -8.839 6.623 1.00 0.00 H new ATOM 0 HE3 LYS A 451 7.105 -9.035 5.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 7.380 -7.073 6.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 7.209 -6.623 5.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 5.908 -6.433 6.331 1.00 0.00 H new ATOM 1258 N LEU A 452 3.010 -10.337 -0.192 1.00 0.00 N ATOM 1259 CA LEU A 452 1.867 -10.899 -0.905 1.00 0.00 C ATOM 1260 C LEU A 452 2.326 -11.840 -2.017 1.00 0.00 C ATOM 1261 O LEU A 452 1.753 -12.912 -2.209 1.00 0.00 O ATOM 1262 CB LEU A 452 1.000 -9.773 -1.485 1.00 0.00 C ATOM 1263 CG LEU A 452 -0.076 -10.209 -2.487 1.00 0.00 C ATOM 1264 CD1 LEU A 452 0.519 -10.345 -3.878 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.733 -11.514 -2.052 1.00 0.00 C ATOM 0 H LEU A 452 3.182 -9.350 -0.381 1.00 0.00 H new ATOM 0 HA LEU A 452 1.272 -11.475 -0.197 1.00 0.00 H new ATOM 0 HB2 LEU A 452 0.513 -9.254 -0.660 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.654 -9.051 -1.974 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.847 -9.439 -2.514 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -0.258 -10.655 -4.577 1.00 0.00 H new ATOM 0 HD12 LEU A 452 0.929 -9.386 -4.194 1.00 0.00 H new ATOM 0 HD13 LEU A 452 1.313 -11.092 -3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.492 -11.800 -2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.022 -12.298 -1.988 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -1.199 -11.379 -1.076 1.00 0.00 H new ATOM 1277 N GLU A 453 3.363 -11.433 -2.742 1.00 0.00 N ATOM 1278 CA GLU A 453 3.895 -12.246 -3.831 1.00 0.00 C ATOM 1279 C GLU A 453 4.560 -13.509 -3.293 1.00 0.00 C ATOM 1280 O GLU A 453 4.366 -14.600 -3.827 1.00 0.00 O ATOM 1281 CB GLU A 453 4.897 -11.439 -4.657 1.00 0.00 C ATOM 1282 CG GLU A 453 6.113 -10.988 -3.866 1.00 0.00 C ATOM 1283 CD GLU A 453 7.068 -10.147 -4.691 1.00 0.00 C ATOM 1284 OE1 GLU A 453 6.690 -9.019 -5.070 1.00 0.00 O ATOM 1285 OE2 GLU A 453 8.193 -10.619 -4.958 1.00 0.00 O ATOM 0 H GLU A 453 3.850 -10.549 -2.596 1.00 0.00 H new ATOM 0 HA GLU A 453 3.063 -12.540 -4.471 1.00 0.00 H new ATOM 0 HB2 GLU A 453 5.227 -12.042 -5.503 1.00 0.00 H new ATOM 0 HB3 GLU A 453 4.395 -10.563 -5.067 1.00 0.00 H new ATOM 0 HG2 GLU A 453 5.785 -10.414 -2.999 1.00 0.00 H new ATOM 0 HG3 GLU A 453 6.640 -11.864 -3.487 1.00 0.00 H new ATOM 1292 N LYS A 454 5.345 -13.355 -2.231 1.00 0.00 N ATOM 1293 CA LYS A 454 6.038 -14.485 -1.623 1.00 0.00 C ATOM 1294 C LYS A 454 5.051 -15.404 -0.909 1.00 0.00 C ATOM 1295 O LYS A 454 5.209 -16.625 -0.915 1.00 0.00 O ATOM 1296 CB LYS A 454 7.101 -13.995 -0.639 1.00 0.00 C ATOM 1297 CG LYS A 454 6.534 -13.207 0.530 1.00 0.00 C ATOM 1298 CD LYS A 454 6.306 -14.096 1.744 1.00 0.00 C ATOM 1299 CE LYS A 454 7.619 -14.480 2.406 1.00 0.00 C ATOM 1300 NZ LYS A 454 7.453 -15.623 3.345 1.00 0.00 N ATOM 0 H LYS A 454 5.517 -12.459 -1.774 1.00 0.00 H new ATOM 0 HA LYS A 454 6.526 -15.049 -2.418 1.00 0.00 H new ATOM 0 HB2 LYS A 454 7.651 -14.854 -0.254 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.818 -13.371 -1.173 1.00 0.00 H new ATOM 0 HG2 LYS A 454 7.218 -12.400 0.792 1.00 0.00 H new ATOM 0 HG3 LYS A 454 5.593 -12.744 0.235 1.00 0.00 H new ATOM 0 HD2 LYS A 454 5.673 -13.577 2.463 1.00 0.00 H new ATOM 0 HD3 LYS A 454 5.772 -14.997 1.442 1.00 0.00 H new ATOM 0 HE2 LYS A 454 8.349 -14.742 1.640 1.00 0.00 H new ATOM 0 HE3 LYS A 454 8.018 -13.621 2.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 8.371 -15.854 3.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 6.776 -15.364 4.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 7.096 -16.450 2.825 1.00 0.00 H new ATOM 1314 N LYS A 455 4.033 -14.808 -0.297 1.00 0.00 N ATOM 1315 CA LYS A 455 3.021 -15.573 0.422 1.00 0.00 C ATOM 1316 C LYS A 455 2.194 -16.420 -0.543 1.00 0.00 C ATOM 1317 O LYS A 455 1.710 -17.493 -0.185 1.00 0.00 O ATOM 1318 CB LYS A 455 2.104 -14.636 1.210 1.00 0.00 C ATOM 1319 CG LYS A 455 1.017 -15.360 1.989 1.00 0.00 C ATOM 1320 CD LYS A 455 1.092 -15.049 3.476 1.00 0.00 C ATOM 1321 CE LYS A 455 2.306 -15.697 4.119 1.00 0.00 C ATOM 1322 NZ LYS A 455 1.984 -17.035 4.692 1.00 0.00 N ATOM 0 H LYS A 455 3.887 -13.799 -0.285 1.00 0.00 H new ATOM 0 HA LYS A 455 3.531 -16.238 1.118 1.00 0.00 H new ATOM 0 HB2 LYS A 455 2.707 -14.050 1.903 1.00 0.00 H new ATOM 0 HB3 LYS A 455 1.638 -13.933 0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 455 0.039 -15.070 1.605 1.00 0.00 H new ATOM 0 HG3 LYS A 455 1.114 -16.435 1.836 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.134 -13.970 3.621 1.00 0.00 H new ATOM 0 HD3 LYS A 455 0.186 -15.402 3.969 1.00 0.00 H new ATOM 0 HE2 LYS A 455 3.098 -15.801 3.377 1.00 0.00 H new ATOM 0 HE3 LYS A 455 2.690 -15.048 4.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 2.839 -17.444 5.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 1.247 -16.933 5.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 1.642 -17.663 3.937 1.00 0.00 H new ATOM 1336 N GLY A 456 2.039 -15.928 -1.769 1.00 0.00 N ATOM 1337 CA GLY A 456 1.271 -16.651 -2.765 1.00 0.00 C ATOM 1338 C GLY A 456 1.838 -18.028 -3.049 1.00 0.00 C ATOM 1339 O GLY A 456 1.237 -18.763 -3.861 1.00 0.00 O ATOM 1340 OXT GLY A 456 2.884 -18.373 -2.459 1.00 0.00 O ATOM 0 H GLY A 456 2.431 -15.043 -2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 456 0.241 -16.749 -2.423 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.247 -16.074 -3.689 1.00 0.00 H new