USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=15 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 389 LYS NZ :NH3+ 172:sc= 0.0351 (180deg=-0.000721) USER MOD Set 1.2: A 415 MET CE :methyl -138:sc= 0 (180deg=-0.0832) USER MOD Single : A 379 SER OG : rot -138:sc= 0.273 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ -161:sc= -1.96 (180deg=-2.84!) USER MOD Single : A 385 HIS : no HD1:sc= -0.135 X(o=-0.13,f=-0.034) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 30:sc= -1.55 USER MOD Single : A 395 GLN : amide:sc= -0.178 X(o=-0.18,f=0) USER MOD Single : A 403 LYS NZ :NH3+ 168:sc= -0.268 (180deg=-0.595) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 180:sc= 0 USER MOD Single : A 417 THR OG1 : rot 40:sc= 0.544 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= -0.619 USER MOD Single : A 431 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.61) USER MOD Single : A 433 SER OG : rot 180:sc= -1.42 USER MOD Single : A 436 GLN : amide:sc= -0.165 K(o=-0.16,f=-1.2!) 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+ -150:sc= -0.13 (180deg=-0.813) USER MOD Single : A 446 GLN : amide:sc= -0.165 K(o=-0.16,f=-1.5!) 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+ 143:sc= 0.0804 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 1.118 16.695 1.567 1.00 0.00 N ATOM 44 CA SER A 379 0.189 15.713 1.021 1.00 0.00 C ATOM 45 C SER A 379 -0.095 14.605 2.036 1.00 0.00 C ATOM 46 O SER A 379 -0.736 13.607 1.709 1.00 0.00 O ATOM 47 CB SER A 379 0.753 15.108 -0.265 1.00 0.00 C ATOM 48 OG SER A 379 -0.267 14.917 -1.230 1.00 0.00 O ATOM 0 HA SER A 379 -0.748 16.223 0.796 1.00 0.00 H new ATOM 0 HB2 SER A 379 1.524 15.763 -0.671 1.00 0.00 H new ATOM 0 HB3 SER A 379 1.231 14.154 -0.043 1.00 0.00 H new ATOM 0 HG SER A 379 -0.142 14.050 -1.670 1.00 0.00 H new ATOM 54 N ILE A 380 0.394 14.787 3.265 1.00 0.00 N ATOM 55 CA ILE A 380 0.210 13.806 4.336 1.00 0.00 C ATOM 56 C ILE A 380 -1.178 13.162 4.296 1.00 0.00 C ATOM 57 O ILE A 380 -1.339 11.996 4.650 1.00 0.00 O ATOM 58 CB ILE A 380 0.427 14.449 5.721 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.419 13.378 6.814 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.633 15.506 5.995 1.00 0.00 C ATOM 61 CD1 ILE A 380 1.773 13.154 7.451 1.00 0.00 C ATOM 0 H ILE A 380 0.925 15.612 3.544 1.00 0.00 H new ATOM 0 HA ILE A 380 0.957 13.029 4.172 1.00 0.00 H new ATOM 0 HB ILE A 380 1.401 14.937 5.725 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.294 13.665 7.587 1.00 0.00 H new ATOM 0 HG13 ILE A 380 0.067 12.438 6.388 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.462 15.947 6.977 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.577 16.284 5.233 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.621 15.045 5.971 1.00 0.00 H new ATOM 0 HD11 ILE A 380 1.692 12.382 8.216 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.485 12.837 6.689 1.00 0.00 H new ATOM 0 HD13 ILE A 380 2.119 14.082 7.907 1.00 0.00 H new ATOM 73 N LYS A 381 -2.175 13.921 3.858 1.00 0.00 N ATOM 74 CA LYS A 381 -3.536 13.406 3.772 1.00 0.00 C ATOM 75 C LYS A 381 -3.598 12.206 2.832 1.00 0.00 C ATOM 76 O LYS A 381 -4.164 11.163 3.170 1.00 0.00 O ATOM 77 CB LYS A 381 -4.490 14.502 3.289 1.00 0.00 C ATOM 78 CG LYS A 381 -5.808 14.537 4.045 1.00 0.00 C ATOM 79 CD LYS A 381 -5.624 15.054 5.462 1.00 0.00 C ATOM 80 CE LYS A 381 -6.494 14.293 6.450 1.00 0.00 C ATOM 81 NZ LYS A 381 -5.855 13.021 6.889 1.00 0.00 N ATOM 0 H LYS A 381 -2.068 14.890 3.558 1.00 0.00 H new ATOM 0 HA LYS A 381 -3.844 13.084 4.767 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -3.998 15.470 3.388 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -4.693 14.354 2.228 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.516 15.173 3.514 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.238 13.536 4.075 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -4.577 14.962 5.751 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -5.872 16.115 5.499 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -6.689 14.920 7.320 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -7.459 14.075 5.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -6.480 12.533 7.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -5.692 12.411 6.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -4.946 13.230 7.350 1.00 0.00 H new ATOM 95 N LYS A 382 -3.009 12.360 1.650 1.00 0.00 N ATOM 96 CA LYS A 382 -2.992 11.293 0.655 1.00 0.00 C ATOM 97 C LYS A 382 -2.208 10.085 1.160 1.00 0.00 C ATOM 98 O LYS A 382 -2.719 8.964 1.173 1.00 0.00 O ATOM 99 CB LYS A 382 -2.387 11.801 -0.655 1.00 0.00 C ATOM 100 CG LYS A 382 -3.428 12.194 -1.692 1.00 0.00 C ATOM 101 CD LYS A 382 -3.106 11.606 -3.058 1.00 0.00 C ATOM 102 CE LYS A 382 -3.485 10.136 -3.135 1.00 0.00 C ATOM 103 NZ LYS A 382 -2.487 9.268 -2.451 1.00 0.00 N ATOM 0 H LYS A 382 -2.536 13.215 1.357 1.00 0.00 H new ATOM 0 HA LYS A 382 -4.021 10.981 0.476 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.753 12.662 -0.443 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.743 11.027 -1.073 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -4.411 11.851 -1.370 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -3.478 13.280 -1.765 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -3.640 12.161 -3.829 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.041 11.720 -3.262 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -4.465 9.990 -2.681 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -3.570 9.837 -4.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -2.590 8.289 -2.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -1.527 9.608 -2.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -2.645 9.300 -1.424 1.00 0.00 H new ATOM 117 N ILE A 383 -0.963 10.316 1.571 1.00 0.00 N ATOM 118 CA ILE A 383 -0.117 9.237 2.068 1.00 0.00 C ATOM 119 C ILE A 383 -0.785 8.514 3.238 1.00 0.00 C ATOM 120 O ILE A 383 -0.683 7.295 3.367 1.00 0.00 O ATOM 121 CB ILE A 383 1.276 9.753 2.494 1.00 0.00 C ATOM 122 CG1 ILE A 383 2.272 8.594 2.550 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.210 10.470 3.834 1.00 0.00 C ATOM 124 CD1 ILE A 383 2.441 7.883 1.224 1.00 0.00 C ATOM 0 H ILE A 383 -0.521 11.235 1.569 1.00 0.00 H new ATOM 0 HA ILE A 383 0.018 8.533 1.247 1.00 0.00 H new ATOM 0 HB ILE A 383 1.616 10.473 1.750 1.00 0.00 H new ATOM 0 HG12 ILE A 383 3.240 8.972 2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 383 1.941 7.875 3.300 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.205 10.822 4.108 1.00 0.00 H new ATOM 0 HG22 ILE A 383 0.532 11.320 3.759 1.00 0.00 H new ATOM 0 HG23 ILE A 383 0.846 9.782 4.597 1.00 0.00 H new ATOM 0 HD11 ILE A 383 3.161 7.072 1.335 1.00 0.00 H new ATOM 0 HD12 ILE A 383 1.482 7.475 0.905 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.802 8.589 0.476 1.00 0.00 H new ATOM 136 N ILE A 384 -1.480 9.274 4.081 1.00 0.00 N ATOM 137 CA ILE A 384 -2.175 8.696 5.226 1.00 0.00 C ATOM 138 C ILE A 384 -3.286 7.766 4.747 1.00 0.00 C ATOM 139 O ILE A 384 -3.407 6.633 5.216 1.00 0.00 O ATOM 140 CB ILE A 384 -2.768 9.789 6.144 1.00 0.00 C ATOM 141 CG1 ILE A 384 -1.654 10.488 6.924 1.00 0.00 C ATOM 142 CG2 ILE A 384 -3.793 9.199 7.106 1.00 0.00 C ATOM 143 CD1 ILE A 384 -2.058 11.836 7.480 1.00 0.00 C ATOM 0 H ILE A 384 -1.576 10.286 3.993 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.446 8.129 5.805 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.274 10.521 5.515 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -1.339 9.845 7.746 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -0.791 10.617 6.271 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -4.194 9.990 7.740 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.604 8.742 6.539 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.315 8.443 7.728 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -1.219 12.273 8.021 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -2.345 12.496 6.661 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -2.902 11.712 8.159 1.00 0.00 H new ATOM 155 N HIS A 385 -4.090 8.248 3.803 1.00 0.00 N ATOM 156 CA HIS A 385 -5.181 7.453 3.252 1.00 0.00 C ATOM 157 C HIS A 385 -4.655 6.124 2.721 1.00 0.00 C ATOM 158 O HIS A 385 -5.125 5.053 3.111 1.00 0.00 O ATOM 159 CB HIS A 385 -5.893 8.222 2.137 1.00 0.00 C ATOM 160 CG HIS A 385 -7.386 8.161 2.227 1.00 0.00 C ATOM 161 ND1 HIS A 385 -8.213 9.127 1.691 1.00 0.00 N ATOM 162 CD2 HIS A 385 -8.204 7.243 2.794 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.472 8.806 1.927 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.494 7.667 2.593 1.00 0.00 N ATOM 0 H HIS A 385 -4.006 9.183 3.405 1.00 0.00 H new ATOM 0 HA HIS A 385 -5.897 7.252 4.049 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -5.578 9.265 2.168 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.579 7.822 1.173 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -7.898 6.344 3.309 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -10.337 9.379 1.626 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -10.334 7.180 2.907 1.00 0.00 H new ATOM 173 N VAL A 386 -3.662 6.199 1.839 1.00 0.00 N ATOM 174 CA VAL A 386 -3.060 5.000 1.270 1.00 0.00 C ATOM 175 C VAL A 386 -2.470 4.132 2.375 1.00 0.00 C ATOM 176 O VAL A 386 -2.487 2.904 2.292 1.00 0.00 O ATOM 177 CB VAL A 386 -1.963 5.345 0.243 1.00 0.00 C ATOM 178 CG1 VAL A 386 -0.880 6.199 0.885 1.00 0.00 C ATOM 179 CG2 VAL A 386 -1.369 4.080 -0.361 1.00 0.00 C ATOM 0 H VAL A 386 -3.259 7.075 1.505 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.848 4.452 0.753 1.00 0.00 H new ATOM 0 HB VAL A 386 -2.418 5.920 -0.563 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -0.114 6.433 0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -1.319 7.125 1.257 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -0.429 5.653 1.713 1.00 0.00 H new ATOM 0 HG21 VAL A 386 -0.597 4.349 -1.082 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -0.930 3.471 0.429 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -2.153 3.513 -0.863 1.00 0.00 H new ATOM 189 N LEU A 387 -1.960 4.780 3.420 1.00 0.00 N ATOM 190 CA LEU A 387 -1.383 4.066 4.553 1.00 0.00 C ATOM 191 C LEU A 387 -2.423 3.140 5.171 1.00 0.00 C ATOM 192 O LEU A 387 -2.178 1.948 5.360 1.00 0.00 O ATOM 193 CB LEU A 387 -0.868 5.052 5.603 1.00 0.00 C ATOM 194 CG LEU A 387 0.234 4.512 6.519 1.00 0.00 C ATOM 195 CD1 LEU A 387 -0.214 3.221 7.187 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.518 4.292 5.733 1.00 0.00 C ATOM 0 H LEU A 387 -1.935 5.796 3.504 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.543 3.470 4.196 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -0.492 5.938 5.092 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.707 5.372 6.220 1.00 0.00 H new ATOM 0 HG LEU A 387 0.430 5.250 7.297 1.00 0.00 H new ATOM 0 HD11 LEU A 387 0.581 2.851 7.834 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -1.108 3.410 7.782 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -0.437 2.475 6.424 1.00 0.00 H new ATOM 0 HD21 LEU A 387 2.291 3.908 6.399 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.337 3.573 4.934 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.847 5.237 5.302 1.00 0.00 H new ATOM 208 N GLU A 388 -3.595 3.697 5.466 1.00 0.00 N ATOM 209 CA GLU A 388 -4.683 2.918 6.045 1.00 0.00 C ATOM 210 C GLU A 388 -5.071 1.787 5.099 1.00 0.00 C ATOM 211 O GLU A 388 -5.230 0.638 5.516 1.00 0.00 O ATOM 212 CB GLU A 388 -5.894 3.813 6.319 1.00 0.00 C ATOM 213 CG GLU A 388 -6.943 3.160 7.204 1.00 0.00 C ATOM 214 CD GLU A 388 -7.219 3.954 8.467 1.00 0.00 C ATOM 215 OE1 GLU A 388 -8.093 4.845 8.430 1.00 0.00 O ATOM 216 OE2 GLU A 388 -6.560 3.684 9.494 1.00 0.00 O ATOM 0 H GLU A 388 -3.814 4.682 5.314 1.00 0.00 H new ATOM 0 HA GLU A 388 -4.345 2.493 6.990 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.555 4.735 6.791 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.353 4.091 5.370 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -7.869 3.048 6.640 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.611 2.158 7.475 1.00 0.00 H new ATOM 223 N LYS A 389 -5.206 2.121 3.817 1.00 0.00 N ATOM 224 CA LYS A 389 -5.554 1.131 2.805 1.00 0.00 C ATOM 225 C LYS A 389 -4.546 -0.012 2.827 1.00 0.00 C ATOM 226 O LYS A 389 -4.918 -1.186 2.782 1.00 0.00 O ATOM 227 CB LYS A 389 -5.594 1.776 1.418 1.00 0.00 C ATOM 228 CG LYS A 389 -6.856 1.453 0.634 1.00 0.00 C ATOM 229 CD LYS A 389 -7.045 -0.049 0.472 1.00 0.00 C ATOM 230 CE LYS A 389 -8.342 -0.522 1.110 1.00 0.00 C ATOM 231 NZ LYS A 389 -9.534 0.114 0.484 1.00 0.00 N ATOM 0 H LYS A 389 -5.080 3.067 3.457 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.544 0.734 3.029 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.510 2.857 1.527 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.727 1.445 0.847 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.721 1.876 1.145 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -6.805 1.922 -0.349 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -7.046 -0.304 -0.588 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -6.204 -0.573 0.925 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -8.418 -1.605 1.017 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -8.327 -0.294 2.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -10.399 -0.332 0.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -9.545 1.129 0.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -9.492 -0.010 -0.548 1.00 0.00 H new ATOM 245 N VAL A 390 -3.268 0.343 2.914 1.00 0.00 N ATOM 246 CA VAL A 390 -2.204 -0.650 2.964 1.00 0.00 C ATOM 247 C VAL A 390 -2.312 -1.467 4.244 1.00 0.00 C ATOM 248 O VAL A 390 -2.001 -2.657 4.261 1.00 0.00 O ATOM 249 CB VAL A 390 -0.810 0.005 2.886 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.287 -1.047 2.963 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.679 0.823 1.611 1.00 0.00 C ATOM 0 H VAL A 390 -2.946 1.310 2.951 1.00 0.00 H new ATOM 0 HA VAL A 390 -2.321 -1.302 2.099 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.698 0.674 3.739 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.261 -0.562 2.906 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.206 -1.589 3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.180 -1.745 2.133 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.310 1.279 1.571 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.814 0.173 0.746 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.439 1.604 1.600 1.00 0.00 H new ATOM 261 N GLN A 391 -2.771 -0.821 5.313 1.00 0.00 N ATOM 262 CA GLN A 391 -2.941 -1.494 6.594 1.00 0.00 C ATOM 263 C GLN A 391 -3.923 -2.648 6.445 1.00 0.00 C ATOM 264 O GLN A 391 -3.612 -3.794 6.775 1.00 0.00 O ATOM 265 CB GLN A 391 -3.442 -0.510 7.654 1.00 0.00 C ATOM 266 CG GLN A 391 -2.864 -0.760 9.037 1.00 0.00 C ATOM 267 CD GLN A 391 -2.451 0.521 9.737 1.00 0.00 C ATOM 268 OE1 GLN A 391 -3.279 1.393 10.001 1.00 0.00 O ATOM 269 NE2 GLN A 391 -1.164 0.640 10.040 1.00 0.00 N ATOM 0 H GLN A 391 -3.031 0.165 5.316 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.976 -1.885 6.915 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -3.193 0.504 7.343 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -4.529 -0.569 7.708 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -3.602 -1.281 9.647 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.999 -1.418 8.952 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.513 -0.108 9.802 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -0.826 1.480 10.511 1.00 0.00 H new ATOM 278 N TYR A 392 -5.105 -2.340 5.916 1.00 0.00 N ATOM 279 CA TYR A 392 -6.123 -3.360 5.695 1.00 0.00 C ATOM 280 C TYR A 392 -5.575 -4.440 4.770 1.00 0.00 C ATOM 281 O TYR A 392 -5.735 -5.635 5.022 1.00 0.00 O ATOM 282 CB TYR A 392 -7.383 -2.740 5.090 1.00 0.00 C ATOM 283 CG TYR A 392 -7.878 -1.521 5.837 1.00 0.00 C ATOM 284 CD1 TYR A 392 -8.141 -1.578 7.200 1.00 0.00 C ATOM 285 CD2 TYR A 392 -8.086 -0.316 5.179 1.00 0.00 C ATOM 286 CE1 TYR A 392 -8.594 -0.467 7.886 1.00 0.00 C ATOM 287 CE2 TYR A 392 -8.539 0.799 5.857 1.00 0.00 C ATOM 288 CZ TYR A 392 -8.791 0.719 7.211 1.00 0.00 C ATOM 289 OH TYR A 392 -9.244 1.826 7.890 1.00 0.00 O ATOM 0 H TYR A 392 -5.379 -1.399 5.635 1.00 0.00 H new ATOM 0 HA TYR A 392 -6.386 -3.807 6.654 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -7.181 -2.464 4.055 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -8.174 -3.490 5.071 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.989 -2.505 7.732 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.890 -0.249 4.119 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -8.793 -0.528 8.946 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.695 1.729 5.330 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.936 1.788 8.820 1.00 0.00 H new ATOM 299 N LEU A 393 -4.907 -4.003 3.705 1.00 0.00 N ATOM 300 CA LEU A 393 -4.311 -4.923 2.749 1.00 0.00 C ATOM 301 C LEU A 393 -3.269 -5.792 3.444 1.00 0.00 C ATOM 302 O LEU A 393 -3.144 -6.982 3.157 1.00 0.00 O ATOM 303 CB LEU A 393 -3.672 -4.151 1.593 1.00 0.00 C ATOM 304 CG LEU A 393 -4.511 -4.087 0.316 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.433 -2.703 -0.309 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.052 -5.147 -0.676 1.00 0.00 C ATOM 0 H LEU A 393 -4.767 -3.017 3.485 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.094 -5.565 2.344 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.466 -3.134 1.926 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.712 -4.610 1.356 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.550 -4.285 0.578 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.037 -2.679 -1.216 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -4.810 -1.963 0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.397 -2.474 -0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.660 -5.088 -1.579 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.006 -4.978 -0.931 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.162 -6.135 -0.229 1.00 0.00 H new ATOM 318 N GLU A 394 -2.533 -5.184 4.372 1.00 0.00 N ATOM 319 CA GLU A 394 -1.513 -5.898 5.128 1.00 0.00 C ATOM 320 C GLU A 394 -2.150 -7.037 5.912 1.00 0.00 C ATOM 321 O GLU A 394 -1.650 -8.162 5.920 1.00 0.00 O ATOM 322 CB GLU A 394 -0.786 -4.945 6.079 1.00 0.00 C ATOM 323 CG GLU A 394 0.488 -4.356 5.495 1.00 0.00 C ATOM 324 CD GLU A 394 1.690 -5.258 5.694 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.536 -6.490 5.570 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.787 -4.730 5.976 1.00 0.00 O ATOM 0 H GLU A 394 -2.626 -4.198 4.617 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.785 -6.311 4.430 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -1.460 -4.133 6.351 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.542 -5.478 6.998 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.346 -4.176 4.429 1.00 0.00 H new ATOM 0 HG3 GLU A 394 0.683 -3.389 5.959 1.00 0.00 H new ATOM 333 N GLN A 395 -3.273 -6.739 6.560 1.00 0.00 N ATOM 334 CA GLN A 395 -3.992 -7.744 7.329 1.00 0.00 C ATOM 335 C GLN A 395 -4.451 -8.871 6.412 1.00 0.00 C ATOM 336 O GLN A 395 -4.339 -10.051 6.748 1.00 0.00 O ATOM 337 CB GLN A 395 -5.197 -7.117 8.034 1.00 0.00 C ATOM 338 CG GLN A 395 -4.883 -6.595 9.428 1.00 0.00 C ATOM 339 CD GLN A 395 -5.360 -7.530 10.521 1.00 0.00 C ATOM 340 OE1 GLN A 395 -5.894 -7.092 11.540 1.00 0.00 O ATOM 341 NE2 GLN A 395 -5.170 -8.828 10.315 1.00 0.00 N ATOM 0 H GLN A 395 -3.701 -5.813 6.567 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.321 -8.151 8.085 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -5.577 -6.297 7.425 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.993 -7.858 8.103 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.807 -6.449 9.524 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -5.350 -5.619 9.560 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -4.723 -9.148 9.456 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -5.471 -9.505 11.016 1.00 0.00 H new ATOM 350 N GLU A 396 -4.957 -8.495 5.240 1.00 0.00 N ATOM 351 CA GLU A 396 -5.422 -9.469 4.259 1.00 0.00 C ATOM 352 C GLU A 396 -4.285 -10.396 3.847 1.00 0.00 C ATOM 353 O GLU A 396 -4.369 -11.611 4.019 1.00 0.00 O ATOM 354 CB GLU A 396 -5.992 -8.760 3.029 1.00 0.00 C ATOM 355 CG GLU A 396 -6.963 -7.642 3.368 1.00 0.00 C ATOM 356 CD GLU A 396 -8.227 -7.693 2.533 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.148 -7.413 1.317 1.00 0.00 O ATOM 358 OE2 GLU A 396 -9.297 -8.014 3.092 1.00 0.00 O ATOM 0 H GLU A 396 -5.055 -7.523 4.948 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.211 -10.065 4.717 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.170 -8.350 2.442 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.499 -9.492 2.400 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -7.227 -7.703 4.424 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.471 -6.681 3.217 1.00 0.00 H new ATOM 365 N VAL A 397 -3.215 -9.816 3.306 1.00 0.00 N ATOM 366 CA VAL A 397 -2.060 -10.596 2.878 1.00 0.00 C ATOM 367 C VAL A 397 -1.573 -11.501 4.006 1.00 0.00 C ATOM 368 O VAL A 397 -1.172 -12.642 3.773 1.00 0.00 O ATOM 369 CB VAL A 397 -0.900 -9.692 2.415 1.00 0.00 C ATOM 370 CG1 VAL A 397 -0.488 -8.736 3.521 1.00 0.00 C ATOM 371 CG2 VAL A 397 0.286 -10.528 1.956 1.00 0.00 C ATOM 0 H VAL A 397 -3.126 -8.811 3.155 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.382 -11.205 2.033 1.00 0.00 H new ATOM 0 HB VAL A 397 -1.248 -9.102 1.567 1.00 0.00 H new ATOM 0 HG11 VAL A 397 0.332 -8.108 3.172 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -1.336 -8.108 3.793 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -0.164 -9.305 4.392 1.00 0.00 H new ATOM 0 HG21 VAL A 397 1.092 -9.869 1.634 1.00 0.00 H new ATOM 0 HG22 VAL A 397 0.633 -11.150 2.781 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.017 -11.164 1.124 1.00 0.00 H new ATOM 381 N GLU A 398 -1.623 -10.988 5.231 1.00 0.00 N ATOM 382 CA GLU A 398 -1.199 -11.755 6.395 1.00 0.00 C ATOM 383 C GLU A 398 -2.084 -12.984 6.569 1.00 0.00 C ATOM 384 O GLU A 398 -1.600 -14.078 6.852 1.00 0.00 O ATOM 385 CB GLU A 398 -1.251 -10.887 7.654 1.00 0.00 C ATOM 386 CG GLU A 398 0.042 -10.137 7.927 1.00 0.00 C ATOM 387 CD GLU A 398 -0.178 -8.871 8.734 1.00 0.00 C ATOM 388 OE1 GLU A 398 -1.038 -8.057 8.335 1.00 0.00 O ATOM 389 OE2 GLU A 398 0.509 -8.693 9.761 1.00 0.00 O ATOM 0 H GLU A 398 -1.952 -10.046 5.442 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.171 -12.081 6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -2.065 -10.169 7.557 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -1.484 -11.518 8.512 1.00 0.00 H new ATOM 0 HG2 GLU A 398 0.731 -10.790 8.463 1.00 0.00 H new ATOM 0 HG3 GLU A 398 0.517 -9.882 6.980 1.00 0.00 H new ATOM 396 N GLU A 399 -3.389 -12.792 6.392 1.00 0.00 N ATOM 397 CA GLU A 399 -4.348 -13.884 6.523 1.00 0.00 C ATOM 398 C GLU A 399 -4.552 -14.605 5.188 1.00 0.00 C ATOM 399 O GLU A 399 -5.303 -15.577 5.111 1.00 0.00 O ATOM 400 CB GLU A 399 -5.688 -13.352 7.037 1.00 0.00 C ATOM 401 CG GLU A 399 -6.384 -14.295 8.004 1.00 0.00 C ATOM 402 CD GLU A 399 -7.772 -13.818 8.386 1.00 0.00 C ATOM 403 OE1 GLU A 399 -8.709 -14.011 7.582 1.00 0.00 O ATOM 404 OE2 GLU A 399 -7.922 -13.249 9.488 1.00 0.00 O ATOM 0 H GLU A 399 -3.806 -11.891 6.158 1.00 0.00 H new ATOM 0 HA GLU A 399 -3.945 -14.600 7.240 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -5.524 -12.394 7.531 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -6.345 -13.165 6.188 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -6.455 -15.285 7.553 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -5.779 -14.398 8.904 1.00 0.00 H new ATOM 411 N PHE A 400 -3.882 -14.121 4.139 1.00 0.00 N ATOM 412 CA PHE A 400 -3.990 -14.714 2.807 1.00 0.00 C ATOM 413 C PHE A 400 -3.944 -16.239 2.871 1.00 0.00 C ATOM 414 O PHE A 400 -3.118 -16.816 3.580 1.00 0.00 O ATOM 415 CB PHE A 400 -2.864 -14.191 1.908 1.00 0.00 C ATOM 416 CG PHE A 400 -2.908 -14.732 0.506 1.00 0.00 C ATOM 417 CD1 PHE A 400 -3.950 -14.404 -0.347 1.00 0.00 C ATOM 418 CD2 PHE A 400 -1.904 -15.566 0.041 1.00 0.00 C ATOM 419 CE1 PHE A 400 -3.992 -14.900 -1.633 1.00 0.00 C ATOM 420 CE2 PHE A 400 -1.941 -16.064 -1.248 1.00 0.00 C ATOM 421 CZ PHE A 400 -2.988 -15.733 -2.084 1.00 0.00 C ATOM 0 H PHE A 400 -3.257 -13.317 4.189 1.00 0.00 H new ATOM 0 HA PHE A 400 -4.953 -14.425 2.386 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -2.918 -13.103 1.870 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -1.904 -14.447 2.357 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.738 -13.752 -0.000 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.084 -15.830 0.692 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.810 -14.637 -2.287 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.152 -16.711 -1.600 1.00 0.00 H new ATOM 0 HZ PHE A 400 -3.022 -16.125 -3.090 1.00 0.00 H new ATOM 431 N VAL A 401 -4.842 -16.884 2.132 1.00 0.00 N ATOM 432 CA VAL A 401 -4.914 -18.343 2.108 1.00 0.00 C ATOM 433 C VAL A 401 -3.553 -18.966 1.800 1.00 0.00 C ATOM 434 O VAL A 401 -3.139 -19.922 2.454 1.00 0.00 O ATOM 435 CB VAL A 401 -5.953 -18.831 1.076 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.678 -18.229 -0.294 1.00 0.00 C ATOM 437 CG2 VAL A 401 -5.974 -20.352 1.003 1.00 0.00 C ATOM 0 H VAL A 401 -5.531 -16.419 1.541 1.00 0.00 H new ATOM 0 HA VAL A 401 -5.225 -18.663 3.102 1.00 0.00 H new ATOM 0 HB VAL A 401 -6.937 -18.495 1.404 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -6.423 -18.587 -1.005 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.730 -17.142 -0.231 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.684 -18.526 -0.629 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -6.714 -20.671 0.269 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -4.990 -20.716 0.708 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -6.233 -20.760 1.980 1.00 0.00 H new ATOM 447 N GLY A 402 -2.858 -18.418 0.806 1.00 0.00 N ATOM 448 CA GLY A 402 -1.553 -18.940 0.445 1.00 0.00 C ATOM 449 C GLY A 402 -1.380 -19.111 -1.052 1.00 0.00 C ATOM 450 O GLY A 402 -0.274 -18.972 -1.576 1.00 0.00 O ATOM 0 H GLY A 402 -3.174 -17.626 0.247 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.782 -18.268 0.820 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -1.404 -19.902 0.935 1.00 0.00 H new ATOM 454 N LYS A 403 -2.473 -19.415 -1.744 1.00 0.00 N ATOM 455 CA LYS A 403 -2.431 -19.607 -3.190 1.00 0.00 C ATOM 456 C LYS A 403 -3.134 -18.463 -3.913 1.00 0.00 C ATOM 457 O LYS A 403 -4.174 -17.979 -3.466 1.00 0.00 O ATOM 458 CB LYS A 403 -3.080 -20.941 -3.567 1.00 0.00 C ATOM 459 CG LYS A 403 -2.312 -22.154 -3.068 1.00 0.00 C ATOM 460 CD LYS A 403 -1.397 -22.715 -4.144 1.00 0.00 C ATOM 461 CE LYS A 403 -2.013 -23.929 -4.823 1.00 0.00 C ATOM 462 NZ LYS A 403 -3.447 -23.712 -5.155 1.00 0.00 N ATOM 0 H LYS A 403 -3.397 -19.534 -1.329 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.386 -19.619 -3.499 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -4.092 -20.970 -3.162 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -3.169 -20.999 -4.652 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -1.722 -21.878 -2.194 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -3.014 -22.924 -2.748 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -1.194 -21.945 -4.888 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -0.440 -22.991 -3.701 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -1.460 -24.155 -5.735 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -1.919 -24.797 -4.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -3.775 -24.468 -5.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -4.011 -23.724 -4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -3.559 -22.792 -5.626 1.00 0.00 H new ATOM 476 N LYS A 404 -2.559 -18.034 -5.032 1.00 0.00 N ATOM 477 CA LYS A 404 -3.128 -16.944 -5.817 1.00 0.00 C ATOM 478 C LYS A 404 -4.270 -17.442 -6.702 1.00 0.00 C ATOM 479 O LYS A 404 -4.234 -17.294 -7.924 1.00 0.00 O ATOM 480 CB LYS A 404 -2.046 -16.290 -6.679 1.00 0.00 C ATOM 481 CG LYS A 404 -1.226 -17.285 -7.486 1.00 0.00 C ATOM 482 CD LYS A 404 -0.956 -16.779 -8.895 1.00 0.00 C ATOM 483 CE LYS A 404 -1.765 -17.548 -9.928 1.00 0.00 C ATOM 484 NZ LYS A 404 -1.980 -16.752 -11.167 1.00 0.00 N ATOM 0 H LYS A 404 -1.699 -18.425 -5.416 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.529 -16.204 -5.124 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -2.516 -15.581 -7.361 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -1.377 -15.718 -6.036 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.280 -17.473 -6.979 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -1.755 -18.237 -7.536 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.201 -15.719 -8.955 1.00 0.00 H new ATOM 0 HD3 LYS A 404 0.106 -16.874 -9.119 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.249 -18.475 -10.177 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -2.729 -17.824 -9.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -2.535 -17.310 -11.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -2.495 -15.879 -10.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -1.060 -16.510 -11.588 1.00 0.00 H new ATOM 498 N THR A 405 -5.282 -18.034 -6.077 1.00 0.00 N ATOM 499 CA THR A 405 -6.434 -18.552 -6.807 1.00 0.00 C ATOM 500 C THR A 405 -7.734 -17.954 -6.277 1.00 0.00 C ATOM 501 O THR A 405 -8.698 -17.779 -7.024 1.00 0.00 O ATOM 502 CB THR A 405 -6.481 -20.079 -6.705 1.00 0.00 C ATOM 503 OG1 THR A 405 -7.698 -20.577 -7.232 1.00 0.00 O ATOM 504 CG2 THR A 405 -6.352 -20.587 -5.286 1.00 0.00 C ATOM 0 H THR A 405 -5.328 -18.167 -5.067 1.00 0.00 H new ATOM 0 HA THR A 405 -6.328 -18.266 -7.853 1.00 0.00 H new ATOM 0 HB THR A 405 -5.626 -20.436 -7.280 1.00 0.00 H new ATOM 0 HG1 THR A 405 -7.710 -21.554 -7.160 1.00 0.00 H new ATOM 0 HG21 THR A 405 -6.393 -21.676 -5.284 1.00 0.00 H new ATOM 0 HG22 THR A 405 -5.401 -20.259 -4.867 1.00 0.00 H new ATOM 0 HG23 THR A 405 -7.169 -20.192 -4.683 1.00 0.00 H new ATOM 512 N ASP A 406 -7.757 -17.641 -4.985 1.00 0.00 N ATOM 513 CA ASP A 406 -8.938 -17.064 -4.357 1.00 0.00 C ATOM 514 C ASP A 406 -9.028 -15.566 -4.639 1.00 0.00 C ATOM 515 O ASP A 406 -8.039 -14.936 -5.014 1.00 0.00 O ATOM 516 CB ASP A 406 -8.908 -17.313 -2.847 1.00 0.00 C ATOM 517 CG ASP A 406 -10.122 -16.743 -2.138 1.00 0.00 C ATOM 518 OD1 ASP A 406 -11.158 -17.438 -2.084 1.00 0.00 O ATOM 519 OD2 ASP A 406 -10.034 -15.602 -1.639 1.00 0.00 O ATOM 0 H ASP A 406 -6.969 -17.778 -4.352 1.00 0.00 H new ATOM 0 HA ASP A 406 -9.819 -17.546 -4.780 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.853 -18.385 -2.660 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -8.005 -16.870 -2.427 1.00 0.00 H new ATOM 524 N LYS A 407 -10.218 -15.004 -4.459 1.00 0.00 N ATOM 525 CA LYS A 407 -10.440 -13.580 -4.694 1.00 0.00 C ATOM 526 C LYS A 407 -9.499 -12.728 -3.843 1.00 0.00 C ATOM 527 O LYS A 407 -9.239 -11.567 -4.162 1.00 0.00 O ATOM 528 CB LYS A 407 -11.893 -13.214 -4.393 1.00 0.00 C ATOM 529 CG LYS A 407 -12.522 -12.308 -5.440 1.00 0.00 C ATOM 530 CD LYS A 407 -13.015 -11.005 -4.833 1.00 0.00 C ATOM 531 CE LYS A 407 -12.717 -9.821 -5.738 1.00 0.00 C ATOM 532 NZ LYS A 407 -13.392 -8.578 -5.268 1.00 0.00 N ATOM 0 H LYS A 407 -11.046 -15.513 -4.150 1.00 0.00 H new ATOM 0 HA LYS A 407 -10.230 -13.375 -5.744 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.481 -14.129 -4.316 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -11.941 -12.721 -3.422 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -11.792 -12.093 -6.221 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -13.355 -12.826 -5.916 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -14.089 -11.068 -4.656 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -12.541 -10.852 -3.864 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -11.640 -9.656 -5.778 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -13.042 -10.049 -6.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -13.163 -7.794 -5.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -14.421 -8.726 -5.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -13.063 -8.345 -4.309 1.00 0.00 H new ATOM 546 N ALA A 408 -8.993 -13.310 -2.758 1.00 0.00 N ATOM 547 CA ALA A 408 -8.082 -12.602 -1.865 1.00 0.00 C ATOM 548 C ALA A 408 -6.929 -11.972 -2.638 1.00 0.00 C ATOM 549 O ALA A 408 -6.772 -10.752 -2.654 1.00 0.00 O ATOM 550 CB ALA A 408 -7.551 -13.547 -0.798 1.00 0.00 C ATOM 0 H ALA A 408 -9.199 -14.269 -2.477 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.639 -11.799 -1.382 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -6.872 -13.006 -0.138 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.383 -13.944 -0.217 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.016 -14.369 -1.274 1.00 0.00 H new ATOM 556 N TYR A 409 -6.123 -12.810 -3.284 1.00 0.00 N ATOM 557 CA TYR A 409 -4.989 -12.327 -4.060 1.00 0.00 C ATOM 558 C TYR A 409 -5.448 -11.362 -5.148 1.00 0.00 C ATOM 559 O TYR A 409 -4.722 -10.442 -5.525 1.00 0.00 O ATOM 560 CB TYR A 409 -4.232 -13.496 -4.686 1.00 0.00 C ATOM 561 CG TYR A 409 -2.824 -13.145 -5.111 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.833 -12.906 -4.168 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.487 -13.052 -6.456 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.546 -12.585 -4.553 1.00 0.00 C ATOM 565 CE2 TYR A 409 -1.202 -12.731 -6.848 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.235 -12.498 -5.894 1.00 0.00 C ATOM 567 OH TYR A 409 1.046 -12.178 -6.280 1.00 0.00 O ATOM 0 H TYR A 409 -6.235 -13.824 -3.285 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.320 -11.795 -3.383 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.193 -14.318 -3.971 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.786 -13.854 -5.554 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.072 -12.972 -3.117 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -3.242 -13.234 -7.207 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.214 -12.403 -3.807 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.956 -12.663 -7.897 1.00 0.00 H new ATOM 0 HH TYR A 409 1.098 -12.159 -7.258 1.00 0.00 H new ATOM 577 N TRP A 410 -6.663 -11.576 -5.647 1.00 0.00 N ATOM 578 CA TRP A 410 -7.222 -10.720 -6.688 1.00 0.00 C ATOM 579 C TRP A 410 -7.273 -9.273 -6.212 1.00 0.00 C ATOM 580 O TRP A 410 -6.580 -8.406 -6.750 1.00 0.00 O ATOM 581 CB TRP A 410 -8.623 -11.198 -7.075 1.00 0.00 C ATOM 582 CG TRP A 410 -8.670 -11.882 -8.406 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.742 -12.738 -8.924 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.704 -11.769 -9.392 1.00 0.00 C ATOM 585 NE1 TRP A 410 -8.133 -13.163 -10.171 1.00 0.00 N ATOM 586 CE2 TRP A 410 -9.335 -12.582 -10.480 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.906 -11.059 -9.459 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -10.125 -12.702 -11.620 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.689 -11.178 -10.592 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.297 -11.996 -11.658 1.00 0.00 C ATOM 0 H TRP A 410 -7.277 -12.333 -5.348 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.579 -10.777 -7.566 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -8.990 -11.882 -6.310 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -9.300 -10.343 -7.090 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.832 -13.038 -8.426 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -7.613 -13.806 -10.769 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.218 -10.428 -8.640 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.824 -13.330 -12.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.618 -10.631 -10.656 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -11.932 -12.072 -12.528 1.00 0.00 H new ATOM 601 N LEU A 411 -8.087 -9.017 -5.191 1.00 0.00 N ATOM 602 CA LEU A 411 -8.209 -7.674 -4.641 1.00 0.00 C ATOM 603 C LEU A 411 -6.875 -7.214 -4.062 1.00 0.00 C ATOM 604 O LEU A 411 -6.592 -6.017 -4.002 1.00 0.00 O ATOM 605 CB LEU A 411 -9.299 -7.622 -3.566 1.00 0.00 C ATOM 606 CG LEU A 411 -9.344 -8.826 -2.621 1.00 0.00 C ATOM 607 CD1 LEU A 411 -9.221 -8.377 -1.172 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.627 -9.618 -2.826 1.00 0.00 C ATOM 0 H LEU A 411 -8.668 -9.719 -4.732 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.493 -7.000 -5.449 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.157 -6.719 -2.971 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.267 -7.531 -4.058 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.498 -9.473 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -9.255 -9.248 -0.517 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -8.275 -7.855 -1.032 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -10.045 -7.707 -0.928 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.641 -10.470 -2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.486 -8.978 -2.624 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -10.674 -9.974 -3.855 1.00 0.00 H new ATOM 620 N LEU A 412 -6.049 -8.175 -3.647 1.00 0.00 N ATOM 621 CA LEU A 412 -4.738 -7.867 -3.087 1.00 0.00 C ATOM 622 C LEU A 412 -3.911 -7.062 -4.085 1.00 0.00 C ATOM 623 O LEU A 412 -3.526 -5.924 -3.814 1.00 0.00 O ATOM 624 CB LEU A 412 -3.991 -9.157 -2.728 1.00 0.00 C ATOM 625 CG LEU A 412 -4.254 -9.704 -1.323 1.00 0.00 C ATOM 626 CD1 LEU A 412 -3.345 -10.890 -1.038 1.00 0.00 C ATOM 627 CD2 LEU A 412 -4.052 -8.616 -0.281 1.00 0.00 C ATOM 0 H LEU A 412 -6.266 -9.171 -3.689 1.00 0.00 H new ATOM 0 HA LEU A 412 -4.885 -7.277 -2.183 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.259 -9.925 -3.454 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -2.921 -8.978 -2.834 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.289 -10.041 -1.271 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -3.544 -11.268 -0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -3.535 -11.678 -1.767 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -2.304 -10.575 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -4.243 -9.023 0.712 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -3.027 -8.250 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -4.741 -7.794 -0.475 1.00 0.00 H new ATOM 639 N GLU A 413 -3.647 -7.664 -5.241 1.00 0.00 N ATOM 640 CA GLU A 413 -2.870 -7.009 -6.286 1.00 0.00 C ATOM 641 C GLU A 413 -3.605 -5.787 -6.824 1.00 0.00 C ATOM 642 O GLU A 413 -3.012 -4.724 -7.006 1.00 0.00 O ATOM 643 CB GLU A 413 -2.581 -7.989 -7.425 1.00 0.00 C ATOM 644 CG GLU A 413 -1.515 -9.017 -7.088 1.00 0.00 C ATOM 645 CD GLU A 413 -0.136 -8.403 -6.949 1.00 0.00 C ATOM 646 OE1 GLU A 413 0.443 -8.003 -7.981 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.366 -8.323 -5.808 1.00 0.00 O ATOM 0 H GLU A 413 -3.961 -8.605 -5.477 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.926 -6.680 -5.851 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -3.503 -8.507 -7.690 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -2.267 -7.428 -8.305 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -1.781 -9.519 -6.158 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -1.492 -9.780 -7.866 1.00 0.00 H new ATOM 654 N GLU A 414 -4.902 -5.943 -7.078 1.00 0.00 N ATOM 655 CA GLU A 414 -5.715 -4.847 -7.594 1.00 0.00 C ATOM 656 C GLU A 414 -5.680 -3.653 -6.645 1.00 0.00 C ATOM 657 O GLU A 414 -5.325 -2.541 -7.042 1.00 0.00 O ATOM 658 CB GLU A 414 -7.159 -5.309 -7.799 1.00 0.00 C ATOM 659 CG GLU A 414 -7.398 -5.978 -9.142 1.00 0.00 C ATOM 660 CD GLU A 414 -8.721 -5.577 -9.766 1.00 0.00 C ATOM 661 OE1 GLU A 414 -8.871 -4.390 -10.126 1.00 0.00 O ATOM 662 OE2 GLU A 414 -9.606 -6.448 -9.896 1.00 0.00 O ATOM 0 H GLU A 414 -5.411 -6.816 -6.935 1.00 0.00 H new ATOM 0 HA GLU A 414 -5.300 -4.539 -8.554 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -7.426 -6.005 -7.003 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -7.823 -4.450 -7.707 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -6.586 -5.719 -9.822 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -7.374 -7.060 -9.014 1.00 0.00 H new ATOM 669 N MET A 415 -6.049 -3.890 -5.391 1.00 0.00 N ATOM 670 CA MET A 415 -6.058 -2.837 -4.384 1.00 0.00 C ATOM 671 C MET A 415 -4.667 -2.233 -4.217 1.00 0.00 C ATOM 672 O MET A 415 -4.522 -1.021 -4.049 1.00 0.00 O ATOM 673 CB MET A 415 -6.554 -3.387 -3.044 1.00 0.00 C ATOM 674 CG MET A 415 -6.923 -2.306 -2.041 1.00 0.00 C ATOM 675 SD MET A 415 -8.608 -1.703 -2.260 1.00 0.00 S ATOM 676 CE MET A 415 -9.544 -3.028 -1.502 1.00 0.00 C ATOM 0 H MET A 415 -6.346 -4.803 -5.048 1.00 0.00 H new ATOM 0 HA MET A 415 -6.737 -2.053 -4.719 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.424 -4.020 -3.220 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.780 -4.022 -2.613 1.00 0.00 H new ATOM 0 HG2 MET A 415 -6.810 -2.699 -1.031 1.00 0.00 H new ATOM 0 HG3 MET A 415 -6.227 -1.473 -2.138 1.00 0.00 H new ATOM 0 HE1 MET A 415 -10.420 -3.250 -2.112 1.00 0.00 H new ATOM 0 HE2 MET A 415 -8.919 -3.918 -1.427 1.00 0.00 H new ATOM 0 HE3 MET A 415 -9.863 -2.724 -0.505 1.00 0.00 H new ATOM 686 N LEU A 416 -3.648 -3.084 -4.270 1.00 0.00 N ATOM 687 CA LEU A 416 -2.267 -2.633 -4.128 1.00 0.00 C ATOM 688 C LEU A 416 -1.888 -1.692 -5.266 1.00 0.00 C ATOM 689 O LEU A 416 -1.275 -0.648 -5.045 1.00 0.00 O ATOM 690 CB LEU A 416 -1.317 -3.832 -4.101 1.00 0.00 C ATOM 691 CG LEU A 416 -1.327 -4.640 -2.802 1.00 0.00 C ATOM 692 CD1 LEU A 416 -0.890 -6.072 -3.060 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.428 -3.987 -1.762 1.00 0.00 C ATOM 0 H LEU A 416 -3.751 -4.089 -4.410 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.180 -2.091 -3.186 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.573 -4.497 -4.926 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.303 -3.476 -4.281 1.00 0.00 H new ATOM 0 HG LEU A 416 -2.346 -4.657 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -0.904 -6.631 -2.124 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -1.572 -6.538 -3.771 1.00 0.00 H new ATOM 0 HD13 LEU A 416 0.120 -6.076 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.447 -4.575 -0.844 1.00 0.00 H new ATOM 0 HD22 LEU A 416 0.593 -3.940 -2.142 1.00 0.00 H new ATOM 0 HD23 LEU A 416 -0.785 -2.978 -1.554 1.00 0.00 H new ATOM 705 N THR A 417 -2.256 -2.069 -6.486 1.00 0.00 N ATOM 706 CA THR A 417 -1.955 -1.258 -7.659 1.00 0.00 C ATOM 707 C THR A 417 -2.646 0.098 -7.568 1.00 0.00 C ATOM 708 O THR A 417 -2.041 1.134 -7.847 1.00 0.00 O ATOM 709 CB THR A 417 -2.389 -1.981 -8.937 1.00 0.00 C ATOM 710 OG1 THR A 417 -3.475 -2.856 -8.678 1.00 0.00 O ATOM 711 CG2 THR A 417 -1.279 -2.794 -9.570 1.00 0.00 C ATOM 0 H THR A 417 -2.763 -2.931 -6.688 1.00 0.00 H new ATOM 0 HA THR A 417 -0.877 -1.099 -7.693 1.00 0.00 H new ATOM 0 HB THR A 417 -2.679 -1.192 -9.631 1.00 0.00 H new ATOM 0 HG1 THR A 417 -4.097 -2.429 -8.052 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.653 -3.280 -10.471 1.00 0.00 H new ATOM 0 HG22 THR A 417 -0.449 -2.137 -9.830 1.00 0.00 H new ATOM 0 HG23 THR A 417 -0.935 -3.551 -8.865 1.00 0.00 H new ATOM 719 N LYS A 418 -3.915 0.086 -7.174 1.00 0.00 N ATOM 720 CA LYS A 418 -4.686 1.317 -7.044 1.00 0.00 C ATOM 721 C LYS A 418 -4.036 2.261 -6.038 1.00 0.00 C ATOM 722 O LYS A 418 -3.730 3.411 -6.358 1.00 0.00 O ATOM 723 CB LYS A 418 -6.122 1.002 -6.617 1.00 0.00 C ATOM 724 CG LYS A 418 -7.167 1.846 -7.330 1.00 0.00 C ATOM 725 CD LYS A 418 -8.578 1.392 -6.987 1.00 0.00 C ATOM 726 CE LYS A 418 -9.214 2.292 -5.941 1.00 0.00 C ATOM 727 NZ LYS A 418 -9.030 1.759 -4.563 1.00 0.00 N ATOM 0 H LYS A 418 -4.431 -0.762 -6.939 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.705 1.810 -8.016 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -6.326 -0.052 -6.807 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.215 1.155 -5.542 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -7.043 2.893 -7.052 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -7.015 1.782 -8.407 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -9.190 1.391 -7.889 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -8.552 0.366 -6.619 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -8.777 3.289 -6.006 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -10.279 2.396 -6.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -9.478 2.402 -3.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -9.469 0.819 -4.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -8.014 1.684 -4.353 1.00 0.00 H new ATOM 741 N GLU A 419 -3.830 1.769 -4.820 1.00 0.00 N ATOM 742 CA GLU A 419 -3.215 2.571 -3.767 1.00 0.00 C ATOM 743 C GLU A 419 -1.852 3.094 -4.206 1.00 0.00 C ATOM 744 O GLU A 419 -1.491 4.236 -3.919 1.00 0.00 O ATOM 745 CB GLU A 419 -3.073 1.748 -2.484 1.00 0.00 C ATOM 746 CG GLU A 419 -2.156 0.546 -2.631 1.00 0.00 C ATOM 747 CD GLU A 419 -1.924 -0.174 -1.316 1.00 0.00 C ATOM 748 OE1 GLU A 419 -2.764 -0.026 -0.403 1.00 0.00 O ATOM 749 OE2 GLU A 419 -0.904 -0.886 -1.199 1.00 0.00 O ATOM 0 H GLU A 419 -4.079 0.821 -4.538 1.00 0.00 H new ATOM 0 HA GLU A 419 -3.864 3.425 -3.570 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -2.692 2.391 -1.690 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -4.059 1.406 -2.171 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -2.587 -0.150 -3.351 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -1.198 0.872 -3.037 1.00 0.00 H new ATOM 756 N LEU A 420 -1.096 2.252 -4.907 1.00 0.00 N ATOM 757 CA LEU A 420 0.225 2.634 -5.390 1.00 0.00 C ATOM 758 C LEU A 420 0.132 3.845 -6.310 1.00 0.00 C ATOM 759 O LEU A 420 0.822 4.846 -6.109 1.00 0.00 O ATOM 760 CB LEU A 420 0.881 1.466 -6.126 1.00 0.00 C ATOM 761 CG LEU A 420 2.410 1.438 -6.066 1.00 0.00 C ATOM 762 CD1 LEU A 420 2.953 0.260 -6.861 1.00 0.00 C ATOM 763 CD2 LEU A 420 2.986 2.745 -6.586 1.00 0.00 C ATOM 0 H LEU A 420 -1.377 1.302 -5.152 1.00 0.00 H new ATOM 0 HA LEU A 420 0.839 2.898 -4.529 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.499 0.534 -5.709 1.00 0.00 H new ATOM 0 HB3 LEU A 420 0.574 1.497 -7.171 1.00 0.00 H new ATOM 0 HG LEU A 420 2.713 1.318 -5.026 1.00 0.00 H new ATOM 0 HD11 LEU A 420 4.042 0.256 -6.807 1.00 0.00 H new ATOM 0 HD12 LEU A 420 2.566 -0.670 -6.444 1.00 0.00 H new ATOM 0 HD13 LEU A 420 2.641 0.349 -7.902 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.074 2.708 -6.536 1.00 0.00 H new ATOM 0 HD22 LEU A 420 2.675 2.894 -7.620 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.623 3.571 -5.975 1.00 0.00 H new ATOM 775 N LEU A 421 -0.728 3.750 -7.319 1.00 0.00 N ATOM 776 CA LEU A 421 -0.917 4.840 -8.268 1.00 0.00 C ATOM 777 C LEU A 421 -1.353 6.112 -7.549 1.00 0.00 C ATOM 778 O LEU A 421 -0.903 7.209 -7.876 1.00 0.00 O ATOM 779 CB LEU A 421 -1.955 4.454 -9.323 1.00 0.00 C ATOM 780 CG LEU A 421 -1.921 5.292 -10.603 1.00 0.00 C ATOM 781 CD1 LEU A 421 -0.751 4.875 -11.481 1.00 0.00 C ATOM 782 CD2 LEU A 421 -3.232 5.158 -11.361 1.00 0.00 C ATOM 0 H LEU A 421 -1.305 2.929 -7.500 1.00 0.00 H new ATOM 0 HA LEU A 421 0.036 5.029 -8.762 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -1.809 3.407 -9.588 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -2.948 4.535 -8.880 1.00 0.00 H new ATOM 0 HG LEU A 421 -1.788 6.338 -10.328 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -0.742 5.481 -12.387 1.00 0.00 H new ATOM 0 HD12 LEU A 421 0.182 5.021 -10.937 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -0.854 3.823 -11.749 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -3.191 5.760 -12.269 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -3.394 4.113 -11.626 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -4.053 5.504 -10.733 1.00 0.00 H new ATOM 794 N GLU A 422 -2.231 5.955 -6.563 1.00 0.00 N ATOM 795 CA GLU A 422 -2.727 7.091 -5.794 1.00 0.00 C ATOM 796 C GLU A 422 -1.583 7.785 -5.061 1.00 0.00 C ATOM 797 O GLU A 422 -1.505 9.014 -5.036 1.00 0.00 O ATOM 798 CB GLU A 422 -3.787 6.631 -4.791 1.00 0.00 C ATOM 799 CG GLU A 422 -4.995 5.976 -5.442 1.00 0.00 C ATOM 800 CD GLU A 422 -6.309 6.528 -4.921 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.734 7.599 -5.401 1.00 0.00 O ATOM 802 OE2 GLU A 422 -6.911 5.887 -4.034 1.00 0.00 O ATOM 0 H GLU A 422 -2.613 5.053 -6.278 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.179 7.801 -6.486 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -3.334 5.927 -4.093 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.120 7.489 -4.207 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.946 6.123 -6.521 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -4.961 4.901 -5.264 1.00 0.00 H new ATOM 809 N LEU A 423 -0.698 6.991 -4.468 1.00 0.00 N ATOM 810 CA LEU A 423 0.444 7.529 -3.737 1.00 0.00 C ATOM 811 C LEU A 423 1.403 8.244 -4.682 1.00 0.00 C ATOM 812 O LEU A 423 1.963 9.287 -4.342 1.00 0.00 O ATOM 813 CB LEU A 423 1.180 6.408 -3.000 1.00 0.00 C ATOM 814 CG LEU A 423 1.981 6.852 -1.775 1.00 0.00 C ATOM 815 CD1 LEU A 423 2.746 5.677 -1.184 1.00 0.00 C ATOM 816 CD2 LEU A 423 2.934 7.980 -2.139 1.00 0.00 C ATOM 0 H LEU A 423 -0.749 5.972 -4.479 1.00 0.00 H new ATOM 0 HA LEU A 423 0.071 8.249 -3.009 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.451 5.661 -2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 423 1.857 5.918 -3.700 1.00 0.00 H new ATOM 0 HG LEU A 423 1.283 7.222 -1.024 1.00 0.00 H new ATOM 0 HD11 LEU A 423 3.310 6.011 -0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 423 2.044 4.899 -0.885 1.00 0.00 H new ATOM 0 HD13 LEU A 423 3.433 5.278 -1.930 1.00 0.00 H new ATOM 0 HD21 LEU A 423 3.495 8.282 -1.255 1.00 0.00 H new ATOM 0 HD22 LEU A 423 3.626 7.638 -2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 423 2.365 8.830 -2.516 1.00 0.00 H new ATOM 828 N ASP A 424 1.588 7.676 -5.868 1.00 0.00 N ATOM 829 CA ASP A 424 2.482 8.256 -6.868 1.00 0.00 C ATOM 830 C ASP A 424 2.142 9.722 -7.132 1.00 0.00 C ATOM 831 O ASP A 424 2.996 10.497 -7.566 1.00 0.00 O ATOM 832 CB ASP A 424 2.405 7.460 -8.172 1.00 0.00 C ATOM 833 CG ASP A 424 3.735 7.408 -8.897 1.00 0.00 C ATOM 834 OD1 ASP A 424 4.090 8.406 -9.559 1.00 0.00 O ATOM 835 OD2 ASP A 424 4.421 6.369 -8.804 1.00 0.00 O ATOM 0 H ASP A 424 1.131 6.813 -6.163 1.00 0.00 H new ATOM 0 HA ASP A 424 3.498 8.207 -6.476 1.00 0.00 H new ATOM 0 HB2 ASP A 424 2.072 6.445 -7.956 1.00 0.00 H new ATOM 0 HB3 ASP A 424 1.656 7.909 -8.825 1.00 0.00 H new ATOM 840 N SER A 425 0.893 10.096 -6.871 1.00 0.00 N ATOM 841 CA SER A 425 0.447 11.469 -7.086 1.00 0.00 C ATOM 842 C SER A 425 0.527 12.284 -5.798 1.00 0.00 C ATOM 843 O SER A 425 -0.340 13.115 -5.525 1.00 0.00 O ATOM 844 CB SER A 425 -0.987 11.481 -7.623 1.00 0.00 C ATOM 845 OG SER A 425 -1.209 10.398 -8.510 1.00 0.00 O ATOM 0 H SER A 425 0.173 9.469 -6.511 1.00 0.00 H new ATOM 0 HA SER A 425 1.110 11.926 -7.820 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.690 11.425 -6.792 1.00 0.00 H new ATOM 0 HB3 SER A 425 -1.178 12.422 -8.139 1.00 0.00 H new ATOM 0 HG SER A 425 -2.132 10.427 -8.837 1.00 0.00 H new ATOM 851 N VAL A 426 1.571 12.047 -5.011 1.00 0.00 N ATOM 852 CA VAL A 426 1.758 12.766 -3.755 1.00 0.00 C ATOM 853 C VAL A 426 2.446 14.107 -3.992 1.00 0.00 C ATOM 854 O VAL A 426 3.409 14.198 -4.753 1.00 0.00 O ATOM 855 CB VAL A 426 2.586 11.942 -2.748 1.00 0.00 C ATOM 856 CG1 VAL A 426 3.981 11.671 -3.294 1.00 0.00 C ATOM 857 CG2 VAL A 426 2.659 12.656 -1.404 1.00 0.00 C ATOM 0 H VAL A 426 2.299 11.364 -5.220 1.00 0.00 H new ATOM 0 HA VAL A 426 0.766 12.937 -3.336 1.00 0.00 H new ATOM 0 HB VAL A 426 2.089 10.983 -2.598 1.00 0.00 H new ATOM 0 HG11 VAL A 426 4.549 11.089 -2.568 1.00 0.00 H new ATOM 0 HG12 VAL A 426 3.904 11.113 -4.227 1.00 0.00 H new ATOM 0 HG13 VAL A 426 4.490 12.617 -3.478 1.00 0.00 H new ATOM 0 HG21 VAL A 426 3.247 12.059 -0.707 1.00 0.00 H new ATOM 0 HG22 VAL A 426 3.130 13.630 -1.535 1.00 0.00 H new ATOM 0 HG23 VAL A 426 1.652 12.790 -1.008 1.00 0.00 H new ATOM 867 N GLU A 427 1.944 15.149 -3.334 1.00 0.00 N ATOM 868 CA GLU A 427 2.511 16.485 -3.471 1.00 0.00 C ATOM 869 C GLU A 427 3.254 16.892 -2.202 1.00 0.00 C ATOM 870 O GLU A 427 2.789 17.741 -1.442 1.00 0.00 O ATOM 871 CB GLU A 427 1.409 17.499 -3.781 1.00 0.00 C ATOM 872 CG GLU A 427 0.261 17.476 -2.785 1.00 0.00 C ATOM 873 CD GLU A 427 -0.438 18.817 -2.670 1.00 0.00 C ATOM 874 OE1 GLU A 427 -0.624 19.480 -3.712 1.00 0.00 O ATOM 875 OE2 GLU A 427 -0.797 19.203 -1.538 1.00 0.00 O ATOM 0 H GLU A 427 1.146 15.093 -2.701 1.00 0.00 H new ATOM 0 HA GLU A 427 3.222 16.470 -4.297 1.00 0.00 H new ATOM 0 HB2 GLU A 427 1.842 18.499 -3.800 1.00 0.00 H new ATOM 0 HB3 GLU A 427 1.017 17.303 -4.779 1.00 0.00 H new ATOM 0 HG2 GLU A 427 -0.462 16.718 -3.087 1.00 0.00 H new ATOM 0 HG3 GLU A 427 0.640 17.183 -1.806 1.00 0.00 H new ATOM 882 N THR A 428 4.414 16.281 -1.980 1.00 0.00 N ATOM 883 CA THR A 428 5.223 16.578 -0.803 1.00 0.00 C ATOM 884 C THR A 428 5.793 17.992 -0.876 1.00 0.00 C ATOM 885 O THR A 428 5.714 18.754 0.088 1.00 0.00 O ATOM 886 CB THR A 428 6.359 15.564 -0.668 1.00 0.00 C ATOM 887 OG1 THR A 428 7.156 15.851 0.467 1.00 0.00 O ATOM 888 CG2 THR A 428 7.276 15.524 -1.874 1.00 0.00 C ATOM 0 H THR A 428 4.815 15.577 -2.600 1.00 0.00 H new ATOM 0 HA THR A 428 4.580 16.510 0.074 1.00 0.00 H new ATOM 0 HB THR A 428 5.869 14.595 -0.573 1.00 0.00 H new ATOM 0 HG1 THR A 428 7.876 15.190 0.537 1.00 0.00 H new ATOM 0 HG21 THR A 428 8.059 14.784 -1.711 1.00 0.00 H new ATOM 0 HG22 THR A 428 6.701 15.255 -2.760 1.00 0.00 H new ATOM 0 HG23 THR A 428 7.729 16.505 -2.020 1.00 0.00 H new ATOM 896 N GLY A 429 6.365 18.337 -2.025 1.00 0.00 N ATOM 897 CA GLY A 429 6.938 19.659 -2.201 1.00 0.00 C ATOM 898 C GLY A 429 8.021 19.964 -1.184 1.00 0.00 C ATOM 899 O GLY A 429 8.102 21.081 -0.671 1.00 0.00 O ATOM 0 H GLY A 429 6.442 17.725 -2.837 1.00 0.00 H new ATOM 0 HA2 GLY A 429 7.354 19.740 -3.205 1.00 0.00 H new ATOM 0 HA3 GLY A 429 6.149 20.407 -2.122 1.00 0.00 H new ATOM 903 N GLY A 430 8.852 18.970 -0.890 1.00 0.00 N ATOM 904 CA GLY A 430 9.922 19.158 0.072 1.00 0.00 C ATOM 905 C GLY A 430 9.406 19.366 1.482 1.00 0.00 C ATOM 906 O GLY A 430 9.595 20.433 2.068 1.00 0.00 O ATOM 0 H GLY A 430 8.804 18.038 -1.301 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.579 18.289 0.054 1.00 0.00 H new ATOM 0 HA3 GLY A 430 10.523 20.018 -0.222 1.00 0.00 H new ATOM 910 N GLN A 431 8.754 18.345 2.028 1.00 0.00 N ATOM 911 CA GLN A 431 8.208 18.421 3.378 1.00 0.00 C ATOM 912 C GLN A 431 8.707 17.260 4.232 1.00 0.00 C ATOM 913 O GLN A 431 8.740 16.114 3.781 1.00 0.00 O ATOM 914 CB GLN A 431 6.680 18.418 3.334 1.00 0.00 C ATOM 915 CG GLN A 431 6.032 18.528 4.706 1.00 0.00 C ATOM 916 CD GLN A 431 5.403 19.885 4.947 1.00 0.00 C ATOM 917 OE1 GLN A 431 4.772 20.457 4.058 1.00 0.00 O ATOM 918 NE2 GLN A 431 5.574 20.413 6.154 1.00 0.00 N ATOM 0 H GLN A 431 8.591 17.455 1.556 1.00 0.00 H new ATOM 0 HA GLN A 431 8.549 19.353 3.829 1.00 0.00 H new ATOM 0 HB2 GLN A 431 6.341 19.248 2.713 1.00 0.00 H new ATOM 0 HB3 GLN A 431 6.340 17.501 2.853 1.00 0.00 H new ATOM 0 HG2 GLN A 431 5.270 17.755 4.806 1.00 0.00 H new ATOM 0 HG3 GLN A 431 6.782 18.338 5.474 1.00 0.00 H new ATOM 0 HE21 GLN A 431 6.104 19.905 6.862 1.00 0.00 H new ATOM 0 HE22 GLN A 431 5.175 21.326 6.372 1.00 0.00 H new ATOM 927 N ASP A 432 9.093 17.563 5.466 1.00 0.00 N ATOM 928 CA ASP A 432 9.590 16.544 6.384 1.00 0.00 C ATOM 929 C ASP A 432 8.496 15.535 6.720 1.00 0.00 C ATOM 930 O ASP A 432 8.733 14.326 6.725 1.00 0.00 O ATOM 931 CB ASP A 432 10.112 17.195 7.667 1.00 0.00 C ATOM 932 CG ASP A 432 11.522 17.729 7.512 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.671 18.898 7.097 1.00 0.00 O ATOM 934 OD2 ASP A 432 12.477 16.980 7.805 1.00 0.00 O ATOM 0 H ASP A 432 9.072 18.506 5.854 1.00 0.00 H new ATOM 0 HA ASP A 432 10.408 16.016 5.894 1.00 0.00 H new ATOM 0 HB2 ASP A 432 9.447 18.010 7.954 1.00 0.00 H new ATOM 0 HB3 ASP A 432 10.090 16.465 8.476 1.00 0.00 H new ATOM 939 N SER A 433 7.298 16.038 6.999 1.00 0.00 N ATOM 940 CA SER A 433 6.168 15.181 7.334 1.00 0.00 C ATOM 941 C SER A 433 5.871 14.206 6.199 1.00 0.00 C ATOM 942 O SER A 433 5.866 12.990 6.395 1.00 0.00 O ATOM 943 CB SER A 433 4.929 16.025 7.634 1.00 0.00 C ATOM 944 OG SER A 433 4.345 16.518 6.440 1.00 0.00 O ATOM 0 H SER A 433 7.085 17.036 7.000 1.00 0.00 H new ATOM 0 HA SER A 433 6.431 14.608 8.223 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.200 15.425 8.178 1.00 0.00 H new ATOM 0 HB3 SER A 433 5.201 16.859 8.280 1.00 0.00 H new ATOM 0 HG SER A 433 3.554 17.053 6.659 1.00 0.00 H new ATOM 950 N VAL A 434 5.627 14.750 5.011 1.00 0.00 N ATOM 951 CA VAL A 434 5.333 13.926 3.844 1.00 0.00 C ATOM 952 C VAL A 434 6.511 13.019 3.510 1.00 0.00 C ATOM 953 O VAL A 434 6.330 11.907 3.019 1.00 0.00 O ATOM 954 CB VAL A 434 4.994 14.789 2.612 1.00 0.00 C ATOM 955 CG1 VAL A 434 4.577 13.911 1.443 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.900 15.793 2.948 1.00 0.00 C ATOM 0 H VAL A 434 5.627 15.754 4.831 1.00 0.00 H new ATOM 0 HA VAL A 434 4.465 13.317 4.095 1.00 0.00 H new ATOM 0 HB VAL A 434 5.888 15.341 2.322 1.00 0.00 H new ATOM 0 HG11 VAL A 434 4.342 14.538 0.583 1.00 0.00 H new ATOM 0 HG12 VAL A 434 5.393 13.235 1.187 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.697 13.330 1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.674 16.393 2.067 1.00 0.00 H new ATOM 0 HG22 VAL A 434 3.003 15.261 3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 434 4.239 16.444 3.753 1.00 0.00 H new ATOM 966 N ARG A 435 7.718 13.501 3.788 1.00 0.00 N ATOM 967 CA ARG A 435 8.926 12.728 3.522 1.00 0.00 C ATOM 968 C ARG A 435 8.919 11.432 4.326 1.00 0.00 C ATOM 969 O ARG A 435 9.095 10.345 3.774 1.00 0.00 O ATOM 970 CB ARG A 435 10.170 13.551 3.863 1.00 0.00 C ATOM 971 CG ARG A 435 10.786 14.246 2.660 1.00 0.00 C ATOM 972 CD ARG A 435 12.179 14.771 2.974 1.00 0.00 C ATOM 973 NE ARG A 435 13.197 13.731 2.850 1.00 0.00 N ATOM 974 CZ ARG A 435 13.703 13.324 1.688 1.00 0.00 C ATOM 975 NH1 ARG A 435 13.290 13.867 0.549 1.00 0.00 N ATOM 976 NH2 ARG A 435 14.625 12.370 1.664 1.00 0.00 N ATOM 0 H ARG A 435 7.886 14.421 4.196 1.00 0.00 H new ATOM 0 HA ARG A 435 8.948 12.480 2.461 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.907 14.300 4.610 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.915 12.897 4.316 1.00 0.00 H new ATOM 0 HG2 ARG A 435 10.838 13.550 1.823 1.00 0.00 H new ATOM 0 HG3 ARG A 435 10.146 15.072 2.348 1.00 0.00 H new ATOM 0 HD2 ARG A 435 12.417 15.593 2.299 1.00 0.00 H new ATOM 0 HD3 ARG A 435 12.195 15.175 3.986 1.00 0.00 H new ATOM 0 HE ARG A 435 13.540 13.291 3.704 1.00 0.00 H new ATOM 0 HH11 ARG A 435 12.581 14.600 0.561 1.00 0.00 H new ATOM 0 HH12 ARG A 435 13.682 13.551 -0.338 1.00 0.00 H new ATOM 0 HH21 ARG A 435 14.946 11.949 2.536 1.00 0.00 H new ATOM 0 HH22 ARG A 435 15.013 12.058 0.774 1.00 0.00 H new ATOM 990 N GLN A 436 8.708 11.556 5.633 1.00 0.00 N ATOM 991 CA GLN A 436 8.672 10.395 6.513 1.00 0.00 C ATOM 992 C GLN A 436 7.515 9.474 6.141 1.00 0.00 C ATOM 993 O GLN A 436 7.697 8.268 5.969 1.00 0.00 O ATOM 994 CB GLN A 436 8.543 10.837 7.973 1.00 0.00 C ATOM 995 CG GLN A 436 9.874 10.911 8.705 1.00 0.00 C ATOM 996 CD GLN A 436 10.035 12.195 9.493 1.00 0.00 C ATOM 997 OE1 GLN A 436 9.054 12.853 9.841 1.00 0.00 O ATOM 998 NE2 GLN A 436 11.281 12.560 9.781 1.00 0.00 N ATOM 0 H GLN A 436 8.560 12.448 6.105 1.00 0.00 H new ATOM 0 HA GLN A 436 9.606 9.846 6.392 1.00 0.00 H new ATOM 0 HB2 GLN A 436 8.064 11.816 8.007 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.887 10.143 8.498 1.00 0.00 H new ATOM 0 HG2 GLN A 436 9.960 10.061 9.381 1.00 0.00 H new ATOM 0 HG3 GLN A 436 10.687 10.828 7.983 1.00 0.00 H new ATOM 0 HE21 GLN A 436 12.065 11.985 9.473 1.00 0.00 H new ATOM 0 HE22 GLN A 436 11.453 13.415 10.310 1.00 0.00 H new ATOM 1007 N ALA A 437 6.323 10.050 6.015 1.00 0.00 N ATOM 1008 CA ALA A 437 5.136 9.282 5.659 1.00 0.00 C ATOM 1009 C ALA A 437 5.299 8.633 4.289 1.00 0.00 C ATOM 1010 O ALA A 437 4.903 7.486 4.083 1.00 0.00 O ATOM 1011 CB ALA A 437 3.903 10.172 5.680 1.00 0.00 C ATOM 0 H ALA A 437 6.154 11.046 6.154 1.00 0.00 H new ATOM 0 HA ALA A 437 5.009 8.491 6.398 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.025 9.584 5.412 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.771 10.587 6.679 1.00 0.00 H new ATOM 0 HB3 ALA A 437 4.028 10.984 4.964 1.00 0.00 H new ATOM 1017 N ARG A 438 5.887 9.375 3.355 1.00 0.00 N ATOM 1018 CA ARG A 438 6.105 8.873 2.005 1.00 0.00 C ATOM 1019 C ARG A 438 6.993 7.634 2.026 1.00 0.00 C ATOM 1020 O ARG A 438 6.570 6.549 1.628 1.00 0.00 O ATOM 1021 CB ARG A 438 6.738 9.954 1.127 1.00 0.00 C ATOM 1022 CG ARG A 438 7.001 9.505 -0.300 1.00 0.00 C ATOM 1023 CD ARG A 438 7.841 10.520 -1.059 1.00 0.00 C ATOM 1024 NE ARG A 438 8.033 10.136 -2.456 1.00 0.00 N ATOM 1025 CZ ARG A 438 8.989 10.636 -3.236 1.00 0.00 C ATOM 1026 NH1 ARG A 438 9.840 11.537 -2.761 1.00 0.00 N ATOM 1027 NH2 ARG A 438 9.094 10.233 -4.496 1.00 0.00 N ATOM 0 H ARG A 438 6.221 10.326 3.510 1.00 0.00 H new ATOM 0 HA ARG A 438 5.137 8.600 1.586 1.00 0.00 H new ATOM 0 HB2 ARG A 438 6.083 10.825 1.110 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.678 10.271 1.578 1.00 0.00 H new ATOM 0 HG2 ARG A 438 7.512 8.542 -0.291 1.00 0.00 H new ATOM 0 HG3 ARG A 438 6.053 9.357 -0.817 1.00 0.00 H new ATOM 0 HD2 ARG A 438 7.358 11.496 -1.014 1.00 0.00 H new ATOM 0 HD3 ARG A 438 8.812 10.622 -0.574 1.00 0.00 H new ATOM 0 HE ARG A 438 7.398 9.445 -2.856 1.00 0.00 H new ATOM 0 HH11 ARG A 438 9.764 11.850 -1.793 1.00 0.00 H new ATOM 0 HH12 ARG A 438 10.570 11.916 -3.364 1.00 0.00 H new ATOM 0 HH21 ARG A 438 8.443 9.541 -4.866 1.00 0.00 H new ATOM 0 HH22 ARG A 438 9.826 10.615 -5.094 1.00 0.00 H new ATOM 1041 N LYS A 439 8.225 7.801 2.496 1.00 0.00 N ATOM 1042 CA LYS A 439 9.174 6.693 2.572 1.00 0.00 C ATOM 1043 C LYS A 439 8.561 5.505 3.307 1.00 0.00 C ATOM 1044 O LYS A 439 8.698 4.359 2.880 1.00 0.00 O ATOM 1045 CB LYS A 439 10.457 7.139 3.277 1.00 0.00 C ATOM 1046 CG LYS A 439 11.720 6.566 2.657 1.00 0.00 C ATOM 1047 CD LYS A 439 12.370 7.553 1.701 1.00 0.00 C ATOM 1048 CE LYS A 439 11.861 7.371 0.281 1.00 0.00 C ATOM 1049 NZ LYS A 439 12.372 8.430 -0.632 1.00 0.00 N ATOM 0 H LYS A 439 8.591 8.693 2.830 1.00 0.00 H new ATOM 0 HA LYS A 439 9.417 6.383 1.556 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.514 8.227 3.257 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.409 6.841 4.324 1.00 0.00 H new ATOM 0 HG2 LYS A 439 12.426 6.303 3.445 1.00 0.00 H new ATOM 0 HG3 LYS A 439 11.480 5.646 2.124 1.00 0.00 H new ATOM 0 HD2 LYS A 439 12.167 8.571 2.034 1.00 0.00 H new ATOM 0 HD3 LYS A 439 13.452 7.421 1.720 1.00 0.00 H new ATOM 0 HE2 LYS A 439 12.166 6.393 -0.091 1.00 0.00 H new ATOM 0 HE3 LYS A 439 10.771 7.387 0.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 12.002 8.270 -1.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 12.060 9.362 -0.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 13.411 8.399 -0.652 1.00 0.00 H new ATOM 1063 N GLU A 440 7.878 5.789 4.411 1.00 0.00 N ATOM 1064 CA GLU A 440 7.237 4.747 5.203 1.00 0.00 C ATOM 1065 C GLU A 440 6.186 4.014 4.375 1.00 0.00 C ATOM 1066 O GLU A 440 6.207 2.786 4.270 1.00 0.00 O ATOM 1067 CB GLU A 440 6.595 5.352 6.454 1.00 0.00 C ATOM 1068 CG GLU A 440 5.872 4.336 7.322 1.00 0.00 C ATOM 1069 CD GLU A 440 4.531 4.841 7.821 1.00 0.00 C ATOM 1070 OE1 GLU A 440 3.908 5.661 7.115 1.00 0.00 O ATOM 1071 OE2 GLU A 440 4.106 4.416 8.914 1.00 0.00 O ATOM 0 H GLU A 440 7.754 6.733 4.777 1.00 0.00 H new ATOM 0 HA GLU A 440 7.998 4.030 5.509 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.368 5.840 7.048 1.00 0.00 H new ATOM 0 HB3 GLU A 440 5.889 6.126 6.151 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.721 3.419 6.752 1.00 0.00 H new ATOM 0 HG3 GLU A 440 6.500 4.081 8.176 1.00 0.00 H new ATOM 1078 N ALA A 441 5.269 4.775 3.786 1.00 0.00 N ATOM 1079 CA ALA A 441 4.212 4.200 2.964 1.00 0.00 C ATOM 1080 C ALA A 441 4.798 3.416 1.794 1.00 0.00 C ATOM 1081 O ALA A 441 4.382 2.290 1.519 1.00 0.00 O ATOM 1082 CB ALA A 441 3.283 5.292 2.457 1.00 0.00 C ATOM 0 H ALA A 441 5.237 5.792 3.863 1.00 0.00 H new ATOM 0 HA ALA A 441 3.637 3.510 3.582 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.499 4.847 1.845 1.00 0.00 H new ATOM 0 HB2 ALA A 441 2.832 5.809 3.304 1.00 0.00 H new ATOM 0 HB3 ALA A 441 3.851 6.004 1.858 1.00 0.00 H new ATOM 1088 N VAL A 442 5.770 4.015 1.112 1.00 0.00 N ATOM 1089 CA VAL A 442 6.416 3.368 -0.023 1.00 0.00 C ATOM 1090 C VAL A 442 7.034 2.039 0.395 1.00 0.00 C ATOM 1091 O VAL A 442 6.975 1.053 -0.343 1.00 0.00 O ATOM 1092 CB VAL A 442 7.509 4.263 -0.638 1.00 0.00 C ATOM 1093 CG1 VAL A 442 8.065 3.632 -1.906 1.00 0.00 C ATOM 1094 CG2 VAL A 442 6.963 5.654 -0.925 1.00 0.00 C ATOM 0 H VAL A 442 6.127 4.946 1.326 1.00 0.00 H new ATOM 0 HA VAL A 442 5.645 3.193 -0.773 1.00 0.00 H new ATOM 0 HB VAL A 442 8.322 4.357 0.082 1.00 0.00 H new ATOM 0 HG11 VAL A 442 8.836 4.278 -2.326 1.00 0.00 H new ATOM 0 HG12 VAL A 442 8.496 2.659 -1.669 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.262 3.506 -2.632 1.00 0.00 H new ATOM 0 HG21 VAL A 442 7.750 6.271 -1.359 1.00 0.00 H new ATOM 0 HG22 VAL A 442 6.131 5.581 -1.626 1.00 0.00 H new ATOM 0 HG23 VAL A 442 6.617 6.108 0.004 1.00 0.00 H new ATOM 1104 N CYS A 443 7.618 2.016 1.587 1.00 0.00 N ATOM 1105 CA CYS A 443 8.236 0.805 2.110 1.00 0.00 C ATOM 1106 C CYS A 443 7.181 -0.268 2.349 1.00 0.00 C ATOM 1107 O CYS A 443 7.369 -1.427 1.985 1.00 0.00 O ATOM 1108 CB CYS A 443 8.983 1.105 3.411 1.00 0.00 C ATOM 1109 SG CYS A 443 10.477 0.116 3.649 1.00 0.00 S ATOM 0 H CYS A 443 7.676 2.822 2.209 1.00 0.00 H new ATOM 0 HA CYS A 443 8.950 0.438 1.373 1.00 0.00 H new ATOM 0 HB2 CYS A 443 9.253 2.161 3.427 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.310 0.935 4.251 1.00 0.00 H new ATOM 0 HG CYS A 443 11.039 0.443 4.774 1.00 0.00 H new ATOM 1115 N LYS A 444 6.070 0.132 2.962 1.00 0.00 N ATOM 1116 CA LYS A 444 4.976 -0.787 3.248 1.00 0.00 C ATOM 1117 C LYS A 444 4.383 -1.349 1.961 1.00 0.00 C ATOM 1118 O LYS A 444 4.379 -2.561 1.748 1.00 0.00 O ATOM 1119 CB LYS A 444 3.887 -0.081 4.058 1.00 0.00 C ATOM 1120 CG LYS A 444 3.050 -1.026 4.905 1.00 0.00 C ATOM 1121 CD LYS A 444 3.549 -1.080 6.340 1.00 0.00 C ATOM 1122 CE LYS A 444 2.397 -1.153 7.329 1.00 0.00 C ATOM 1123 NZ LYS A 444 1.509 0.039 7.238 1.00 0.00 N ATOM 0 H LYS A 444 5.905 1.090 3.270 1.00 0.00 H new ATOM 0 HA LYS A 444 5.377 -1.615 3.833 1.00 0.00 H new ATOM 0 HB2 LYS A 444 4.352 0.661 4.708 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.231 0.460 3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 444 2.009 -0.702 4.893 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.078 -2.026 4.471 1.00 0.00 H new ATOM 0 HD2 LYS A 444 4.196 -1.948 6.469 1.00 0.00 H new ATOM 0 HD3 LYS A 444 4.154 -0.198 6.549 1.00 0.00 H new ATOM 0 HE2 LYS A 444 1.814 -2.055 7.141 1.00 0.00 H new ATOM 0 HE3 LYS A 444 2.793 -1.234 8.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 1.086 0.229 8.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 2.065 0.864 6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 0.755 -0.142 6.545 1.00 0.00 H new ATOM 1137 N ILE A 445 3.885 -0.463 1.099 1.00 0.00 N ATOM 1138 CA ILE A 445 3.295 -0.883 -0.169 1.00 0.00 C ATOM 1139 C ILE A 445 4.242 -1.812 -0.924 1.00 0.00 C ATOM 1140 O ILE A 445 3.844 -2.884 -1.379 1.00 0.00 O ATOM 1141 CB ILE A 445 2.938 0.321 -1.065 1.00 0.00 C ATOM 1142 CG1 ILE A 445 4.124 1.278 -1.184 1.00 0.00 C ATOM 1143 CG2 ILE A 445 1.720 1.046 -0.514 1.00 0.00 C ATOM 1144 CD1 ILE A 445 4.922 1.098 -2.457 1.00 0.00 C ATOM 0 H ILE A 445 3.879 0.545 1.255 1.00 0.00 H new ATOM 0 HA ILE A 445 2.375 -1.416 0.071 1.00 0.00 H new ATOM 0 HB ILE A 445 2.700 -0.050 -2.062 1.00 0.00 H new ATOM 0 HG12 ILE A 445 3.759 2.304 -1.136 1.00 0.00 H new ATOM 0 HG13 ILE A 445 4.784 1.134 -0.328 1.00 0.00 H new ATOM 0 HG21 ILE A 445 1.480 1.893 -1.156 1.00 0.00 H new ATOM 0 HG22 ILE A 445 0.872 0.362 -0.484 1.00 0.00 H new ATOM 0 HG23 ILE A 445 1.934 1.403 0.493 1.00 0.00 H new ATOM 0 HD11 ILE A 445 5.747 1.810 -2.473 1.00 0.00 H new ATOM 0 HD12 ILE A 445 5.318 0.083 -2.498 1.00 0.00 H new ATOM 0 HD13 ILE A 445 4.277 1.271 -3.318 1.00 0.00 H new ATOM 1156 N GLN A 446 5.502 -1.403 -1.034 1.00 0.00 N ATOM 1157 CA GLN A 446 6.503 -2.216 -1.710 1.00 0.00 C ATOM 1158 C GLN A 446 6.775 -3.480 -0.904 1.00 0.00 C ATOM 1159 O GLN A 446 7.078 -4.536 -1.459 1.00 0.00 O ATOM 1160 CB GLN A 446 7.798 -1.423 -1.902 1.00 0.00 C ATOM 1161 CG GLN A 446 8.813 -2.121 -2.791 1.00 0.00 C ATOM 1162 CD GLN A 446 9.518 -1.164 -3.732 1.00 0.00 C ATOM 1163 OE1 GLN A 446 9.471 0.053 -3.550 1.00 0.00 O ATOM 1164 NE2 GLN A 446 10.178 -1.711 -4.746 1.00 0.00 N ATOM 0 H GLN A 446 5.851 -0.518 -0.666 1.00 0.00 H new ATOM 0 HA GLN A 446 6.122 -2.495 -2.692 1.00 0.00 H new ATOM 0 HB2 GLN A 446 7.558 -0.451 -2.333 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.248 -1.237 -0.927 1.00 0.00 H new ATOM 0 HG2 GLN A 446 9.553 -2.623 -2.167 1.00 0.00 H new ATOM 0 HG3 GLN A 446 8.310 -2.893 -3.373 1.00 0.00 H new ATOM 0 HE21 GLN A 446 10.191 -2.725 -4.859 1.00 0.00 H new ATOM 0 HE22 GLN A 446 10.672 -1.118 -5.412 1.00 0.00 H new ATOM 1173 N ALA A 447 6.650 -3.358 0.417 1.00 0.00 N ATOM 1174 CA ALA A 447 6.868 -4.481 1.317 1.00 0.00 C ATOM 1175 C ALA A 447 5.791 -5.542 1.122 1.00 0.00 C ATOM 1176 O ALA A 447 6.091 -6.724 0.958 1.00 0.00 O ATOM 1177 CB ALA A 447 6.883 -3.999 2.761 1.00 0.00 C ATOM 0 H ALA A 447 6.398 -2.488 0.885 1.00 0.00 H new ATOM 0 HA ALA A 447 7.835 -4.929 1.086 1.00 0.00 H new ATOM 0 HB1 ALA A 447 7.047 -4.847 3.426 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.685 -3.273 2.894 1.00 0.00 H new ATOM 0 HB3 ALA A 447 5.928 -3.531 2.998 1.00 0.00 H new ATOM 1183 N ILE A 448 4.534 -5.105 1.131 1.00 0.00 N ATOM 1184 CA ILE A 448 3.409 -6.012 0.946 1.00 0.00 C ATOM 1185 C ILE A 448 3.443 -6.630 -0.448 1.00 0.00 C ATOM 1186 O ILE A 448 3.143 -7.811 -0.623 1.00 0.00 O ATOM 1187 CB ILE A 448 2.064 -5.285 1.158 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.892 -6.250 0.962 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.945 -4.099 0.215 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.453 -5.633 1.281 1.00 0.00 C ATOM 0 H ILE A 448 4.271 -4.129 1.265 1.00 0.00 H new ATOM 0 HA ILE A 448 3.497 -6.802 1.692 1.00 0.00 H new ATOM 0 HB ILE A 448 2.032 -4.914 2.182 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.888 -6.600 -0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 448 1.041 -7.125 1.594 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.991 -3.598 0.379 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.759 -3.400 0.406 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.000 -4.447 -0.816 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.239 -6.371 1.121 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.467 -5.308 2.321 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.623 -4.775 0.631 1.00 0.00 H new ATOM 1202 N LEU A 449 3.817 -5.824 -1.439 1.00 0.00 N ATOM 1203 CA LEU A 449 3.898 -6.294 -2.815 1.00 0.00 C ATOM 1204 C LEU A 449 4.909 -7.431 -2.934 1.00 0.00 C ATOM 1205 O LEU A 449 4.582 -8.522 -3.404 1.00 0.00 O ATOM 1206 CB LEU A 449 4.284 -5.145 -3.750 1.00 0.00 C ATOM 1207 CG LEU A 449 3.348 -4.938 -4.942 1.00 0.00 C ATOM 1208 CD1 LEU A 449 2.007 -4.393 -4.478 1.00 0.00 C ATOM 1209 CD2 LEU A 449 3.983 -4.004 -5.960 1.00 0.00 C ATOM 0 H LEU A 449 4.068 -4.844 -1.312 1.00 0.00 H new ATOM 0 HA LEU A 449 2.917 -6.669 -3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.320 -4.222 -3.171 1.00 0.00 H new ATOM 0 HB3 LEU A 449 5.291 -5.325 -4.125 1.00 0.00 H new ATOM 0 HG LEU A 449 3.178 -5.903 -5.420 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.354 -4.252 -5.339 1.00 0.00 H new ATOM 0 HD12 LEU A 449 1.547 -5.098 -3.786 1.00 0.00 H new ATOM 0 HD13 LEU A 449 2.157 -3.437 -3.976 1.00 0.00 H new ATOM 0 HD21 LEU A 449 3.304 -3.867 -6.802 1.00 0.00 H new ATOM 0 HD22 LEU A 449 4.182 -3.039 -5.494 1.00 0.00 H new ATOM 0 HD23 LEU A 449 4.919 -4.435 -6.315 1.00 0.00 H new ATOM 1221 N GLU A 450 6.138 -7.171 -2.495 1.00 0.00 N ATOM 1222 CA GLU A 450 7.192 -8.177 -2.545 1.00 0.00 C ATOM 1223 C GLU A 450 6.805 -9.398 -1.719 1.00 0.00 C ATOM 1224 O GLU A 450 7.103 -10.534 -2.092 1.00 0.00 O ATOM 1225 CB GLU A 450 8.512 -7.593 -2.033 1.00 0.00 C ATOM 1226 CG GLU A 450 8.483 -7.217 -0.560 1.00 0.00 C ATOM 1227 CD GLU A 450 9.850 -6.835 -0.030 1.00 0.00 C ATOM 1228 OE1 GLU A 450 10.548 -6.045 -0.700 1.00 0.00 O ATOM 1229 OE2 GLU A 450 10.224 -7.327 1.056 1.00 0.00 O ATOM 0 H GLU A 450 6.427 -6.275 -2.102 1.00 0.00 H new ATOM 0 HA GLU A 450 7.323 -8.485 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 450 9.308 -8.319 -2.198 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.760 -6.709 -2.620 1.00 0.00 H new ATOM 0 HG2 GLU A 450 7.795 -6.384 -0.415 1.00 0.00 H new ATOM 0 HG3 GLU A 450 8.095 -8.056 0.018 1.00 0.00 H new ATOM 1236 N LYS A 451 6.133 -9.156 -0.597 1.00 0.00 N ATOM 1237 CA LYS A 451 5.697 -10.236 0.281 1.00 0.00 C ATOM 1238 C LYS A 451 4.770 -11.189 -0.464 1.00 0.00 C ATOM 1239 O LYS A 451 4.922 -12.407 -0.387 1.00 0.00 O ATOM 1240 CB LYS A 451 4.987 -9.668 1.510 1.00 0.00 C ATOM 1241 CG LYS A 451 4.518 -10.733 2.487 1.00 0.00 C ATOM 1242 CD LYS A 451 5.494 -10.900 3.641 1.00 0.00 C ATOM 1243 CE LYS A 451 4.851 -11.621 4.815 1.00 0.00 C ATOM 1244 NZ LYS A 451 5.436 -11.194 6.116 1.00 0.00 N ATOM 0 H LYS A 451 5.879 -8.222 -0.275 1.00 0.00 H new ATOM 0 HA LYS A 451 6.577 -10.790 0.607 1.00 0.00 H new ATOM 0 HB2 LYS A 451 5.662 -8.985 2.026 1.00 0.00 H new ATOM 0 HB3 LYS A 451 4.128 -9.082 1.184 1.00 0.00 H new ATOM 0 HG2 LYS A 451 3.536 -10.464 2.876 1.00 0.00 H new ATOM 0 HG3 LYS A 451 4.405 -11.683 1.965 1.00 0.00 H new ATOM 0 HD2 LYS A 451 6.366 -11.459 3.303 1.00 0.00 H new ATOM 0 HD3 LYS A 451 5.848 -9.921 3.964 1.00 0.00 H new ATOM 0 HE2 LYS A 451 3.779 -11.426 4.818 1.00 0.00 H new ATOM 0 HE3 LYS A 451 4.979 -12.697 4.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 4.971 -11.708 6.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 6.455 -11.403 6.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 5.291 -10.172 6.243 1.00 0.00 H new ATOM 1258 N LEU A 452 3.809 -10.625 -1.191 1.00 0.00 N ATOM 1259 CA LEU A 452 2.861 -11.425 -1.954 1.00 0.00 C ATOM 1260 C LEU A 452 3.573 -12.184 -3.070 1.00 0.00 C ATOM 1261 O LEU A 452 3.340 -13.375 -3.271 1.00 0.00 O ATOM 1262 CB LEU A 452 1.764 -10.534 -2.547 1.00 0.00 C ATOM 1263 CG LEU A 452 0.482 -10.442 -1.718 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.564 -9.617 -2.450 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.055 -11.833 -1.400 1.00 0.00 C ATOM 0 H LEU A 452 3.668 -9.618 -1.266 1.00 0.00 H new ATOM 0 HA LEU A 452 2.403 -12.146 -1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 452 2.166 -9.529 -2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 452 1.510 -10.908 -3.539 1.00 0.00 H new ATOM 0 HG LEU A 452 0.716 -9.945 -0.776 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.470 -9.561 -1.847 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.180 -8.612 -2.622 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.793 -10.086 -3.407 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -0.967 -11.745 -0.810 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -0.273 -12.360 -2.329 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.691 -12.390 -0.834 1.00 0.00 H new ATOM 1277 N GLU A 453 4.442 -11.482 -3.790 1.00 0.00 N ATOM 1278 CA GLU A 453 5.191 -12.088 -4.885 1.00 0.00 C ATOM 1279 C GLU A 453 6.059 -13.236 -4.382 1.00 0.00 C ATOM 1280 O GLU A 453 6.285 -14.214 -5.094 1.00 0.00 O ATOM 1281 CB GLU A 453 6.062 -11.038 -5.577 1.00 0.00 C ATOM 1282 CG GLU A 453 5.266 -9.935 -6.254 1.00 0.00 C ATOM 1283 CD GLU A 453 6.149 -8.929 -6.965 1.00 0.00 C ATOM 1284 OE1 GLU A 453 7.183 -8.533 -6.386 1.00 0.00 O ATOM 1285 OE2 GLU A 453 5.808 -8.536 -8.100 1.00 0.00 O ATOM 0 H GLU A 453 4.645 -10.494 -3.635 1.00 0.00 H new ATOM 0 HA GLU A 453 4.476 -12.487 -5.604 1.00 0.00 H new ATOM 0 HB2 GLU A 453 6.731 -10.592 -4.841 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.688 -11.531 -6.321 1.00 0.00 H new ATOM 0 HG2 GLU A 453 4.576 -10.379 -6.972 1.00 0.00 H new ATOM 0 HG3 GLU A 453 4.661 -9.419 -5.508 1.00 0.00 H new ATOM 1292 N LYS A 454 6.543 -13.109 -3.150 1.00 0.00 N ATOM 1293 CA LYS A 454 7.388 -14.138 -2.552 1.00 0.00 C ATOM 1294 C LYS A 454 6.542 -15.249 -1.934 1.00 0.00 C ATOM 1295 O LYS A 454 6.791 -16.432 -2.165 1.00 0.00 O ATOM 1296 CB LYS A 454 8.299 -13.524 -1.489 1.00 0.00 C ATOM 1297 CG LYS A 454 9.651 -14.207 -1.378 1.00 0.00 C ATOM 1298 CD LYS A 454 9.565 -15.482 -0.555 1.00 0.00 C ATOM 1299 CE LYS A 454 10.465 -16.570 -1.120 1.00 0.00 C ATOM 1300 NZ LYS A 454 10.126 -17.912 -0.568 1.00 0.00 N ATOM 0 H LYS A 454 6.365 -12.306 -2.547 1.00 0.00 H new ATOM 0 HA LYS A 454 8.002 -14.571 -3.341 1.00 0.00 H new ATOM 0 HB2 LYS A 454 8.452 -12.470 -1.719 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.798 -13.570 -0.522 1.00 0.00 H new ATOM 0 HG2 LYS A 454 10.025 -14.441 -2.375 1.00 0.00 H new ATOM 0 HG3 LYS A 454 10.368 -13.525 -0.921 1.00 0.00 H new ATOM 0 HD2 LYS A 454 9.850 -15.271 0.476 1.00 0.00 H new ATOM 0 HD3 LYS A 454 8.534 -15.835 -0.535 1.00 0.00 H new ATOM 0 HE2 LYS A 454 10.373 -16.590 -2.206 1.00 0.00 H new ATOM 0 HE3 LYS A 454 11.505 -16.336 -0.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 10.761 -18.626 -0.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 10.238 -17.901 0.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 9.141 -18.147 -0.807 1.00 0.00 H new ATOM 1314 N LYS A 455 5.545 -14.859 -1.148 1.00 0.00 N ATOM 1315 CA LYS A 455 4.665 -15.823 -0.496 1.00 0.00 C ATOM 1316 C LYS A 455 3.816 -16.568 -1.522 1.00 0.00 C ATOM 1317 O LYS A 455 3.521 -17.751 -1.358 1.00 0.00 O ATOM 1318 CB LYS A 455 3.760 -15.118 0.516 1.00 0.00 C ATOM 1319 CG LYS A 455 3.516 -15.924 1.781 1.00 0.00 C ATOM 1320 CD LYS A 455 2.154 -15.620 2.383 1.00 0.00 C ATOM 1321 CE LYS A 455 2.260 -14.630 3.531 1.00 0.00 C ATOM 1322 NZ LYS A 455 1.162 -14.807 4.521 1.00 0.00 N ATOM 0 H LYS A 455 5.326 -13.883 -0.947 1.00 0.00 H new ATOM 0 HA LYS A 455 5.288 -16.548 0.028 1.00 0.00 H new ATOM 0 HB2 LYS A 455 4.207 -14.161 0.786 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.802 -14.900 0.044 1.00 0.00 H new ATOM 0 HG2 LYS A 455 3.585 -16.988 1.554 1.00 0.00 H new ATOM 0 HG3 LYS A 455 4.295 -15.702 2.511 1.00 0.00 H new ATOM 0 HD2 LYS A 455 1.497 -15.216 1.613 1.00 0.00 H new ATOM 0 HD3 LYS A 455 1.698 -16.544 2.739 1.00 0.00 H new ATOM 0 HE2 LYS A 455 3.221 -14.754 4.029 1.00 0.00 H new ATOM 0 HE3 LYS A 455 2.234 -13.614 3.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 1.530 -14.645 5.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 0.402 -14.126 4.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 0.786 -15.774 4.453 1.00 0.00 H new ATOM 1336 N GLY A 456 3.429 -15.865 -2.581 1.00 0.00 N ATOM 1337 CA GLY A 456 2.618 -16.476 -3.619 1.00 0.00 C ATOM 1338 C GLY A 456 3.422 -16.823 -4.856 1.00 0.00 C ATOM 1339 O GLY A 456 4.098 -17.873 -4.847 1.00 0.00 O ATOM 1340 OXT GLY A 456 3.376 -16.047 -5.832 1.00 0.00 O ATOM 0 H GLY A 456 3.662 -14.885 -2.739 1.00 0.00 H new ATOM 0 HA2 GLY A 456 2.153 -17.380 -3.227 1.00 0.00 H new ATOM 0 HA3 GLY A 456 1.812 -15.796 -3.893 1.00 0.00 H new