USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 652 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 619 CYS SG : rot 35:sc= -6.1! USER MOD Set 1.2: A 633 GLN : amide:sc= -1.48 K(o=-7.6,f=-8.6) USER MOD Single : A 559 CYS SG : rot 10:sc= 0.656 USER MOD Single : A 561 MET CE :methyl -155:sc= -1.05 (180deg=-1.62!) USER MOD Single : A 562 HIS : no HD1:sc= -0.532 K(o=-0.53,f=-1.3) USER MOD Single : A 564 TYR OH : rot -17:sc= 0.241 USER MOD Single : A 565 MET CE :methyl -121:sc= -4.15! (180deg=-9.81!) USER MOD Single : A 566 SER OG : rot -43:sc= -0.691 USER MOD Single : A 567 LYS NZ :NH3+ -162:sc= 1.97 (180deg=1.54) USER MOD Single : A 580 TYR OH : rot 180:sc= 0 USER MOD Single : A 582 TYR OH : rot 180:sc= -0.414 USER MOD Single : A 586 ASN : amide:sc= -5.18! C(o=-5.2!,f=-6.4!) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0.0147 USER MOD Single : A 603 MET CE :methyl 153:sc= -12.1! (180deg=-13.4!) USER MOD Single : A 607 GLN : amide:sc= -0.0408 X(o=-0.041,f=-0.21) USER MOD Single : A 608 SER OG : rot 46:sc= 1.13 USER MOD Single : A 612 THR OG1 : rot 180:sc= -0.593 USER MOD Single : A 613 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 615 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 618 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 623 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 628 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 629 GLN : amide:sc= -0.256 K(o=-0.26,f=-2.5!) USER MOD Single : A 634 CYS SG : rot 170:sc= -0.601 USER MOD Single : A 636 SER OG : rot -140:sc= -1.14 USER MOD Single : A 642 GLN : amide:sc= -0.387 K(o=-0.39,f=-2.7!) USER MOD Single : A 644 LYS NZ :NH3+ -152:sc= -9.7! (180deg=-13.8!) USER MOD Single : A 645 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 651 TYR OH : rot -15:sc= -4.16! USER MOD Single : A 655 GLN : amide:sc= -2.74! C(o=-2.7!,f=-2!) USER MOD ----------------------------------------------------------------- ATOM 96 N CYS A 559 -13.578 -6.130 0.258 1.00 1.00 N ATOM 97 CA CYS A 559 -14.695 -6.101 1.189 1.00 1.00 C ATOM 98 C CYS A 559 -14.202 -6.601 2.548 1.00 1.00 C ATOM 99 O CYS A 559 -13.393 -7.526 2.618 1.00 1.00 O ATOM 100 CB CYS A 559 -15.880 -6.923 0.674 1.00 1.00 C ATOM 101 SG CYS A 559 -17.357 -6.603 1.706 1.00 1.00 S ATOM 0 HA CYS A 559 -15.061 -5.079 1.291 1.00 1.00 H new ATOM 0 HB2 CYS A 559 -16.089 -6.665 -0.364 1.00 1.00 H new ATOM 0 HB3 CYS A 559 -15.634 -7.985 0.696 1.00 1.00 H new ATOM 0 HG CYS A 559 -17.123 -5.601 2.500 1.00 1.00 H new ATOM 107 N ILE A 560 -14.708 -5.967 3.594 1.00 1.00 N ATOM 108 CA ILE A 560 -14.330 -6.335 4.947 1.00 1.00 C ATOM 109 C ILE A 560 -15.245 -7.457 5.442 1.00 1.00 C ATOM 110 O ILE A 560 -14.769 -8.517 5.847 1.00 1.00 O ATOM 111 CB ILE A 560 -14.321 -5.103 5.856 1.00 1.00 C ATOM 112 CG1 ILE A 560 -13.358 -4.039 5.328 1.00 1.00 C ATOM 113 CG2 ILE A 560 -14.010 -5.491 7.302 1.00 1.00 C ATOM 114 CD1 ILE A 560 -13.864 -2.632 5.650 1.00 1.00 C ATOM 0 H ILE A 560 -15.377 -5.200 3.532 1.00 1.00 H new ATOM 0 HA ILE A 560 -13.312 -6.723 4.964 1.00 1.00 H new ATOM 0 HB ILE A 560 -15.319 -4.665 5.848 1.00 1.00 H new ATOM 0 HG12 ILE A 560 -12.372 -4.185 5.770 1.00 1.00 H new ATOM 0 HG13 ILE A 560 -13.244 -4.150 4.250 1.00 1.00 H new ATOM 0 HG21 ILE A 560 -14.010 -4.598 7.926 1.00 1.00 H new ATOM 0 HG22 ILE A 560 -14.768 -6.186 7.663 1.00 1.00 H new ATOM 0 HG23 ILE A 560 -13.030 -5.966 7.348 1.00 1.00 H new ATOM 0 HD11 ILE A 560 -13.160 -1.895 5.263 1.00 1.00 H new ATOM 0 HD12 ILE A 560 -14.839 -2.481 5.187 1.00 1.00 H new ATOM 0 HD13 ILE A 560 -13.954 -2.516 6.730 1.00 1.00 H new ATOM 126 N MET A 561 -16.540 -7.185 5.392 1.00 1.00 N ATOM 127 CA MET A 561 -17.527 -8.159 5.829 1.00 1.00 C ATOM 128 C MET A 561 -18.793 -8.079 4.975 1.00 1.00 C ATOM 129 O MET A 561 -19.105 -7.028 4.416 1.00 1.00 O ATOM 130 CB MET A 561 -17.883 -7.901 7.295 1.00 1.00 C ATOM 131 CG MET A 561 -18.047 -9.217 8.058 1.00 1.00 C ATOM 132 SD MET A 561 -16.494 -9.689 8.802 1.00 1.00 S ATOM 133 CE MET A 561 -17.094 -10.581 10.228 1.00 1.00 C ATOM 0 H MET A 561 -16.930 -6.304 5.056 1.00 1.00 H new ATOM 0 HA MET A 561 -17.100 -9.156 5.718 1.00 1.00 H new ATOM 0 HB2 MET A 561 -17.103 -7.300 7.762 1.00 1.00 H new ATOM 0 HB3 MET A 561 -18.807 -7.325 7.353 1.00 1.00 H new ATOM 0 HG2 MET A 561 -18.810 -9.108 8.828 1.00 1.00 H new ATOM 0 HG3 MET A 561 -18.388 -10.000 7.380 1.00 1.00 H new ATOM 0 HE1 MET A 561 -16.338 -10.563 11.013 1.00 1.00 H new ATOM 0 HE2 MET A 561 -18.007 -10.111 10.593 1.00 1.00 H new ATOM 0 HE3 MET A 561 -17.304 -11.614 9.949 1.00 1.00 H new ATOM 143 N HIS A 562 -19.489 -9.204 4.898 1.00 1.00 N ATOM 144 CA HIS A 562 -20.714 -9.275 4.121 1.00 1.00 C ATOM 145 C HIS A 562 -21.642 -10.333 4.720 1.00 1.00 C ATOM 146 O HIS A 562 -21.234 -11.099 5.592 1.00 1.00 O ATOM 147 CB HIS A 562 -20.406 -9.524 2.643 1.00 1.00 C ATOM 148 CG HIS A 562 -19.588 -10.767 2.388 1.00 1.00 C ATOM 149 ND1 HIS A 562 -18.344 -10.977 2.958 1.00 1.00 N ATOM 150 CD2 HIS A 562 -19.847 -11.863 1.618 1.00 1.00 C ATOM 151 CE1 HIS A 562 -17.886 -12.149 2.543 1.00 1.00 C ATOM 152 NE2 HIS A 562 -18.819 -12.697 1.713 1.00 1.00 N ATOM 0 H HIS A 562 -19.227 -10.074 5.362 1.00 1.00 H new ATOM 0 HA HIS A 562 -21.234 -8.318 4.168 1.00 1.00 H new ATOM 0 HB2 HIS A 562 -21.345 -9.600 2.094 1.00 1.00 H new ATOM 0 HB3 HIS A 562 -19.872 -8.662 2.243 1.00 1.00 H new ATOM 0 HD2 HIS A 562 -20.738 -12.025 1.030 1.00 1.00 H new ATOM 0 HE1 HIS A 562 -16.939 -12.593 2.815 1.00 1.00 H new ATOM 0 HE2 HIS A 562 -18.740 -13.599 1.243 1.00 1.00 H new ATOM 160 N GLY A 563 -22.873 -10.343 4.228 1.00 1.00 N ATOM 161 CA GLY A 563 -23.861 -11.295 4.704 1.00 1.00 C ATOM 162 C GLY A 563 -25.226 -10.627 4.881 1.00 1.00 C ATOM 163 O GLY A 563 -25.495 -9.587 4.280 1.00 1.00 O ATOM 0 H GLY A 563 -23.208 -9.707 3.505 1.00 1.00 H new ATOM 0 HA2 GLY A 563 -23.945 -12.121 3.998 1.00 1.00 H new ATOM 0 HA3 GLY A 563 -23.534 -11.720 5.653 1.00 1.00 H new ATOM 167 N TYR A 564 -26.053 -11.249 5.707 1.00 1.00 N ATOM 168 CA TYR A 564 -27.382 -10.727 5.970 1.00 1.00 C ATOM 169 C TYR A 564 -27.381 -9.816 7.199 1.00 1.00 C ATOM 170 O TYR A 564 -26.916 -10.208 8.268 1.00 1.00 O ATOM 171 CB TYR A 564 -28.264 -11.946 6.256 1.00 1.00 C ATOM 172 CG TYR A 564 -29.706 -11.798 5.764 1.00 1.00 C ATOM 173 CD1 TYR A 564 -30.204 -10.550 5.450 1.00 1.00 C ATOM 174 CD2 TYR A 564 -30.507 -12.914 5.633 1.00 1.00 C ATOM 175 CE1 TYR A 564 -31.560 -10.411 4.988 1.00 1.00 C ATOM 176 CE2 TYR A 564 -31.864 -12.775 5.171 1.00 1.00 C ATOM 177 CZ TYR A 564 -32.323 -11.532 4.871 1.00 1.00 C ATOM 178 OH TYR A 564 -33.605 -11.401 4.435 1.00 1.00 O ATOM 0 H TYR A 564 -25.828 -12.111 6.204 1.00 1.00 H new ATOM 0 HA TYR A 564 -27.738 -10.141 5.123 1.00 1.00 H new ATOM 0 HB2 TYR A 564 -27.818 -12.823 5.786 1.00 1.00 H new ATOM 0 HB3 TYR A 564 -28.274 -12.131 7.330 1.00 1.00 H new ATOM 0 HD1 TYR A 564 -29.576 -9.677 5.551 1.00 1.00 H new ATOM 0 HD2 TYR A 564 -30.117 -13.891 5.877 1.00 1.00 H new ATOM 0 HE1 TYR A 564 -31.963 -9.440 4.740 1.00 1.00 H new ATOM 0 HE2 TYR A 564 -32.502 -13.640 5.065 1.00 1.00 H new ATOM 0 HH TYR A 564 -33.885 -10.466 4.519 1.00 1.00 H new ATOM 188 N MET A 565 -27.905 -8.615 7.005 1.00 1.00 N ATOM 189 CA MET A 565 -27.969 -7.643 8.084 1.00 1.00 C ATOM 190 C MET A 565 -29.231 -6.784 7.975 1.00 1.00 C ATOM 191 O MET A 565 -29.563 -6.300 6.894 1.00 1.00 O ATOM 192 CB MET A 565 -26.732 -6.743 8.035 1.00 1.00 C ATOM 193 CG MET A 565 -26.144 -6.543 9.433 1.00 1.00 C ATOM 194 SD MET A 565 -26.166 -4.811 9.863 1.00 1.00 S ATOM 195 CE MET A 565 -25.098 -4.162 8.589 1.00 1.00 C ATOM 0 H MET A 565 -28.289 -8.292 6.117 1.00 1.00 H new ATOM 0 HA MET A 565 -28.000 -8.181 9.031 1.00 1.00 H new ATOM 0 HB2 MET A 565 -25.981 -7.186 7.381 1.00 1.00 H new ATOM 0 HB3 MET A 565 -26.998 -5.777 7.607 1.00 1.00 H new ATOM 0 HG2 MET A 565 -26.717 -7.115 10.163 1.00 1.00 H new ATOM 0 HG3 MET A 565 -25.122 -6.921 9.464 1.00 1.00 H new ATOM 0 HE1 MET A 565 -24.245 -3.663 9.049 1.00 1.00 H new ATOM 0 HE2 MET A 565 -24.745 -4.979 7.959 1.00 1.00 H new ATOM 0 HE3 MET A 565 -25.651 -3.447 7.980 1.00 1.00 H new ATOM 205 N SER A 566 -29.898 -6.621 9.107 1.00 1.00 N ATOM 206 CA SER A 566 -31.115 -5.830 9.152 1.00 1.00 C ATOM 207 C SER A 566 -30.822 -4.453 9.751 1.00 1.00 C ATOM 208 O SER A 566 -30.071 -4.340 10.719 1.00 1.00 O ATOM 209 CB SER A 566 -32.204 -6.540 9.960 1.00 1.00 C ATOM 210 OG SER A 566 -32.412 -5.926 11.229 1.00 1.00 O ATOM 0 H SER A 566 -29.618 -7.024 10.001 1.00 1.00 H new ATOM 0 HA SER A 566 -31.480 -5.705 8.133 1.00 1.00 H new ATOM 0 HB2 SER A 566 -33.137 -6.533 9.396 1.00 1.00 H new ATOM 0 HB3 SER A 566 -31.927 -7.584 10.103 1.00 1.00 H new ATOM 0 HG SER A 566 -31.546 -5.712 11.635 1.00 1.00 H new ATOM 216 N LYS A 567 -31.431 -3.442 9.150 1.00 1.00 N ATOM 217 CA LYS A 567 -31.244 -2.076 9.612 1.00 1.00 C ATOM 218 C LYS A 567 -32.392 -1.206 9.095 1.00 1.00 C ATOM 219 O LYS A 567 -32.836 -1.367 7.959 1.00 1.00 O ATOM 220 CB LYS A 567 -29.858 -1.562 9.220 1.00 1.00 C ATOM 221 CG LYS A 567 -29.757 -0.049 9.423 1.00 1.00 C ATOM 222 CD LYS A 567 -29.387 0.657 8.117 1.00 1.00 C ATOM 223 CE LYS A 567 -27.987 1.268 8.201 1.00 1.00 C ATOM 224 NZ LYS A 567 -27.610 1.882 6.907 1.00 1.00 N ATOM 0 H LYS A 567 -32.054 -3.540 8.348 1.00 1.00 H new ATOM 0 HA LYS A 567 -31.277 -2.034 10.701 1.00 1.00 H new ATOM 0 HB2 LYS A 567 -29.097 -2.064 9.818 1.00 1.00 H new ATOM 0 HB3 LYS A 567 -29.657 -1.807 8.177 1.00 1.00 H new ATOM 0 HG2 LYS A 567 -30.708 0.336 9.792 1.00 1.00 H new ATOM 0 HG3 LYS A 567 -29.008 0.170 10.184 1.00 1.00 H new ATOM 0 HD2 LYS A 567 -29.429 -0.053 7.291 1.00 1.00 H new ATOM 0 HD3 LYS A 567 -30.116 1.438 7.903 1.00 1.00 H new ATOM 0 HE2 LYS A 567 -27.959 2.021 8.989 1.00 1.00 H new ATOM 0 HE3 LYS A 567 -27.263 0.498 8.469 1.00 1.00 H new ATOM 0 HZ1 LYS A 567 -26.579 2.016 6.873 1.00 1.00 H new ATOM 0 HZ2 LYS A 567 -27.904 1.259 6.128 1.00 1.00 H new ATOM 0 HZ3 LYS A 567 -28.082 2.804 6.810 1.00 1.00 H new ATOM 401 N ARG A 578 -35.312 -7.336 7.390 1.00 1.00 N ATOM 402 CA ARG A 578 -34.073 -8.071 7.195 1.00 1.00 C ATOM 403 C ARG A 578 -33.614 -7.958 5.739 1.00 1.00 C ATOM 404 O ARG A 578 -34.313 -8.396 4.827 1.00 1.00 O ATOM 405 CB ARG A 578 -34.247 -9.548 7.553 1.00 1.00 C ATOM 406 CG ARG A 578 -33.863 -9.806 9.013 1.00 1.00 C ATOM 407 CD ARG A 578 -35.100 -10.121 9.857 1.00 1.00 C ATOM 408 NE ARG A 578 -34.735 -11.016 10.976 1.00 1.00 N ATOM 409 CZ ARG A 578 -35.598 -11.452 11.904 1.00 1.00 C ATOM 410 NH1 ARG A 578 -36.884 -11.078 11.850 1.00 1.00 N ATOM 411 NH2 ARG A 578 -35.176 -12.263 12.884 1.00 1.00 N ATOM 0 HA ARG A 578 -33.321 -7.635 7.853 1.00 1.00 H new ATOM 0 HB2 ARG A 578 -35.282 -9.847 7.387 1.00 1.00 H new ATOM 0 HB3 ARG A 578 -33.629 -10.161 6.897 1.00 1.00 H new ATOM 0 HG2 ARG A 578 -33.160 -10.637 9.067 1.00 1.00 H new ATOM 0 HG3 ARG A 578 -33.354 -8.932 9.419 1.00 1.00 H new ATOM 0 HD2 ARG A 578 -35.530 -9.198 10.245 1.00 1.00 H new ATOM 0 HD3 ARG A 578 -35.863 -10.593 9.237 1.00 1.00 H new ATOM 0 HE ARG A 578 -33.764 -11.321 11.046 1.00 1.00 H new ATOM 0 HH11 ARG A 578 -37.205 -10.462 11.103 1.00 1.00 H new ATOM 0 HH12 ARG A 578 -37.542 -11.409 12.556 1.00 1.00 H new ATOM 0 HH21 ARG A 578 -34.198 -12.549 12.924 1.00 1.00 H new ATOM 0 HH22 ARG A 578 -35.833 -12.595 13.590 1.00 1.00 H new ATOM 425 N ARG A 579 -32.440 -7.368 5.568 1.00 1.00 N ATOM 426 CA ARG A 579 -31.878 -7.191 4.239 1.00 1.00 C ATOM 427 C ARG A 579 -30.393 -7.561 4.238 1.00 1.00 C ATOM 428 O ARG A 579 -29.782 -7.699 5.296 1.00 1.00 O ATOM 429 CB ARG A 579 -32.036 -5.746 3.762 1.00 1.00 C ATOM 430 CG ARG A 579 -33.432 -5.211 4.087 1.00 1.00 C ATOM 431 CD ARG A 579 -34.459 -5.700 3.062 1.00 1.00 C ATOM 432 NE ARG A 579 -34.746 -4.629 2.083 1.00 1.00 N ATOM 433 CZ ARG A 579 -35.273 -3.439 2.403 1.00 1.00 C ATOM 434 NH1 ARG A 579 -35.575 -3.162 3.678 1.00 1.00 N ATOM 435 NH2 ARG A 579 -35.499 -2.528 1.447 1.00 1.00 N ATOM 0 H ARG A 579 -31.863 -7.006 6.327 1.00 1.00 H new ATOM 0 HA ARG A 579 -32.421 -7.848 3.559 1.00 1.00 H new ATOM 0 HB2 ARG A 579 -31.282 -5.118 4.237 1.00 1.00 H new ATOM 0 HB3 ARG A 579 -31.864 -5.693 2.687 1.00 1.00 H new ATOM 0 HG2 ARG A 579 -33.726 -5.535 5.085 1.00 1.00 H new ATOM 0 HG3 ARG A 579 -33.414 -4.121 4.098 1.00 1.00 H new ATOM 0 HD2 ARG A 579 -34.079 -6.583 2.547 1.00 1.00 H new ATOM 0 HD3 ARG A 579 -35.377 -5.997 3.568 1.00 1.00 H new ATOM 0 HE ARG A 579 -34.529 -4.807 1.102 1.00 1.00 H new ATOM 0 HH11 ARG A 579 -35.404 -3.857 4.405 1.00 1.00 H new ATOM 0 HH12 ARG A 579 -35.976 -2.256 3.922 1.00 1.00 H new ATOM 0 HH21 ARG A 579 -35.270 -2.740 0.476 1.00 1.00 H new ATOM 0 HH22 ARG A 579 -35.900 -1.622 1.690 1.00 1.00 H new ATOM 449 N TYR A 580 -29.856 -7.712 3.036 1.00 1.00 N ATOM 450 CA TYR A 580 -28.454 -8.064 2.884 1.00 1.00 C ATOM 451 C TYR A 580 -27.573 -6.814 2.867 1.00 1.00 C ATOM 452 O TYR A 580 -27.762 -5.928 2.035 1.00 1.00 O ATOM 453 CB TYR A 580 -28.342 -8.770 1.529 1.00 1.00 C ATOM 454 CG TYR A 580 -27.482 -10.034 1.556 1.00 1.00 C ATOM 455 CD1 TYR A 580 -26.113 -9.935 1.702 1.00 1.00 C ATOM 456 CD2 TYR A 580 -28.074 -11.275 1.436 1.00 1.00 C ATOM 457 CE1 TYR A 580 -25.303 -11.124 1.727 1.00 1.00 C ATOM 458 CE2 TYR A 580 -27.264 -12.464 1.460 1.00 1.00 C ATOM 459 CZ TYR A 580 -25.919 -12.332 1.606 1.00 1.00 C ATOM 460 OH TYR A 580 -25.153 -13.455 1.629 1.00 1.00 O ATOM 0 H TYR A 580 -30.365 -7.597 2.160 1.00 1.00 H new ATOM 0 HA TYR A 580 -28.124 -8.691 3.712 1.00 1.00 H new ATOM 0 HB2 TYR A 580 -29.342 -9.031 1.183 1.00 1.00 H new ATOM 0 HB3 TYR A 580 -27.924 -8.074 0.802 1.00 1.00 H new ATOM 0 HD1 TYR A 580 -25.649 -8.964 1.798 1.00 1.00 H new ATOM 0 HD2 TYR A 580 -29.145 -11.354 1.324 1.00 1.00 H new ATOM 0 HE1 TYR A 580 -24.231 -11.060 1.839 1.00 1.00 H new ATOM 0 HE2 TYR A 580 -27.715 -13.441 1.364 1.00 1.00 H new ATOM 0 HH TYR A 580 -25.726 -14.244 1.534 1.00 1.00 H new ATOM 470 N PHE A 581 -26.629 -6.781 3.796 1.00 1.00 N ATOM 471 CA PHE A 581 -25.719 -5.653 3.899 1.00 1.00 C ATOM 472 C PHE A 581 -24.278 -6.085 3.618 1.00 1.00 C ATOM 473 O PHE A 581 -23.940 -7.260 3.752 1.00 1.00 O ATOM 474 CB PHE A 581 -25.812 -5.134 5.336 1.00 1.00 C ATOM 475 CG PHE A 581 -26.941 -4.127 5.560 1.00 1.00 C ATOM 476 CD1 PHE A 581 -28.235 -4.503 5.372 1.00 1.00 C ATOM 477 CD2 PHE A 581 -26.652 -2.857 5.952 1.00 1.00 C ATOM 478 CE1 PHE A 581 -29.283 -3.569 5.581 1.00 1.00 C ATOM 479 CE2 PHE A 581 -27.701 -1.923 6.161 1.00 1.00 C ATOM 480 CZ PHE A 581 -28.994 -2.298 5.971 1.00 1.00 C ATOM 0 H PHE A 581 -26.475 -7.518 4.484 1.00 1.00 H new ATOM 0 HA PHE A 581 -25.990 -4.888 3.171 1.00 1.00 H new ATOM 0 HB2 PHE A 581 -25.954 -5.980 6.009 1.00 1.00 H new ATOM 0 HB3 PHE A 581 -24.864 -4.668 5.606 1.00 1.00 H new ATOM 0 HD1 PHE A 581 -28.465 -5.512 5.064 1.00 1.00 H new ATOM 0 HD2 PHE A 581 -25.625 -2.559 6.104 1.00 1.00 H new ATOM 0 HE1 PHE A 581 -30.310 -3.867 5.430 1.00 1.00 H new ATOM 0 HE2 PHE A 581 -27.472 -0.914 6.471 1.00 1.00 H new ATOM 0 HZ PHE A 581 -29.791 -1.587 6.130 1.00 1.00 H new ATOM 490 N TYR A 582 -23.467 -5.111 3.232 1.00 1.00 N ATOM 491 CA TYR A 582 -22.070 -5.375 2.931 1.00 1.00 C ATOM 492 C TYR A 582 -21.182 -4.219 3.393 1.00 1.00 C ATOM 493 O TYR A 582 -21.395 -3.073 3.001 1.00 1.00 O ATOM 494 CB TYR A 582 -21.983 -5.492 1.408 1.00 1.00 C ATOM 495 CG TYR A 582 -21.638 -4.180 0.701 1.00 1.00 C ATOM 496 CD1 TYR A 582 -20.392 -3.610 0.872 1.00 1.00 C ATOM 497 CD2 TYR A 582 -22.573 -3.565 -0.106 1.00 1.00 C ATOM 498 CE1 TYR A 582 -20.067 -2.376 0.208 1.00 1.00 C ATOM 499 CE2 TYR A 582 -22.248 -2.330 -0.772 1.00 1.00 C ATOM 500 CZ TYR A 582 -21.012 -1.795 -0.582 1.00 1.00 C ATOM 501 OH TYR A 582 -20.705 -0.629 -1.209 1.00 1.00 O ATOM 0 H TYR A 582 -23.751 -4.138 3.121 1.00 1.00 H new ATOM 0 HA TYR A 582 -21.731 -6.277 3.440 1.00 1.00 H new ATOM 0 HB2 TYR A 582 -21.230 -6.238 1.154 1.00 1.00 H new ATOM 0 HB3 TYR A 582 -22.936 -5.858 1.027 1.00 1.00 H new ATOM 0 HD1 TYR A 582 -19.661 -4.091 1.505 1.00 1.00 H new ATOM 0 HD2 TYR A 582 -23.548 -4.010 -0.238 1.00 1.00 H new ATOM 0 HE1 TYR A 582 -19.096 -1.921 0.333 1.00 1.00 H new ATOM 0 HE2 TYR A 582 -22.970 -1.840 -1.408 1.00 1.00 H new ATOM 0 HH TYR A 582 -21.473 -0.331 -1.739 1.00 1.00 H new ATOM 511 N LEU A 583 -20.205 -4.561 4.220 1.00 1.00 N ATOM 512 CA LEU A 583 -19.282 -3.565 4.740 1.00 1.00 C ATOM 513 C LEU A 583 -18.003 -3.574 3.900 1.00 1.00 C ATOM 514 O LEU A 583 -17.394 -4.624 3.699 1.00 1.00 O ATOM 515 CB LEU A 583 -19.038 -3.789 6.232 1.00 1.00 C ATOM 516 CG LEU A 583 -18.841 -2.528 7.078 1.00 1.00 C ATOM 517 CD1 LEU A 583 -20.125 -1.697 7.128 1.00 1.00 C ATOM 518 CD2 LEU A 583 -18.331 -2.879 8.476 1.00 1.00 C ATOM 0 H LEU A 583 -20.032 -5.513 4.543 1.00 1.00 H new ATOM 0 HA LEU A 583 -19.712 -2.567 4.657 1.00 1.00 H new ATOM 0 HB2 LEU A 583 -19.882 -4.346 6.638 1.00 1.00 H new ATOM 0 HB3 LEU A 583 -18.156 -4.419 6.345 1.00 1.00 H new ATOM 0 HG LEU A 583 -18.077 -1.913 6.603 1.00 1.00 H new ATOM 0 HD11 LEU A 583 -19.959 -0.807 7.735 1.00 1.00 H new ATOM 0 HD12 LEU A 583 -20.406 -1.400 6.118 1.00 1.00 H new ATOM 0 HD13 LEU A 583 -20.926 -2.291 7.567 1.00 1.00 H new ATOM 0 HD21 LEU A 583 -18.200 -1.965 9.056 1.00 1.00 H new ATOM 0 HD22 LEU A 583 -19.053 -3.525 8.975 1.00 1.00 H new ATOM 0 HD23 LEU A 583 -17.376 -3.398 8.395 1.00 1.00 H new ATOM 530 N PHE A 584 -17.632 -2.390 3.432 1.00 1.00 N ATOM 531 CA PHE A 584 -16.437 -2.249 2.619 1.00 1.00 C ATOM 532 C PHE A 584 -15.385 -1.398 3.335 1.00 1.00 C ATOM 533 O PHE A 584 -15.631 -0.889 4.427 1.00 1.00 O ATOM 534 CB PHE A 584 -16.854 -1.541 1.328 1.00 1.00 C ATOM 535 CG PHE A 584 -16.759 -2.419 0.078 1.00 1.00 C ATOM 536 CD1 PHE A 584 -17.338 -3.651 0.066 1.00 1.00 C ATOM 537 CD2 PHE A 584 -16.096 -1.969 -1.020 1.00 1.00 C ATOM 538 CE1 PHE A 584 -17.248 -4.464 -1.093 1.00 1.00 C ATOM 539 CE2 PHE A 584 -16.007 -2.783 -2.180 1.00 1.00 C ATOM 540 CZ PHE A 584 -16.584 -4.014 -2.192 1.00 1.00 C ATOM 0 H PHE A 584 -18.138 -1.521 3.601 1.00 1.00 H new ATOM 0 HA PHE A 584 -16.003 -3.229 2.423 1.00 1.00 H new ATOM 0 HB2 PHE A 584 -17.880 -1.188 1.434 1.00 1.00 H new ATOM 0 HB3 PHE A 584 -16.227 -0.661 1.190 1.00 1.00 H new ATOM 0 HD1 PHE A 584 -17.865 -4.009 0.938 1.00 1.00 H new ATOM 0 HD2 PHE A 584 -15.637 -0.992 -1.010 1.00 1.00 H new ATOM 0 HE1 PHE A 584 -17.707 -5.441 -1.103 1.00 1.00 H new ATOM 0 HE2 PHE A 584 -15.481 -2.424 -3.052 1.00 1.00 H new ATOM 0 HZ PHE A 584 -16.515 -4.634 -3.073 1.00 1.00 H new ATOM 550 N PRO A 585 -14.204 -1.267 2.672 1.00 1.00 N ATOM 551 CA PRO A 585 -13.114 -0.488 3.233 1.00 1.00 C ATOM 552 C PRO A 585 -13.390 1.012 3.107 1.00 1.00 C ATOM 553 O PRO A 585 -12.571 1.834 3.513 1.00 1.00 O ATOM 554 CB PRO A 585 -11.879 -0.930 2.467 1.00 1.00 C ATOM 555 CG PRO A 585 -12.390 -1.594 1.199 1.00 1.00 C ATOM 556 CD PRO A 585 -13.877 -1.857 1.377 1.00 1.00 C ATOM 0 HA PRO A 585 -12.985 -0.656 4.302 1.00 1.00 H new ATOM 0 HB2 PRO A 585 -11.240 -0.079 2.232 1.00 1.00 H new ATOM 0 HB3 PRO A 585 -11.281 -1.624 3.057 1.00 1.00 H new ATOM 0 HG2 PRO A 585 -12.217 -0.952 0.335 1.00 1.00 H new ATOM 0 HG3 PRO A 585 -11.857 -2.527 1.015 1.00 1.00 H new ATOM 0 HD2 PRO A 585 -14.459 -1.401 0.576 1.00 1.00 H new ATOM 0 HD3 PRO A 585 -14.095 -2.925 1.362 1.00 1.00 H new ATOM 564 N ASN A 586 -14.548 1.322 2.540 1.00 1.00 N ATOM 565 CA ASN A 586 -14.943 2.707 2.355 1.00 1.00 C ATOM 566 C ASN A 586 -16.429 2.766 1.996 1.00 1.00 C ATOM 567 O ASN A 586 -17.159 3.623 2.492 1.00 1.00 O ATOM 568 CB ASN A 586 -14.156 3.358 1.216 1.00 1.00 C ATOM 569 CG ASN A 586 -12.719 2.828 1.170 1.00 1.00 C ATOM 570 OD1 ASN A 586 -12.451 1.727 0.718 1.00 1.00 O ATOM 571 ND2 ASN A 586 -11.816 3.670 1.663 1.00 1.00 N ATOM 0 H ASN A 586 -15.224 0.637 2.203 1.00 1.00 H new ATOM 0 HA ASN A 586 -14.741 3.241 3.284 1.00 1.00 H new ATOM 0 HB2 ASN A 586 -14.652 3.159 0.266 1.00 1.00 H new ATOM 0 HB3 ASN A 586 -14.145 4.440 1.349 1.00 1.00 H new ATOM 0 HD21 ASN A 586 -10.830 3.409 1.678 1.00 1.00 H new ATOM 0 HD22 ASN A 586 -12.109 4.577 2.026 1.00 1.00 H new ATOM 578 N ARG A 587 -16.833 1.844 1.135 1.00 1.00 N ATOM 579 CA ARG A 587 -18.220 1.780 0.703 1.00 1.00 C ATOM 580 C ARG A 587 -19.039 0.924 1.672 1.00 1.00 C ATOM 581 O ARG A 587 -18.502 0.399 2.646 1.00 1.00 O ATOM 582 CB ARG A 587 -18.330 1.194 -0.706 1.00 1.00 C ATOM 583 CG ARG A 587 -17.041 1.419 -1.499 1.00 1.00 C ATOM 584 CD ARG A 587 -17.258 1.150 -2.988 1.00 1.00 C ATOM 585 NE ARG A 587 -17.557 2.417 -3.692 1.00 1.00 N ATOM 586 CZ ARG A 587 -18.168 2.489 -4.883 1.00 1.00 C ATOM 587 NH1 ARG A 587 -18.550 1.367 -5.510 1.00 1.00 N ATOM 588 NH2 ARG A 587 -18.397 3.682 -5.448 1.00 1.00 N ATOM 0 H ARG A 587 -16.225 1.135 0.725 1.00 1.00 H new ATOM 0 HA ARG A 587 -18.613 2.797 0.693 1.00 1.00 H new ATOM 0 HB2 ARG A 587 -18.540 0.126 -0.644 1.00 1.00 H new ATOM 0 HB3 ARG A 587 -19.168 1.654 -1.230 1.00 1.00 H new ATOM 0 HG2 ARG A 587 -16.697 2.444 -1.358 1.00 1.00 H new ATOM 0 HG3 ARG A 587 -16.257 0.764 -1.118 1.00 1.00 H new ATOM 0 HD2 ARG A 587 -16.369 0.688 -3.416 1.00 1.00 H new ATOM 0 HD3 ARG A 587 -18.080 0.446 -3.123 1.00 1.00 H new ATOM 0 HE ARG A 587 -17.281 3.290 -3.243 1.00 1.00 H new ATOM 0 HH11 ARG A 587 -18.376 0.458 -5.081 1.00 1.00 H new ATOM 0 HH12 ARG A 587 -19.015 1.422 -6.416 1.00 1.00 H new ATOM 0 HH21 ARG A 587 -18.106 4.536 -4.972 1.00 1.00 H new ATOM 0 HH22 ARG A 587 -18.862 3.736 -6.354 1.00 1.00 H new ATOM 602 N LEU A 588 -20.324 0.812 1.369 1.00 1.00 N ATOM 603 CA LEU A 588 -21.221 0.029 2.201 1.00 1.00 C ATOM 604 C LEU A 588 -22.667 0.308 1.786 1.00 1.00 C ATOM 605 O LEU A 588 -23.098 1.460 1.762 1.00 1.00 O ATOM 606 CB LEU A 588 -20.945 0.290 3.682 1.00 1.00 C ATOM 607 CG LEU A 588 -22.169 0.582 4.552 1.00 1.00 C ATOM 608 CD1 LEU A 588 -23.071 -0.647 4.658 1.00 1.00 C ATOM 609 CD2 LEU A 588 -21.751 1.107 5.928 1.00 1.00 C ATOM 0 H LEU A 588 -20.765 1.250 0.560 1.00 1.00 H new ATOM 0 HA LEU A 588 -21.045 -1.036 2.052 1.00 1.00 H new ATOM 0 HB2 LEU A 588 -20.430 -0.578 4.094 1.00 1.00 H new ATOM 0 HB3 LEU A 588 -20.259 1.134 3.760 1.00 1.00 H new ATOM 0 HG LEU A 588 -22.751 1.368 4.071 1.00 1.00 H new ATOM 0 HD11 LEU A 588 -23.934 -0.413 5.282 1.00 1.00 H new ATOM 0 HD12 LEU A 588 -23.410 -0.936 3.663 1.00 1.00 H new ATOM 0 HD13 LEU A 588 -22.513 -1.470 5.105 1.00 1.00 H new ATOM 0 HD21 LEU A 588 -22.640 1.307 6.527 1.00 1.00 H new ATOM 0 HD22 LEU A 588 -21.135 0.361 6.430 1.00 1.00 H new ATOM 0 HD23 LEU A 588 -21.180 2.028 5.808 1.00 1.00 H new ATOM 799 N LEU A 601 -23.946 4.070 0.480 1.00 1.00 N ATOM 800 CA LEU A 601 -23.097 5.143 0.969 1.00 1.00 C ATOM 801 C LEU A 601 -21.717 4.579 1.313 1.00 1.00 C ATOM 802 O LEU A 601 -21.445 3.403 1.072 1.00 1.00 O ATOM 803 CB LEU A 601 -23.771 5.871 2.133 1.00 1.00 C ATOM 804 CG LEU A 601 -24.360 7.246 1.813 1.00 1.00 C ATOM 805 CD1 LEU A 601 -23.275 8.209 1.328 1.00 1.00 C ATOM 806 CD2 LEU A 601 -25.512 7.130 0.814 1.00 1.00 C ATOM 0 HA LEU A 601 -22.950 5.896 0.194 1.00 1.00 H new ATOM 0 HB2 LEU A 601 -24.569 5.237 2.519 1.00 1.00 H new ATOM 0 HB3 LEU A 601 -23.041 5.988 2.934 1.00 1.00 H new ATOM 0 HG LEU A 601 -24.772 7.663 2.732 1.00 1.00 H new ATOM 0 HD11 LEU A 601 -23.721 9.179 1.108 1.00 1.00 H new ATOM 0 HD12 LEU A 601 -22.519 8.326 2.104 1.00 1.00 H new ATOM 0 HD13 LEU A 601 -22.811 7.810 0.426 1.00 1.00 H new ATOM 0 HD21 LEU A 601 -25.913 8.122 0.604 1.00 1.00 H new ATOM 0 HD22 LEU A 601 -25.148 6.682 -0.111 1.00 1.00 H new ATOM 0 HD23 LEU A 601 -26.298 6.503 1.236 1.00 1.00 H new ATOM 818 N THR A 602 -20.883 5.443 1.872 1.00 1.00 N ATOM 819 CA THR A 602 -19.537 5.046 2.251 1.00 1.00 C ATOM 820 C THR A 602 -19.434 4.895 3.770 1.00 1.00 C ATOM 821 O THR A 602 -20.445 4.727 4.450 1.00 1.00 O ATOM 822 CB THR A 602 -18.560 6.072 1.674 1.00 1.00 C ATOM 823 OG1 THR A 602 -19.400 7.023 1.024 1.00 1.00 O ATOM 824 CG2 THR A 602 -17.704 5.496 0.544 1.00 1.00 C ATOM 0 H THR A 602 -21.113 6.416 2.072 1.00 1.00 H new ATOM 0 HA THR A 602 -19.283 4.069 1.841 1.00 1.00 H new ATOM 0 HB THR A 602 -17.911 6.441 2.468 1.00 1.00 H new ATOM 0 HG1 THR A 602 -18.848 7.726 0.623 1.00 1.00 H new ATOM 0 HG21 THR A 602 -17.029 6.266 0.171 1.00 1.00 H new ATOM 0 HG22 THR A 602 -17.122 4.655 0.921 1.00 1.00 H new ATOM 0 HG23 THR A 602 -18.350 5.157 -0.265 1.00 1.00 H new ATOM 832 N MET A 603 -18.203 4.961 4.257 1.00 1.00 N ATOM 833 CA MET A 603 -17.955 4.834 5.682 1.00 1.00 C ATOM 834 C MET A 603 -17.097 5.993 6.195 1.00 1.00 C ATOM 835 O MET A 603 -16.285 5.816 7.101 1.00 1.00 O ATOM 836 CB MET A 603 -17.242 3.509 5.960 1.00 1.00 C ATOM 837 CG MET A 603 -16.243 3.178 4.850 1.00 1.00 C ATOM 838 SD MET A 603 -14.737 2.531 5.554 1.00 1.00 S ATOM 839 CE MET A 603 -13.622 3.878 5.195 1.00 1.00 C ATOM 0 H MET A 603 -17.367 5.101 3.689 1.00 1.00 H new ATOM 0 HA MET A 603 -18.913 4.858 6.202 1.00 1.00 H new ATOM 0 HB2 MET A 603 -16.722 3.566 6.916 1.00 1.00 H new ATOM 0 HB3 MET A 603 -17.976 2.708 6.043 1.00 1.00 H new ATOM 0 HG2 MET A 603 -16.676 2.449 4.166 1.00 1.00 H new ATOM 0 HG3 MET A 603 -16.026 4.073 4.267 1.00 1.00 H new ATOM 0 HE1 MET A 603 -12.818 3.890 5.930 1.00 1.00 H new ATOM 0 HE2 MET A 603 -13.201 3.746 4.198 1.00 1.00 H new ATOM 0 HE3 MET A 603 -14.166 4.822 5.237 1.00 1.00 H new ATOM 849 N GLU A 604 -17.307 7.154 5.592 1.00 1.00 N ATOM 850 CA GLU A 604 -16.564 8.342 5.977 1.00 1.00 C ATOM 851 C GLU A 604 -17.525 9.478 6.330 1.00 1.00 C ATOM 852 O GLU A 604 -17.515 10.527 5.687 1.00 1.00 O ATOM 853 CB GLU A 604 -15.597 8.765 4.869 1.00 1.00 C ATOM 854 CG GLU A 604 -16.349 9.055 3.567 1.00 1.00 C ATOM 855 CD GLU A 604 -15.381 9.146 2.385 1.00 1.00 C ATOM 856 OE1 GLU A 604 -14.608 8.180 2.209 1.00 1.00 O ATOM 857 OE2 GLU A 604 -15.436 10.179 1.684 1.00 1.00 O ATOM 0 H GLU A 604 -17.981 7.297 4.840 1.00 1.00 H new ATOM 0 HA GLU A 604 -15.972 8.107 6.861 1.00 1.00 H new ATOM 0 HB2 GLU A 604 -15.047 9.653 5.181 1.00 1.00 H new ATOM 0 HB3 GLU A 604 -14.863 7.977 4.702 1.00 1.00 H new ATOM 0 HG2 GLU A 604 -17.081 8.269 3.383 1.00 1.00 H new ATOM 0 HG3 GLU A 604 -16.902 9.990 3.662 1.00 1.00 H new ATOM 864 N GLU A 605 -18.332 9.231 7.351 1.00 1.00 N ATOM 865 CA GLU A 605 -19.298 10.221 7.797 1.00 1.00 C ATOM 866 C GLU A 605 -19.721 9.937 9.241 1.00 1.00 C ATOM 867 O GLU A 605 -19.711 10.834 10.083 1.00 1.00 O ATOM 868 CB GLU A 605 -20.512 10.262 6.869 1.00 1.00 C ATOM 869 CG GLU A 605 -20.877 8.857 6.382 1.00 1.00 C ATOM 870 CD GLU A 605 -21.613 8.915 5.043 1.00 1.00 C ATOM 871 OE1 GLU A 605 -21.017 9.463 4.089 1.00 1.00 O ATOM 872 OE2 GLU A 605 -22.757 8.412 5.001 1.00 1.00 O ATOM 0 H GLU A 605 -18.337 8.360 7.882 1.00 1.00 H new ATOM 0 HA GLU A 605 -18.824 11.202 7.763 1.00 1.00 H new ATOM 0 HB2 GLU A 605 -21.361 10.701 7.394 1.00 1.00 H new ATOM 0 HB3 GLU A 605 -20.299 10.904 6.014 1.00 1.00 H new ATOM 0 HG2 GLU A 605 -19.972 8.258 6.278 1.00 1.00 H new ATOM 0 HG3 GLU A 605 -21.503 8.362 7.124 1.00 1.00 H new ATOM 879 N ILE A 606 -20.082 8.686 9.482 1.00 1.00 N ATOM 880 CA ILE A 606 -20.508 8.272 10.808 1.00 1.00 C ATOM 881 C ILE A 606 -19.683 9.018 11.859 1.00 1.00 C ATOM 882 O ILE A 606 -18.478 9.201 11.692 1.00 1.00 O ATOM 883 CB ILE A 606 -20.440 6.749 10.942 1.00 1.00 C ATOM 884 CG1 ILE A 606 -21.698 6.093 10.368 1.00 1.00 C ATOM 885 CG2 ILE A 606 -20.191 6.336 12.393 1.00 1.00 C ATOM 886 CD1 ILE A 606 -21.496 5.708 8.900 1.00 1.00 C ATOM 0 H ILE A 606 -20.088 7.945 8.781 1.00 1.00 H new ATOM 0 HA ILE A 606 -21.552 8.537 10.973 1.00 1.00 H new ATOM 0 HB ILE A 606 -19.593 6.392 10.356 1.00 1.00 H new ATOM 0 HG12 ILE A 606 -21.947 5.205 10.949 1.00 1.00 H new ATOM 0 HG13 ILE A 606 -22.541 6.778 10.455 1.00 1.00 H new ATOM 0 HG21 ILE A 606 -20.147 5.249 12.459 1.00 1.00 H new ATOM 0 HG22 ILE A 606 -19.246 6.759 12.735 1.00 1.00 H new ATOM 0 HG23 ILE A 606 -21.002 6.706 13.021 1.00 1.00 H new ATOM 0 HD11 ILE A 606 -22.405 5.244 8.517 1.00 1.00 H new ATOM 0 HD12 ILE A 606 -21.271 6.601 8.317 1.00 1.00 H new ATOM 0 HD13 ILE A 606 -20.668 5.004 8.819 1.00 1.00 H new ATOM 898 N GLN A 607 -20.365 9.428 12.919 1.00 1.00 N ATOM 899 CA GLN A 607 -19.711 10.149 13.997 1.00 1.00 C ATOM 900 C GLN A 607 -19.323 9.186 15.121 1.00 1.00 C ATOM 901 O GLN A 607 -18.287 9.359 15.760 1.00 1.00 O ATOM 902 CB GLN A 607 -20.604 11.275 14.523 1.00 1.00 C ATOM 903 CG GLN A 607 -19.874 12.620 14.474 1.00 1.00 C ATOM 904 CD GLN A 607 -19.415 13.046 15.869 1.00 1.00 C ATOM 905 OE1 GLN A 607 -20.171 13.042 16.828 1.00 1.00 O ATOM 906 NE2 GLN A 607 -18.139 13.413 15.931 1.00 1.00 N ATOM 0 H GLN A 607 -21.364 9.274 13.054 1.00 1.00 H new ATOM 0 HA GLN A 607 -18.801 10.604 13.605 1.00 1.00 H new ATOM 0 HB2 GLN A 607 -21.516 11.330 13.928 1.00 1.00 H new ATOM 0 HB3 GLN A 607 -20.905 11.057 15.548 1.00 1.00 H new ATOM 0 HG2 GLN A 607 -19.012 12.546 13.811 1.00 1.00 H new ATOM 0 HG3 GLN A 607 -20.534 13.381 14.056 1.00 1.00 H new ATOM 0 HE21 GLN A 607 -17.561 13.393 15.091 1.00 1.00 H new ATOM 0 HE22 GLN A 607 -17.738 13.715 16.819 1.00 1.00 H new ATOM 915 N SER A 608 -20.176 8.194 15.328 1.00 1.00 N ATOM 916 CA SER A 608 -19.936 7.204 16.364 1.00 1.00 C ATOM 917 C SER A 608 -20.970 6.081 16.264 1.00 1.00 C ATOM 918 O SER A 608 -22.160 6.342 16.095 1.00 1.00 O ATOM 919 CB SER A 608 -19.976 7.841 17.754 1.00 1.00 C ATOM 920 OG SER A 608 -18.684 8.259 18.187 1.00 1.00 O ATOM 0 H SER A 608 -21.035 8.054 14.796 1.00 1.00 H new ATOM 0 HA SER A 608 -18.940 6.786 16.214 1.00 1.00 H new ATOM 0 HB2 SER A 608 -20.649 8.698 17.741 1.00 1.00 H new ATOM 0 HB3 SER A 608 -20.384 7.126 18.469 1.00 1.00 H new ATOM 0 HG SER A 608 -18.234 8.736 17.459 1.00 1.00 H new ATOM 926 N VAL A 609 -20.478 4.856 16.374 1.00 1.00 N ATOM 927 CA VAL A 609 -21.345 3.692 16.299 1.00 1.00 C ATOM 928 C VAL A 609 -21.482 3.073 17.691 1.00 1.00 C ATOM 929 O VAL A 609 -20.513 3.011 18.446 1.00 1.00 O ATOM 930 CB VAL A 609 -20.810 2.707 15.258 1.00 1.00 C ATOM 931 CG1 VAL A 609 -19.339 2.379 15.519 1.00 1.00 C ATOM 932 CG2 VAL A 609 -21.658 1.434 15.221 1.00 1.00 C ATOM 0 H VAL A 609 -19.490 4.644 16.514 1.00 1.00 H new ATOM 0 HA VAL A 609 -22.344 3.981 15.971 1.00 1.00 H new ATOM 0 HB VAL A 609 -20.878 3.183 14.280 1.00 1.00 H new ATOM 0 HG11 VAL A 609 -18.983 1.677 14.765 1.00 1.00 H new ATOM 0 HG12 VAL A 609 -18.748 3.294 15.471 1.00 1.00 H new ATOM 0 HG13 VAL A 609 -19.236 1.932 16.508 1.00 1.00 H new ATOM 0 HG21 VAL A 609 -21.256 0.751 14.473 1.00 1.00 H new ATOM 0 HG22 VAL A 609 -21.637 0.954 16.199 1.00 1.00 H new ATOM 0 HG23 VAL A 609 -22.686 1.689 14.964 1.00 1.00 H new ATOM 942 N GLU A 610 -22.696 2.632 17.992 1.00 1.00 N ATOM 943 CA GLU A 610 -22.972 2.020 19.280 1.00 1.00 C ATOM 944 C GLU A 610 -24.202 1.116 19.184 1.00 1.00 C ATOM 945 O GLU A 610 -24.653 0.786 18.088 1.00 1.00 O ATOM 946 CB GLU A 610 -23.158 3.085 20.363 1.00 1.00 C ATOM 947 CG GLU A 610 -23.246 4.482 19.750 1.00 1.00 C ATOM 948 CD GLU A 610 -23.609 5.524 20.809 1.00 1.00 C ATOM 949 OE1 GLU A 610 -23.599 5.149 22.002 1.00 1.00 O ATOM 950 OE2 GLU A 610 -23.888 6.674 20.402 1.00 1.00 O ATOM 0 H GLU A 610 -23.499 2.687 17.365 1.00 1.00 H new ATOM 0 HA GLU A 610 -22.116 1.407 19.561 1.00 1.00 H new ATOM 0 HB2 GLU A 610 -24.064 2.876 20.931 1.00 1.00 H new ATOM 0 HB3 GLU A 610 -22.325 3.044 21.065 1.00 1.00 H new ATOM 0 HG2 GLU A 610 -22.292 4.742 19.291 1.00 1.00 H new ATOM 0 HG3 GLU A 610 -23.994 4.489 18.957 1.00 1.00 H new ATOM 957 N GLU A 611 -24.711 0.735 20.348 1.00 1.00 N ATOM 958 CA GLU A 611 -25.878 -0.126 20.410 1.00 1.00 C ATOM 959 C GLU A 611 -26.746 0.240 21.615 1.00 1.00 C ATOM 960 O GLU A 611 -26.226 0.591 22.674 1.00 1.00 O ATOM 961 CB GLU A 611 -25.472 -1.600 20.454 1.00 1.00 C ATOM 962 CG GLU A 611 -26.703 -2.507 20.514 1.00 1.00 C ATOM 963 CD GLU A 611 -26.345 -3.879 21.086 1.00 1.00 C ATOM 964 OE1 GLU A 611 -25.549 -4.579 20.426 1.00 1.00 O ATOM 965 OE2 GLU A 611 -26.877 -4.197 22.173 1.00 1.00 O ATOM 0 H GLU A 611 -24.335 1.008 21.256 1.00 1.00 H new ATOM 0 HA GLU A 611 -26.465 0.028 19.505 1.00 1.00 H new ATOM 0 HB2 GLU A 611 -24.879 -1.844 19.573 1.00 1.00 H new ATOM 0 HB3 GLU A 611 -24.840 -1.781 21.323 1.00 1.00 H new ATOM 0 HG2 GLU A 611 -27.472 -2.042 21.130 1.00 1.00 H new ATOM 0 HG3 GLU A 611 -27.122 -2.624 19.515 1.00 1.00 H new ATOM 972 N THR A 612 -28.052 0.149 21.416 1.00 1.00 N ATOM 973 CA THR A 612 -28.995 0.465 22.476 1.00 1.00 C ATOM 974 C THR A 612 -29.573 -0.817 23.075 1.00 1.00 C ATOM 975 O THR A 612 -29.436 -1.896 22.498 1.00 1.00 O ATOM 976 CB THR A 612 -30.060 1.399 21.894 1.00 1.00 C ATOM 977 OG1 THR A 612 -31.184 1.220 22.753 1.00 1.00 O ATOM 978 CG2 THR A 612 -30.560 0.937 20.525 1.00 1.00 C ATOM 0 H THR A 612 -28.480 -0.139 20.536 1.00 1.00 H new ATOM 0 HA THR A 612 -28.505 0.979 23.303 1.00 1.00 H new ATOM 0 HB THR A 612 -29.652 2.406 21.809 1.00 1.00 H new ATOM 0 HG1 THR A 612 -31.921 1.790 22.450 1.00 1.00 H new ATOM 0 HG21 THR A 612 -31.313 1.634 20.158 1.00 1.00 H new ATOM 0 HG22 THR A 612 -29.725 0.904 19.825 1.00 1.00 H new ATOM 0 HG23 THR A 612 -30.999 -0.057 20.614 1.00 1.00 H new ATOM 986 N GLN A 613 -30.209 -0.660 24.227 1.00 1.00 N ATOM 987 CA GLN A 613 -30.810 -1.792 24.912 1.00 1.00 C ATOM 988 C GLN A 613 -32.240 -1.456 25.338 1.00 1.00 C ATOM 989 O GLN A 613 -32.613 -0.286 25.408 1.00 1.00 O ATOM 990 CB GLN A 613 -29.965 -2.215 26.116 1.00 1.00 C ATOM 991 CG GLN A 613 -28.487 -2.330 25.734 1.00 1.00 C ATOM 992 CD GLN A 613 -27.617 -2.550 26.974 1.00 1.00 C ATOM 993 OE1 GLN A 613 -28.066 -2.459 28.103 1.00 1.00 O ATOM 994 NE2 GLN A 613 -26.348 -2.843 26.699 1.00 1.00 N ATOM 0 H GLN A 613 -30.321 0.235 24.704 1.00 1.00 H new ATOM 0 HA GLN A 613 -30.846 -2.634 24.220 1.00 1.00 H new ATOM 0 HB2 GLN A 613 -30.081 -1.488 26.920 1.00 1.00 H new ATOM 0 HB3 GLN A 613 -30.322 -3.172 26.497 1.00 1.00 H new ATOM 0 HG2 GLN A 613 -28.351 -3.158 25.038 1.00 1.00 H new ATOM 0 HG3 GLN A 613 -28.169 -1.424 25.218 1.00 1.00 H new ATOM 0 HE21 GLN A 613 -26.037 -2.904 25.729 1.00 1.00 H new ATOM 0 HE22 GLN A 613 -25.686 -3.007 27.458 1.00 1.00 H new ATOM 1003 N ILE A 614 -33.003 -2.505 25.612 1.00 1.00 N ATOM 1004 CA ILE A 614 -34.385 -2.336 26.030 1.00 1.00 C ATOM 1005 C ILE A 614 -34.749 -3.436 27.029 1.00 1.00 C ATOM 1006 O ILE A 614 -35.300 -4.468 26.648 1.00 1.00 O ATOM 1007 CB ILE A 614 -35.308 -2.282 24.812 1.00 1.00 C ATOM 1008 CG1 ILE A 614 -35.711 -0.840 24.494 1.00 1.00 C ATOM 1009 CG2 ILE A 614 -36.527 -3.187 25.007 1.00 1.00 C ATOM 1010 CD1 ILE A 614 -35.043 -0.356 23.205 1.00 1.00 C ATOM 0 H ILE A 614 -32.691 -3.474 25.553 1.00 1.00 H new ATOM 0 HA ILE A 614 -34.515 -1.383 26.543 1.00 1.00 H new ATOM 0 HB ILE A 614 -34.759 -2.662 23.950 1.00 1.00 H new ATOM 0 HG12 ILE A 614 -36.794 -0.775 24.393 1.00 1.00 H new ATOM 0 HG13 ILE A 614 -35.428 -0.189 25.321 1.00 1.00 H new ATOM 0 HG21 ILE A 614 -37.167 -3.130 24.127 1.00 1.00 H new ATOM 0 HG22 ILE A 614 -36.197 -4.216 25.150 1.00 1.00 H new ATOM 0 HG23 ILE A 614 -37.086 -2.860 25.884 1.00 1.00 H new ATOM 0 HD11 ILE A 614 -35.346 0.671 23.002 1.00 1.00 H new ATOM 0 HD12 ILE A 614 -33.960 -0.399 23.318 1.00 1.00 H new ATOM 0 HD13 ILE A 614 -35.347 -0.995 22.376 1.00 1.00 H new ATOM 1022 N LYS A 615 -34.426 -3.178 28.288 1.00 1.00 N ATOM 1023 CA LYS A 615 -34.712 -4.134 29.344 1.00 1.00 C ATOM 1024 C LYS A 615 -33.613 -5.198 29.374 1.00 1.00 C ATOM 1025 O LYS A 615 -33.258 -5.697 30.441 1.00 1.00 O ATOM 1026 CB LYS A 615 -36.120 -4.709 29.180 1.00 1.00 C ATOM 1027 CG LYS A 615 -37.138 -3.599 28.911 1.00 1.00 C ATOM 1028 CD LYS A 615 -37.777 -3.112 30.213 1.00 1.00 C ATOM 1029 CE LYS A 615 -38.733 -1.947 29.953 1.00 1.00 C ATOM 1030 NZ LYS A 615 -39.431 -1.560 31.201 1.00 1.00 N ATOM 0 H LYS A 615 -33.969 -2.321 28.600 1.00 1.00 H new ATOM 0 HA LYS A 615 -34.706 -3.641 30.316 1.00 1.00 H new ATOM 0 HB2 LYS A 615 -36.131 -5.424 28.358 1.00 1.00 H new ATOM 0 HB3 LYS A 615 -36.401 -5.255 30.081 1.00 1.00 H new ATOM 0 HG2 LYS A 615 -36.648 -2.765 28.409 1.00 1.00 H new ATOM 0 HG3 LYS A 615 -37.912 -3.966 28.237 1.00 1.00 H new ATOM 0 HD2 LYS A 615 -38.318 -3.932 30.686 1.00 1.00 H new ATOM 0 HD3 LYS A 615 -36.999 -2.800 30.909 1.00 1.00 H new ATOM 0 HE2 LYS A 615 -38.179 -1.095 29.560 1.00 1.00 H new ATOM 0 HE3 LYS A 615 -39.462 -2.230 29.194 1.00 1.00 H new ATOM 0 HZ1 LYS A 615 -40.076 -0.768 31.007 1.00 1.00 H new ATOM 0 HZ2 LYS A 615 -39.976 -2.370 31.560 1.00 1.00 H new ATOM 0 HZ3 LYS A 615 -38.732 -1.270 31.914 1.00 1.00 H new ATOM 1044 N GLU A 616 -33.106 -5.513 28.192 1.00 1.00 N ATOM 1045 CA GLU A 616 -32.056 -6.510 28.070 1.00 1.00 C ATOM 1046 C GLU A 616 -31.247 -6.275 26.792 1.00 1.00 C ATOM 1047 O GLU A 616 -30.018 -6.242 26.828 1.00 1.00 O ATOM 1048 CB GLU A 616 -32.635 -7.924 28.101 1.00 1.00 C ATOM 1049 CG GLU A 616 -31.704 -8.913 27.397 1.00 1.00 C ATOM 1050 CD GLU A 616 -31.782 -10.298 28.045 1.00 1.00 C ATOM 1051 OE1 GLU A 616 -32.915 -10.700 28.389 1.00 1.00 O ATOM 1052 OE2 GLU A 616 -30.709 -10.922 28.182 1.00 1.00 O ATOM 0 H GLU A 616 -33.403 -5.096 27.310 1.00 1.00 H new ATOM 0 HA GLU A 616 -31.386 -6.410 28.924 1.00 1.00 H new ATOM 0 HB2 GLU A 616 -32.788 -8.236 29.134 1.00 1.00 H new ATOM 0 HB3 GLU A 616 -33.612 -7.932 27.618 1.00 1.00 H new ATOM 0 HG2 GLU A 616 -31.974 -8.985 26.343 1.00 1.00 H new ATOM 0 HG3 GLU A 616 -30.679 -8.545 27.439 1.00 1.00 H new ATOM 1059 N ARG A 617 -31.970 -6.117 25.694 1.00 1.00 N ATOM 1060 CA ARG A 617 -31.336 -5.886 24.407 1.00 1.00 C ATOM 1061 C ARG A 617 -32.296 -5.154 23.466 1.00 1.00 C ATOM 1062 O ARG A 617 -33.487 -5.456 23.432 1.00 1.00 O ATOM 1063 CB ARG A 617 -30.904 -7.204 23.762 1.00 1.00 C ATOM 1064 CG ARG A 617 -29.703 -6.993 22.837 1.00 1.00 C ATOM 1065 CD ARG A 617 -29.422 -8.250 22.012 1.00 1.00 C ATOM 1066 NE ARG A 617 -27.989 -8.303 21.643 1.00 1.00 N ATOM 1067 CZ ARG A 617 -27.001 -8.568 22.507 1.00 1.00 C ATOM 1068 NH1 ARG A 617 -27.282 -8.807 23.795 1.00 1.00 N ATOM 1069 NH2 ARG A 617 -25.729 -8.595 22.083 1.00 1.00 N ATOM 0 H ARG A 617 -32.989 -6.144 25.668 1.00 1.00 H new ATOM 0 HA ARG A 617 -30.452 -5.272 24.578 1.00 1.00 H new ATOM 0 HB2 ARG A 617 -30.648 -7.926 24.537 1.00 1.00 H new ATOM 0 HB3 ARG A 617 -31.734 -7.625 23.196 1.00 1.00 H new ATOM 0 HG2 ARG A 617 -29.895 -6.152 22.171 1.00 1.00 H new ATOM 0 HG3 ARG A 617 -28.824 -6.737 23.428 1.00 1.00 H new ATOM 0 HD2 ARG A 617 -29.692 -9.138 22.583 1.00 1.00 H new ATOM 0 HD3 ARG A 617 -30.038 -8.250 21.113 1.00 1.00 H new ATOM 0 HE ARG A 617 -27.739 -8.127 20.670 1.00 1.00 H new ATOM 0 HH11 ARG A 617 -28.249 -8.787 24.118 1.00 1.00 H new ATOM 0 HH12 ARG A 617 -26.529 -9.009 24.452 1.00 1.00 H new ATOM 0 HH21 ARG A 617 -25.514 -8.414 21.102 1.00 1.00 H new ATOM 0 HH22 ARG A 617 -24.976 -8.797 22.741 1.00 1.00 H new ATOM 1083 N LYS A 618 -31.739 -4.207 22.725 1.00 1.00 N ATOM 1084 CA LYS A 618 -32.531 -3.430 21.787 1.00 1.00 C ATOM 1085 C LYS A 618 -32.004 -3.660 20.369 1.00 1.00 C ATOM 1086 O LYS A 618 -32.361 -4.643 19.721 1.00 1.00 O ATOM 1087 CB LYS A 618 -32.562 -1.958 22.200 1.00 1.00 C ATOM 1088 CG LYS A 618 -33.115 -1.083 21.074 1.00 1.00 C ATOM 1089 CD LYS A 618 -34.234 -1.803 20.320 1.00 1.00 C ATOM 1090 CE LYS A 618 -35.207 -0.800 19.694 1.00 1.00 C ATOM 1091 NZ LYS A 618 -35.959 -1.429 18.585 1.00 1.00 N ATOM 0 H LYS A 618 -30.750 -3.961 22.755 1.00 1.00 H new ATOM 0 HA LYS A 618 -33.569 -3.761 21.800 1.00 1.00 H new ATOM 0 HB2 LYS A 618 -33.177 -1.840 23.092 1.00 1.00 H new ATOM 0 HB3 LYS A 618 -31.556 -1.629 22.460 1.00 1.00 H new ATOM 0 HG2 LYS A 618 -33.493 -0.148 21.487 1.00 1.00 H new ATOM 0 HG3 LYS A 618 -32.313 -0.824 20.382 1.00 1.00 H new ATOM 0 HD2 LYS A 618 -33.805 -2.434 19.541 1.00 1.00 H new ATOM 0 HD3 LYS A 618 -34.773 -2.460 21.002 1.00 1.00 H new ATOM 0 HE2 LYS A 618 -35.901 -0.437 20.452 1.00 1.00 H new ATOM 0 HE3 LYS A 618 -34.658 0.066 19.324 1.00 1.00 H new ATOM 0 HZ1 LYS A 618 -36.614 -0.735 18.172 1.00 1.00 H new ATOM 0 HZ2 LYS A 618 -35.294 -1.754 17.855 1.00 1.00 H new ATOM 0 HZ3 LYS A 618 -36.498 -2.241 18.948 1.00 1.00 H new ATOM 1105 N CYS A 619 -31.160 -2.737 19.930 1.00 1.00 N ATOM 1106 CA CYS A 619 -30.579 -2.827 18.600 1.00 1.00 C ATOM 1107 C CYS A 619 -29.291 -2.001 18.584 1.00 1.00 C ATOM 1108 O CYS A 619 -28.886 -1.453 19.608 1.00 1.00 O ATOM 1109 CB CYS A 619 -31.563 -2.371 17.521 1.00 1.00 C ATOM 1110 SG CYS A 619 -32.706 -3.738 17.101 1.00 1.00 S ATOM 0 H CYS A 619 -30.865 -1.924 20.471 1.00 1.00 H new ATOM 0 HA CYS A 619 -30.347 -3.867 18.370 1.00 1.00 H new ATOM 0 HB2 CYS A 619 -32.128 -1.508 17.873 1.00 1.00 H new ATOM 0 HB3 CYS A 619 -31.019 -2.054 16.631 1.00 1.00 H new ATOM 0 HG CYS A 619 -32.963 -4.433 18.169 1.00 1.00 H new ATOM 1116 N LEU A 620 -28.682 -1.939 17.407 1.00 1.00 N ATOM 1117 CA LEU A 620 -27.448 -1.189 17.244 1.00 1.00 C ATOM 1118 C LEU A 620 -27.772 0.209 16.713 1.00 1.00 C ATOM 1119 O LEU A 620 -28.760 0.393 16.004 1.00 1.00 O ATOM 1120 CB LEU A 620 -26.462 -1.966 16.369 1.00 1.00 C ATOM 1121 CG LEU A 620 -25.005 -1.965 16.837 1.00 1.00 C ATOM 1122 CD1 LEU A 620 -24.576 -3.361 17.292 1.00 1.00 C ATOM 1123 CD2 LEU A 620 -24.082 -1.406 15.752 1.00 1.00 C ATOM 0 H LEU A 620 -29.020 -2.395 16.560 1.00 1.00 H new ATOM 0 HA LEU A 620 -26.952 -1.058 18.205 1.00 1.00 H new ATOM 0 HB2 LEU A 620 -26.801 -3.000 16.304 1.00 1.00 H new ATOM 0 HB3 LEU A 620 -26.499 -1.554 15.360 1.00 1.00 H new ATOM 0 HG LEU A 620 -24.923 -1.305 17.701 1.00 1.00 H new ATOM 0 HD11 LEU A 620 -23.537 -3.334 17.620 1.00 1.00 H new ATOM 0 HD12 LEU A 620 -25.209 -3.685 18.118 1.00 1.00 H new ATOM 0 HD13 LEU A 620 -24.676 -4.061 16.462 1.00 1.00 H new ATOM 0 HD21 LEU A 620 -23.052 -1.416 16.110 1.00 1.00 H new ATOM 0 HD22 LEU A 620 -24.161 -2.021 14.855 1.00 1.00 H new ATOM 0 HD23 LEU A 620 -24.375 -0.383 15.517 1.00 1.00 H new ATOM 1135 N LEU A 621 -26.921 1.156 17.076 1.00 1.00 N ATOM 1136 CA LEU A 621 -27.105 2.532 16.646 1.00 1.00 C ATOM 1137 C LEU A 621 -26.004 2.901 15.649 1.00 1.00 C ATOM 1138 O LEU A 621 -24.962 2.249 15.600 1.00 1.00 O ATOM 1139 CB LEU A 621 -27.179 3.467 17.855 1.00 1.00 C ATOM 1140 CG LEU A 621 -26.560 4.854 17.669 1.00 1.00 C ATOM 1141 CD1 LEU A 621 -27.500 5.775 16.889 1.00 1.00 C ATOM 1142 CD2 LEU A 621 -26.154 5.458 19.015 1.00 1.00 C ATOM 0 H LEU A 621 -26.102 0.998 17.663 1.00 1.00 H new ATOM 0 HA LEU A 621 -28.057 2.645 16.127 1.00 1.00 H new ATOM 0 HB2 LEU A 621 -28.227 3.592 18.129 1.00 1.00 H new ATOM 0 HB3 LEU A 621 -26.685 2.980 18.696 1.00 1.00 H new ATOM 0 HG LEU A 621 -25.651 4.745 17.077 1.00 1.00 H new ATOM 0 HD11 LEU A 621 -27.035 6.754 16.771 1.00 1.00 H new ATOM 0 HD12 LEU A 621 -27.697 5.346 15.906 1.00 1.00 H new ATOM 0 HD13 LEU A 621 -28.439 5.882 17.433 1.00 1.00 H new ATOM 0 HD21 LEU A 621 -25.717 6.444 18.855 1.00 1.00 H new ATOM 0 HD22 LEU A 621 -27.033 5.550 19.652 1.00 1.00 H new ATOM 0 HD23 LEU A 621 -25.422 4.811 19.498 1.00 1.00 H new ATOM 1154 N LEU A 622 -26.271 3.946 14.880 1.00 1.00 N ATOM 1155 CA LEU A 622 -25.317 4.410 13.888 1.00 1.00 C ATOM 1156 C LEU A 622 -25.554 5.897 13.614 1.00 1.00 C ATOM 1157 O LEU A 622 -26.266 6.252 12.676 1.00 1.00 O ATOM 1158 CB LEU A 622 -25.380 3.535 12.635 1.00 1.00 C ATOM 1159 CG LEU A 622 -24.364 2.394 12.562 1.00 1.00 C ATOM 1160 CD1 LEU A 622 -24.581 1.546 11.306 1.00 1.00 C ATOM 1161 CD2 LEU A 622 -22.933 2.925 12.654 1.00 1.00 C ATOM 0 H LEU A 622 -27.136 4.485 14.924 1.00 1.00 H new ATOM 0 HA LEU A 622 -24.299 4.314 14.264 1.00 1.00 H new ATOM 0 HB2 LEU A 622 -26.381 3.109 12.563 1.00 1.00 H new ATOM 0 HB3 LEU A 622 -25.242 4.174 11.763 1.00 1.00 H new ATOM 0 HG LEU A 622 -24.521 1.743 13.422 1.00 1.00 H new ATOM 0 HD11 LEU A 622 -23.846 0.742 11.278 1.00 1.00 H new ATOM 0 HD12 LEU A 622 -25.584 1.120 11.323 1.00 1.00 H new ATOM 0 HD13 LEU A 622 -24.468 2.172 10.421 1.00 1.00 H new ATOM 0 HD21 LEU A 622 -22.232 2.092 12.600 1.00 1.00 H new ATOM 0 HD22 LEU A 622 -22.746 3.612 11.828 1.00 1.00 H new ATOM 0 HD23 LEU A 622 -22.800 3.450 13.600 1.00 1.00 H new ATOM 1173 N LYS A 623 -24.944 6.725 14.448 1.00 1.00 N ATOM 1174 CA LYS A 623 -25.080 8.164 14.308 1.00 1.00 C ATOM 1175 C LYS A 623 -24.041 8.675 13.307 1.00 1.00 C ATOM 1176 O LYS A 623 -22.886 8.251 13.334 1.00 1.00 O ATOM 1177 CB LYS A 623 -25.002 8.846 15.675 1.00 1.00 C ATOM 1178 CG LYS A 623 -23.566 8.858 16.202 1.00 1.00 C ATOM 1179 CD LYS A 623 -23.486 8.228 17.594 1.00 1.00 C ATOM 1180 CE LYS A 623 -24.055 9.172 18.656 1.00 1.00 C ATOM 1181 NZ LYS A 623 -22.983 9.631 19.568 1.00 1.00 N ATOM 0 H LYS A 623 -24.354 6.426 15.224 1.00 1.00 H new ATOM 0 HA LYS A 623 -26.062 8.416 13.907 1.00 1.00 H new ATOM 0 HB2 LYS A 623 -25.373 9.868 15.597 1.00 1.00 H new ATOM 0 HB3 LYS A 623 -25.648 8.326 16.382 1.00 1.00 H new ATOM 0 HG2 LYS A 623 -22.918 8.313 15.515 1.00 1.00 H new ATOM 0 HG3 LYS A 623 -23.198 9.883 16.242 1.00 1.00 H new ATOM 0 HD2 LYS A 623 -24.038 7.288 17.604 1.00 1.00 H new ATOM 0 HD3 LYS A 623 -22.449 7.991 17.831 1.00 1.00 H new ATOM 0 HE2 LYS A 623 -24.524 10.030 18.175 1.00 1.00 H new ATOM 0 HE3 LYS A 623 -24.832 8.662 19.226 1.00 1.00 H new ATOM 0 HZ1 LYS A 623 -23.385 10.271 20.283 1.00 1.00 H new ATOM 0 HZ2 LYS A 623 -22.554 8.810 20.041 1.00 1.00 H new ATOM 0 HZ3 LYS A 623 -22.255 10.135 19.022 1.00 1.00 H new ATOM 1195 N ILE A 624 -24.489 9.578 12.448 1.00 1.00 N ATOM 1196 CA ILE A 624 -23.613 10.150 11.440 1.00 1.00 C ATOM 1197 C ILE A 624 -23.255 11.584 11.836 1.00 1.00 C ATOM 1198 O ILE A 624 -24.073 12.292 12.422 1.00 1.00 O ATOM 1199 CB ILE A 624 -24.248 10.037 10.051 1.00 1.00 C ATOM 1200 CG1 ILE A 624 -24.505 8.574 9.685 1.00 1.00 C ATOM 1201 CG2 ILE A 624 -23.395 10.750 9.000 1.00 1.00 C ATOM 1202 CD1 ILE A 624 -25.487 8.466 8.517 1.00 1.00 C ATOM 0 H ILE A 624 -25.447 9.928 12.429 1.00 1.00 H new ATOM 0 HA ILE A 624 -22.679 9.590 11.386 1.00 1.00 H new ATOM 0 HB ILE A 624 -25.216 10.538 10.074 1.00 1.00 H new ATOM 0 HG12 ILE A 624 -23.564 8.091 9.420 1.00 1.00 H new ATOM 0 HG13 ILE A 624 -24.903 8.043 10.550 1.00 1.00 H new ATOM 0 HG21 ILE A 624 -23.868 10.655 8.022 1.00 1.00 H new ATOM 0 HG22 ILE A 624 -23.305 11.805 9.259 1.00 1.00 H new ATOM 0 HG23 ILE A 624 -22.403 10.299 8.969 1.00 1.00 H new ATOM 0 HD11 ILE A 624 -25.653 7.416 8.277 1.00 1.00 H new ATOM 0 HD12 ILE A 624 -26.434 8.929 8.794 1.00 1.00 H new ATOM 0 HD13 ILE A 624 -25.075 8.977 7.647 1.00 1.00 H new ATOM 1214 N ARG A 625 -22.033 11.970 11.500 1.00 1.00 N ATOM 1215 CA ARG A 625 -21.556 13.305 11.814 1.00 1.00 C ATOM 1216 C ARG A 625 -22.140 14.322 10.831 1.00 1.00 C ATOM 1217 O ARG A 625 -21.825 15.509 10.898 1.00 1.00 O ATOM 1218 CB ARG A 625 -20.029 13.373 11.760 1.00 1.00 C ATOM 1219 CG ARG A 625 -19.546 13.756 10.359 1.00 1.00 C ATOM 1220 CD ARG A 625 -18.019 13.716 10.275 1.00 1.00 C ATOM 1221 NE ARG A 625 -17.581 13.977 8.886 1.00 1.00 N ATOM 1222 CZ ARG A 625 -16.377 14.462 8.557 1.00 1.00 C ATOM 1223 NH1 ARG A 625 -15.483 14.742 9.515 1.00 1.00 N ATOM 1224 NH2 ARG A 625 -16.066 14.667 7.269 1.00 1.00 N ATOM 0 H ARG A 625 -21.358 11.380 11.013 1.00 1.00 H new ATOM 0 HA ARG A 625 -21.882 13.543 12.826 1.00 1.00 H new ATOM 0 HB2 ARG A 625 -19.668 14.103 12.485 1.00 1.00 H new ATOM 0 HB3 ARG A 625 -19.608 12.408 12.042 1.00 1.00 H new ATOM 0 HG2 ARG A 625 -19.972 13.073 9.624 1.00 1.00 H new ATOM 0 HG3 ARG A 625 -19.901 14.756 10.109 1.00 1.00 H new ATOM 0 HD2 ARG A 625 -17.590 14.460 10.946 1.00 1.00 H new ATOM 0 HD3 ARG A 625 -17.654 12.743 10.603 1.00 1.00 H new ATOM 0 HE ARG A 625 -18.237 13.775 8.132 1.00 1.00 H new ATOM 0 HH11 ARG A 625 -15.720 14.586 10.495 1.00 1.00 H new ATOM 0 HH12 ARG A 625 -14.566 15.111 9.264 1.00 1.00 H new ATOM 0 HH21 ARG A 625 -16.747 14.454 6.540 1.00 1.00 H new ATOM 0 HH22 ARG A 625 -15.149 15.036 7.018 1.00 1.00 H new ATOM 1238 N GLY A 626 -22.980 13.818 9.938 1.00 1.00 N ATOM 1239 CA GLY A 626 -23.611 14.668 8.941 1.00 1.00 C ATOM 1240 C GLY A 626 -24.941 15.222 9.456 1.00 1.00 C ATOM 1241 O GLY A 626 -25.446 16.217 8.937 1.00 1.00 O ATOM 0 H GLY A 626 -23.238 12.833 9.884 1.00 1.00 H new ATOM 0 HA2 GLY A 626 -22.944 15.492 8.686 1.00 1.00 H new ATOM 0 HA3 GLY A 626 -23.779 14.099 8.027 1.00 1.00 H new ATOM 1245 N GLY A 627 -25.471 14.556 10.471 1.00 1.00 N ATOM 1246 CA GLY A 627 -26.732 14.969 11.062 1.00 1.00 C ATOM 1247 C GLY A 627 -27.827 13.934 10.796 1.00 1.00 C ATOM 1248 O GLY A 627 -28.966 14.293 10.500 1.00 1.00 O ATOM 0 H GLY A 627 -25.049 13.732 10.900 1.00 1.00 H new ATOM 0 HA2 GLY A 627 -26.607 15.104 12.136 1.00 1.00 H new ATOM 0 HA3 GLY A 627 -27.031 15.934 10.652 1.00 1.00 H new ATOM 1252 N LYS A 628 -27.444 12.671 10.912 1.00 1.00 N ATOM 1253 CA LYS A 628 -28.379 11.582 10.689 1.00 1.00 C ATOM 1254 C LYS A 628 -28.119 10.473 11.712 1.00 1.00 C ATOM 1255 O LYS A 628 -27.118 10.507 12.427 1.00 1.00 O ATOM 1256 CB LYS A 628 -28.311 11.107 9.236 1.00 1.00 C ATOM 1257 CG LYS A 628 -29.632 11.371 8.511 1.00 1.00 C ATOM 1258 CD LYS A 628 -29.568 12.674 7.713 1.00 1.00 C ATOM 1259 CE LYS A 628 -28.622 12.540 6.519 1.00 1.00 C ATOM 1260 NZ LYS A 628 -29.351 12.768 5.252 1.00 1.00 N ATOM 0 H LYS A 628 -26.498 12.378 11.158 1.00 1.00 H new ATOM 0 HA LYS A 628 -29.403 11.922 10.842 1.00 1.00 H new ATOM 0 HB2 LYS A 628 -27.500 11.620 8.719 1.00 1.00 H new ATOM 0 HB3 LYS A 628 -28.083 10.041 9.208 1.00 1.00 H new ATOM 0 HG2 LYS A 628 -29.856 10.541 7.841 1.00 1.00 H new ATOM 0 HG3 LYS A 628 -30.445 11.424 9.236 1.00 1.00 H new ATOM 0 HD2 LYS A 628 -30.566 12.940 7.363 1.00 1.00 H new ATOM 0 HD3 LYS A 628 -29.231 13.484 8.359 1.00 1.00 H new ATOM 0 HE2 LYS A 628 -27.807 13.258 6.611 1.00 1.00 H new ATOM 0 HE3 LYS A 628 -28.173 11.547 6.513 1.00 1.00 H new ATOM 0 HZ1 LYS A 628 -28.694 12.673 4.451 1.00 1.00 H new ATOM 0 HZ2 LYS A 628 -30.113 12.067 5.159 1.00 1.00 H new ATOM 0 HZ3 LYS A 628 -29.759 13.725 5.254 1.00 1.00 H new ATOM 1274 N GLN A 629 -29.036 9.518 11.749 1.00 1.00 N ATOM 1275 CA GLN A 629 -28.918 8.403 12.671 1.00 1.00 C ATOM 1276 C GLN A 629 -29.381 7.107 12.001 1.00 1.00 C ATOM 1277 O GLN A 629 -30.277 7.126 11.159 1.00 1.00 O ATOM 1278 CB GLN A 629 -29.707 8.666 13.955 1.00 1.00 C ATOM 1279 CG GLN A 629 -28.991 9.694 14.837 1.00 1.00 C ATOM 1280 CD GLN A 629 -29.644 11.072 14.714 1.00 1.00 C ATOM 1281 OE1 GLN A 629 -30.768 11.216 14.260 1.00 1.00 O ATOM 1282 NE2 GLN A 629 -28.881 12.073 15.142 1.00 1.00 N ATOM 0 H GLN A 629 -29.865 9.494 11.155 1.00 1.00 H new ATOM 0 HA GLN A 629 -27.868 8.294 12.944 1.00 1.00 H new ATOM 0 HB2 GLN A 629 -30.705 9.027 13.706 1.00 1.00 H new ATOM 0 HB3 GLN A 629 -29.834 7.734 14.506 1.00 1.00 H new ATOM 0 HG2 GLN A 629 -29.017 9.367 15.877 1.00 1.00 H new ATOM 0 HG3 GLN A 629 -27.942 9.758 14.549 1.00 1.00 H new ATOM 0 HE21 GLN A 629 -27.949 11.882 15.511 1.00 1.00 H new ATOM 0 HE22 GLN A 629 -29.227 13.032 15.102 1.00 1.00 H new ATOM 1291 N PHE A 630 -28.747 6.013 12.399 1.00 1.00 N ATOM 1292 CA PHE A 630 -29.083 4.712 11.845 1.00 1.00 C ATOM 1293 C PHE A 630 -29.233 3.669 12.955 1.00 1.00 C ATOM 1294 O PHE A 630 -28.586 3.766 13.996 1.00 1.00 O ATOM 1295 CB PHE A 630 -27.927 4.304 10.931 1.00 1.00 C ATOM 1296 CG PHE A 630 -28.213 4.501 9.440 1.00 1.00 C ATOM 1297 CD1 PHE A 630 -29.346 3.986 8.892 1.00 1.00 C ATOM 1298 CD2 PHE A 630 -27.334 5.193 8.665 1.00 1.00 C ATOM 1299 CE1 PHE A 630 -29.612 4.169 7.509 1.00 1.00 C ATOM 1300 CE2 PHE A 630 -27.601 5.376 7.283 1.00 1.00 C ATOM 1301 CZ PHE A 630 -28.734 4.860 6.733 1.00 1.00 C ATOM 0 H PHE A 630 -28.004 6.001 13.097 1.00 1.00 H new ATOM 0 HA PHE A 630 -30.028 4.768 11.304 1.00 1.00 H new ATOM 0 HB2 PHE A 630 -27.043 4.882 11.200 1.00 1.00 H new ATOM 0 HB3 PHE A 630 -27.689 3.255 11.109 1.00 1.00 H new ATOM 0 HD1 PHE A 630 -30.043 3.438 9.508 1.00 1.00 H new ATOM 0 HD2 PHE A 630 -26.435 5.602 9.101 1.00 1.00 H new ATOM 0 HE1 PHE A 630 -30.511 3.760 7.073 1.00 1.00 H new ATOM 0 HE2 PHE A 630 -26.904 5.925 6.667 1.00 1.00 H new ATOM 0 HZ PHE A 630 -28.936 4.999 5.681 1.00 1.00 H new ATOM 1311 N ILE A 631 -30.091 2.693 12.693 1.00 1.00 N ATOM 1312 CA ILE A 631 -30.335 1.632 13.655 1.00 1.00 C ATOM 1313 C ILE A 631 -30.172 0.276 12.966 1.00 1.00 C ATOM 1314 O ILE A 631 -30.859 -0.013 11.987 1.00 1.00 O ATOM 1315 CB ILE A 631 -31.696 1.822 14.327 1.00 1.00 C ATOM 1316 CG1 ILE A 631 -31.539 2.389 15.738 1.00 1.00 C ATOM 1317 CG2 ILE A 631 -32.496 0.516 14.321 1.00 1.00 C ATOM 1318 CD1 ILE A 631 -32.150 3.788 15.838 1.00 1.00 C ATOM 0 H ILE A 631 -30.626 2.615 11.828 1.00 1.00 H new ATOM 0 HA ILE A 631 -29.600 1.670 14.459 1.00 1.00 H new ATOM 0 HB ILE A 631 -32.262 2.552 13.749 1.00 1.00 H new ATOM 0 HG12 ILE A 631 -32.021 1.726 16.456 1.00 1.00 H new ATOM 0 HG13 ILE A 631 -30.482 2.430 16.002 1.00 1.00 H new ATOM 0 HG21 ILE A 631 -33.460 0.677 14.804 1.00 1.00 H new ATOM 0 HG22 ILE A 631 -32.656 0.192 13.293 1.00 1.00 H new ATOM 0 HG23 ILE A 631 -31.943 -0.252 14.862 1.00 1.00 H new ATOM 0 HD11 ILE A 631 -32.025 4.168 16.852 1.00 1.00 H new ATOM 0 HD12 ILE A 631 -31.649 4.455 15.136 1.00 1.00 H new ATOM 0 HD13 ILE A 631 -33.212 3.739 15.597 1.00 1.00 H new ATOM 1330 N LEU A 632 -29.258 -0.519 13.503 1.00 1.00 N ATOM 1331 CA LEU A 632 -28.996 -1.837 12.952 1.00 1.00 C ATOM 1332 C LEU A 632 -29.597 -2.900 13.874 1.00 1.00 C ATOM 1333 O LEU A 632 -29.773 -2.662 15.068 1.00 1.00 O ATOM 1334 CB LEU A 632 -27.499 -2.022 12.692 1.00 1.00 C ATOM 1335 CG LEU A 632 -26.765 -0.812 12.111 1.00 1.00 C ATOM 1336 CD1 LEU A 632 -26.224 0.089 13.223 1.00 1.00 C ATOM 1337 CD2 LEU A 632 -25.664 -1.253 11.143 1.00 1.00 C ATOM 0 H LEU A 632 -28.690 -0.275 14.314 1.00 1.00 H new ATOM 0 HA LEU A 632 -29.480 -1.947 11.981 1.00 1.00 H new ATOM 0 HB2 LEU A 632 -27.019 -2.297 13.631 1.00 1.00 H new ATOM 0 HB3 LEU A 632 -27.370 -2.862 12.010 1.00 1.00 H new ATOM 0 HG LEU A 632 -27.480 -0.221 11.539 1.00 1.00 H new ATOM 0 HD11 LEU A 632 -25.707 0.941 12.782 1.00 1.00 H new ATOM 0 HD12 LEU A 632 -27.051 0.445 13.838 1.00 1.00 H new ATOM 0 HD13 LEU A 632 -25.528 -0.476 13.843 1.00 1.00 H new ATOM 0 HD21 LEU A 632 -25.157 -0.374 10.744 1.00 1.00 H new ATOM 0 HD22 LEU A 632 -24.944 -1.878 11.671 1.00 1.00 H new ATOM 0 HD23 LEU A 632 -26.106 -1.821 10.324 1.00 1.00 H new ATOM 1349 N GLN A 633 -29.895 -4.049 13.284 1.00 1.00 N ATOM 1350 CA GLN A 633 -30.472 -5.148 14.039 1.00 1.00 C ATOM 1351 C GLN A 633 -30.168 -6.481 13.352 1.00 1.00 C ATOM 1352 O GLN A 633 -30.309 -6.602 12.135 1.00 1.00 O ATOM 1353 CB GLN A 633 -31.979 -4.957 14.222 1.00 1.00 C ATOM 1354 CG GLN A 633 -32.566 -6.050 15.116 1.00 1.00 C ATOM 1355 CD GLN A 633 -34.077 -5.874 15.278 1.00 1.00 C ATOM 1356 OE1 GLN A 633 -34.676 -4.938 14.774 1.00 1.00 O ATOM 1357 NE2 GLN A 633 -34.657 -6.823 16.006 1.00 1.00 N ATOM 0 H GLN A 633 -29.748 -4.242 12.293 1.00 1.00 H new ATOM 0 HA GLN A 633 -30.018 -5.160 15.030 1.00 1.00 H new ATOM 0 HB2 GLN A 633 -32.174 -3.979 14.662 1.00 1.00 H new ATOM 0 HB3 GLN A 633 -32.472 -4.974 13.250 1.00 1.00 H new ATOM 0 HG2 GLN A 633 -32.354 -7.029 14.686 1.00 1.00 H new ATOM 0 HG3 GLN A 633 -32.086 -6.021 16.094 1.00 1.00 H new ATOM 0 HE21 GLN A 633 -34.096 -7.579 16.399 1.00 1.00 H new ATOM 0 HE22 GLN A 633 -35.663 -6.795 16.172 1.00 1.00 H new ATOM 1366 N CYS A 634 -29.758 -7.448 14.159 1.00 1.00 N ATOM 1367 CA CYS A 634 -29.433 -8.766 13.643 1.00 1.00 C ATOM 1368 C CYS A 634 -29.890 -9.809 14.666 1.00 1.00 C ATOM 1369 O CYS A 634 -30.002 -9.510 15.854 1.00 1.00 O ATOM 1370 CB CYS A 634 -27.943 -8.897 13.323 1.00 1.00 C ATOM 1371 SG CYS A 634 -27.717 -9.330 11.559 1.00 1.00 S ATOM 0 H CYS A 634 -29.643 -7.345 15.167 1.00 1.00 H new ATOM 0 HA CYS A 634 -29.956 -8.929 12.701 1.00 1.00 H new ATOM 0 HB2 CYS A 634 -27.431 -7.960 13.544 1.00 1.00 H new ATOM 0 HB3 CYS A 634 -27.493 -9.663 13.955 1.00 1.00 H new ATOM 0 HG CYS A 634 -26.459 -9.230 11.245 1.00 1.00 H new ATOM 1377 N ASP A 635 -30.143 -11.009 14.167 1.00 1.00 N ATOM 1378 CA ASP A 635 -30.587 -12.097 15.022 1.00 1.00 C ATOM 1379 C ASP A 635 -29.381 -12.681 15.763 1.00 1.00 C ATOM 1380 O ASP A 635 -29.540 -13.346 16.786 1.00 1.00 O ATOM 1381 CB ASP A 635 -31.227 -13.218 14.201 1.00 1.00 C ATOM 1382 CG ASP A 635 -32.504 -13.809 14.800 1.00 1.00 C ATOM 1383 OD1 ASP A 635 -33.278 -13.019 15.381 1.00 1.00 O ATOM 1384 OD2 ASP A 635 -32.677 -15.040 14.663 1.00 1.00 O ATOM 0 H ASP A 635 -30.049 -11.253 13.181 1.00 1.00 H new ATOM 0 HA ASP A 635 -31.323 -11.699 15.721 1.00 1.00 H new ATOM 0 HB2 ASP A 635 -31.454 -12.835 13.206 1.00 1.00 H new ATOM 0 HB3 ASP A 635 -30.498 -14.018 14.076 1.00 1.00 H new ATOM 1389 N SER A 636 -28.205 -12.411 15.217 1.00 1.00 N ATOM 1390 CA SER A 636 -26.974 -12.902 15.813 1.00 1.00 C ATOM 1391 C SER A 636 -26.353 -11.820 16.699 1.00 1.00 C ATOM 1392 O SER A 636 -26.461 -10.631 16.401 1.00 1.00 O ATOM 1393 CB SER A 636 -25.978 -13.342 14.737 1.00 1.00 C ATOM 1394 OG SER A 636 -26.634 -13.850 13.578 1.00 1.00 O ATOM 0 H SER A 636 -28.078 -11.859 14.369 1.00 1.00 H new ATOM 0 HA SER A 636 -27.214 -13.771 16.426 1.00 1.00 H new ATOM 0 HB2 SER A 636 -25.350 -12.496 14.457 1.00 1.00 H new ATOM 0 HB3 SER A 636 -25.318 -14.108 15.145 1.00 1.00 H new ATOM 0 HG SER A 636 -26.145 -14.629 13.240 1.00 1.00 H new ATOM 1400 N ASP A 637 -25.717 -12.269 17.771 1.00 1.00 N ATOM 1401 CA ASP A 637 -25.079 -11.355 18.702 1.00 1.00 C ATOM 1402 C ASP A 637 -23.735 -10.905 18.128 1.00 1.00 C ATOM 1403 O ASP A 637 -23.349 -9.746 18.274 1.00 1.00 O ATOM 1404 CB ASP A 637 -24.816 -12.032 20.048 1.00 1.00 C ATOM 1405 CG ASP A 637 -25.818 -11.687 21.152 1.00 1.00 C ATOM 1406 OD1 ASP A 637 -27.030 -11.731 20.852 1.00 1.00 O ATOM 1407 OD2 ASP A 637 -25.349 -11.388 22.272 1.00 1.00 O ATOM 0 H ASP A 637 -25.630 -13.255 18.015 1.00 1.00 H new ATOM 0 HA ASP A 637 -25.746 -10.506 18.851 1.00 1.00 H new ATOM 0 HB2 ASP A 637 -24.818 -13.112 19.901 1.00 1.00 H new ATOM 0 HB3 ASP A 637 -23.817 -11.758 20.386 1.00 1.00 H new ATOM 1412 N PRO A 638 -23.038 -11.870 17.470 1.00 1.00 N ATOM 1413 CA PRO A 638 -21.745 -11.587 16.874 1.00 1.00 C ATOM 1414 C PRO A 638 -21.901 -10.774 15.587 1.00 1.00 C ATOM 1415 O PRO A 638 -21.408 -9.651 15.495 1.00 1.00 O ATOM 1416 CB PRO A 638 -21.110 -12.948 16.643 1.00 1.00 C ATOM 1417 CG PRO A 638 -22.250 -13.952 16.686 1.00 1.00 C ATOM 1418 CD PRO A 638 -23.464 -13.254 17.277 1.00 1.00 C ATOM 0 HA PRO A 638 -21.113 -10.972 17.515 1.00 1.00 H new ATOM 0 HB2 PRO A 638 -20.596 -12.981 15.682 1.00 1.00 H new ATOM 0 HB3 PRO A 638 -20.367 -13.168 17.410 1.00 1.00 H new ATOM 0 HG2 PRO A 638 -22.472 -14.321 15.685 1.00 1.00 H new ATOM 0 HG3 PRO A 638 -21.975 -14.816 17.290 1.00 1.00 H new ATOM 0 HD2 PRO A 638 -24.321 -13.315 16.606 1.00 1.00 H new ATOM 0 HD3 PRO A 638 -23.764 -13.711 18.220 1.00 1.00 H new ATOM 1426 N GLU A 639 -22.587 -11.373 14.626 1.00 1.00 N ATOM 1427 CA GLU A 639 -22.815 -10.718 13.349 1.00 1.00 C ATOM 1428 C GLU A 639 -22.659 -9.203 13.494 1.00 1.00 C ATOM 1429 O GLU A 639 -21.616 -8.647 13.150 1.00 1.00 O ATOM 1430 CB GLU A 639 -24.192 -11.077 12.787 1.00 1.00 C ATOM 1431 CG GLU A 639 -24.254 -12.551 12.382 1.00 1.00 C ATOM 1432 CD GLU A 639 -23.381 -12.820 11.155 1.00 1.00 C ATOM 1433 OE1 GLU A 639 -23.497 -12.030 10.193 1.00 1.00 O ATOM 1434 OE2 GLU A 639 -22.619 -13.809 11.207 1.00 1.00 O ATOM 0 H GLU A 639 -22.993 -12.305 14.705 1.00 1.00 H new ATOM 0 HA GLU A 639 -22.066 -11.074 12.641 1.00 1.00 H new ATOM 0 HB2 GLU A 639 -24.958 -10.869 13.534 1.00 1.00 H new ATOM 0 HB3 GLU A 639 -24.410 -10.450 11.923 1.00 1.00 H new ATOM 0 HG2 GLU A 639 -23.922 -13.174 13.212 1.00 1.00 H new ATOM 0 HG3 GLU A 639 -25.286 -12.830 12.167 1.00 1.00 H new ATOM 1441 N LEU A 640 -23.710 -8.578 14.002 1.00 1.00 N ATOM 1442 CA LEU A 640 -23.703 -7.137 14.196 1.00 1.00 C ATOM 1443 C LEU A 640 -22.431 -6.735 14.945 1.00 1.00 C ATOM 1444 O LEU A 640 -21.712 -5.834 14.515 1.00 1.00 O ATOM 1445 CB LEU A 640 -24.991 -6.683 14.884 1.00 1.00 C ATOM 1446 CG LEU A 640 -25.581 -5.358 14.397 1.00 1.00 C ATOM 1447 CD1 LEU A 640 -24.601 -4.206 14.628 1.00 1.00 C ATOM 1448 CD2 LEU A 640 -26.015 -5.457 12.934 1.00 1.00 C ATOM 0 H LEU A 640 -24.573 -9.042 14.286 1.00 1.00 H new ATOM 0 HA LEU A 640 -23.684 -6.623 13.235 1.00 1.00 H new ATOM 0 HB2 LEU A 640 -25.742 -7.462 14.754 1.00 1.00 H new ATOM 0 HB3 LEU A 640 -24.798 -6.601 15.954 1.00 1.00 H new ATOM 0 HG LEU A 640 -26.474 -5.144 14.984 1.00 1.00 H new ATOM 0 HD11 LEU A 640 -25.044 -3.275 14.273 1.00 1.00 H new ATOM 0 HD12 LEU A 640 -24.383 -4.122 15.693 1.00 1.00 H new ATOM 0 HD13 LEU A 640 -23.677 -4.399 14.083 1.00 1.00 H new ATOM 0 HD21 LEU A 640 -26.431 -4.502 12.612 1.00 1.00 H new ATOM 0 HD22 LEU A 640 -25.153 -5.704 12.315 1.00 1.00 H new ATOM 0 HD23 LEU A 640 -26.771 -6.235 12.831 1.00 1.00 H new ATOM 1460 N VAL A 641 -22.191 -7.423 16.052 1.00 1.00 N ATOM 1461 CA VAL A 641 -21.019 -7.149 16.865 1.00 1.00 C ATOM 1462 C VAL A 641 -19.805 -6.958 15.952 1.00 1.00 C ATOM 1463 O VAL A 641 -19.179 -5.897 15.959 1.00 1.00 O ATOM 1464 CB VAL A 641 -20.823 -8.262 17.895 1.00 1.00 C ATOM 1465 CG1 VAL A 641 -19.377 -8.762 17.893 1.00 1.00 C ATOM 1466 CG2 VAL A 641 -21.242 -7.798 19.291 1.00 1.00 C ATOM 0 H VAL A 641 -22.789 -8.170 16.405 1.00 1.00 H new ATOM 0 HA VAL A 641 -21.152 -6.225 17.428 1.00 1.00 H new ATOM 0 HB VAL A 641 -21.466 -9.096 17.614 1.00 1.00 H new ATOM 0 HG11 VAL A 641 -19.265 -9.553 18.634 1.00 1.00 H new ATOM 0 HG12 VAL A 641 -19.128 -9.152 16.906 1.00 1.00 H new ATOM 0 HG13 VAL A 641 -18.707 -7.938 18.137 1.00 1.00 H new ATOM 0 HG21 VAL A 641 -21.092 -8.609 20.004 1.00 1.00 H new ATOM 0 HG22 VAL A 641 -20.638 -6.940 19.586 1.00 1.00 H new ATOM 0 HG23 VAL A 641 -22.294 -7.515 19.280 1.00 1.00 H new ATOM 1476 N GLN A 642 -19.509 -7.999 15.190 1.00 1.00 N ATOM 1477 CA GLN A 642 -18.380 -7.959 14.275 1.00 1.00 C ATOM 1478 C GLN A 642 -18.548 -6.814 13.275 1.00 1.00 C ATOM 1479 O GLN A 642 -17.585 -6.119 12.953 1.00 1.00 O ATOM 1480 CB GLN A 642 -18.213 -9.298 13.552 1.00 1.00 C ATOM 1481 CG GLN A 642 -16.892 -9.965 13.935 1.00 1.00 C ATOM 1482 CD GLN A 642 -17.138 -11.278 14.684 1.00 1.00 C ATOM 1483 OE1 GLN A 642 -18.233 -11.815 14.704 1.00 1.00 O ATOM 1484 NE2 GLN A 642 -16.061 -11.761 15.297 1.00 1.00 N ATOM 0 H GLN A 642 -20.030 -8.876 15.186 1.00 1.00 H new ATOM 0 HA GLN A 642 -17.474 -7.780 14.854 1.00 1.00 H new ATOM 0 HB2 GLN A 642 -19.044 -9.957 13.803 1.00 1.00 H new ATOM 0 HB3 GLN A 642 -18.246 -9.140 12.474 1.00 1.00 H new ATOM 0 HG2 GLN A 642 -16.304 -10.159 13.038 1.00 1.00 H new ATOM 0 HG3 GLN A 642 -16.307 -9.290 14.560 1.00 1.00 H new ATOM 0 HE21 GLN A 642 -15.174 -11.260 15.240 1.00 1.00 H new ATOM 0 HE22 GLN A 642 -16.122 -12.632 15.824 1.00 1.00 H new ATOM 1493 N TRP A 643 -19.780 -6.650 12.812 1.00 1.00 N ATOM 1494 CA TRP A 643 -20.086 -5.601 11.855 1.00 1.00 C ATOM 1495 C TRP A 643 -19.551 -4.281 12.414 1.00 1.00 C ATOM 1496 O TRP A 643 -18.846 -3.549 11.720 1.00 1.00 O ATOM 1497 CB TRP A 643 -21.585 -5.557 11.550 1.00 1.00 C ATOM 1498 CG TRP A 643 -21.991 -6.360 10.312 1.00 1.00 C ATOM 1499 CD1 TRP A 643 -22.361 -7.646 10.249 1.00 1.00 C ATOM 1500 CD2 TRP A 643 -22.054 -5.874 8.955 1.00 1.00 C ATOM 1501 NE1 TRP A 643 -22.658 -8.024 8.955 1.00 1.00 N ATOM 1502 CE2 TRP A 643 -22.465 -6.912 8.142 1.00 1.00 C ATOM 1503 CE3 TRP A 643 -21.774 -4.600 8.431 1.00 1.00 C ATOM 1504 CZ2 TRP A 643 -22.631 -6.783 6.759 1.00 1.00 C ATOM 1505 CZ3 TRP A 643 -21.946 -4.487 7.046 1.00 1.00 C ATOM 1506 CH2 TRP A 643 -22.359 -5.521 6.215 1.00 1.00 C ATOM 0 H TRP A 643 -20.577 -7.226 13.082 1.00 1.00 H new ATOM 0 HA TRP A 643 -19.600 -5.797 10.899 1.00 1.00 H new ATOM 0 HB2 TRP A 643 -22.132 -5.937 12.413 1.00 1.00 H new ATOM 0 HB3 TRP A 643 -21.887 -4.519 11.413 1.00 1.00 H new ATOM 0 HD1 TRP A 643 -22.420 -8.304 11.103 1.00 1.00 H new ATOM 0 HE1 TRP A 643 -22.963 -8.949 8.651 1.00 1.00 H new ATOM 0 HE3 TRP A 643 -21.452 -3.774 9.048 1.00 1.00 H new ATOM 0 HZ2 TRP A 643 -22.951 -7.611 6.144 1.00 1.00 H new ATOM 0 HZ3 TRP A 643 -21.743 -3.528 6.592 1.00 1.00 H new ATOM 0 HH2 TRP A 643 -22.470 -5.353 5.154 1.00 1.00 H new ATOM 1517 N LYS A 644 -19.906 -4.016 13.662 1.00 1.00 N ATOM 1518 CA LYS A 644 -19.472 -2.798 14.323 1.00 1.00 C ATOM 1519 C LYS A 644 -17.949 -2.677 14.210 1.00 1.00 C ATOM 1520 O LYS A 644 -17.441 -1.712 13.644 1.00 1.00 O ATOM 1521 CB LYS A 644 -19.987 -2.755 15.762 1.00 1.00 C ATOM 1522 CG LYS A 644 -19.525 -1.480 16.472 1.00 1.00 C ATOM 1523 CD LYS A 644 -20.722 -0.639 16.923 1.00 1.00 C ATOM 1524 CE LYS A 644 -21.192 -1.057 18.317 1.00 1.00 C ATOM 1525 NZ LYS A 644 -22.667 -0.987 18.410 1.00 1.00 N ATOM 0 H LYS A 644 -20.491 -4.626 14.234 1.00 1.00 H new ATOM 0 HA LYS A 644 -19.900 -1.925 13.831 1.00 1.00 H new ATOM 0 HB2 LYS A 644 -21.076 -2.802 15.764 1.00 1.00 H new ATOM 0 HB3 LYS A 644 -19.629 -3.629 16.306 1.00 1.00 H new ATOM 0 HG2 LYS A 644 -18.914 -1.742 17.336 1.00 1.00 H new ATOM 0 HG3 LYS A 644 -18.896 -0.894 15.802 1.00 1.00 H new ATOM 0 HD2 LYS A 644 -20.448 0.416 16.929 1.00 1.00 H new ATOM 0 HD3 LYS A 644 -21.539 -0.752 16.211 1.00 1.00 H new ATOM 0 HE2 LYS A 644 -20.856 -2.072 18.531 1.00 1.00 H new ATOM 0 HE3 LYS A 644 -20.743 -0.407 19.068 1.00 1.00 H new ATOM 0 HZ1 LYS A 644 -22.944 -0.801 19.395 1.00 1.00 H new ATOM 0 HZ2 LYS A 644 -23.017 -0.220 17.801 1.00 1.00 H new ATOM 0 HZ3 LYS A 644 -23.078 -1.890 18.099 1.00 1.00 H new ATOM 1539 N LYS A 645 -17.268 -3.671 14.759 1.00 1.00 N ATOM 1540 CA LYS A 645 -15.814 -3.689 14.727 1.00 1.00 C ATOM 1541 C LYS A 645 -15.333 -3.163 13.373 1.00 1.00 C ATOM 1542 O LYS A 645 -14.462 -2.294 13.315 1.00 1.00 O ATOM 1543 CB LYS A 645 -15.289 -5.084 15.068 1.00 1.00 C ATOM 1544 CG LYS A 645 -13.821 -5.026 15.497 1.00 1.00 C ATOM 1545 CD LYS A 645 -12.897 -4.922 14.281 1.00 1.00 C ATOM 1546 CE LYS A 645 -11.435 -4.798 14.713 1.00 1.00 C ATOM 1547 NZ LYS A 645 -10.686 -6.028 14.373 1.00 1.00 N ATOM 0 H LYS A 645 -17.695 -4.470 15.228 1.00 1.00 H new ATOM 0 HA LYS A 645 -15.406 -3.026 15.490 1.00 1.00 H new ATOM 0 HB2 LYS A 645 -15.889 -5.517 15.868 1.00 1.00 H new ATOM 0 HB3 LYS A 645 -15.393 -5.738 14.202 1.00 1.00 H new ATOM 0 HG2 LYS A 645 -13.664 -4.169 16.152 1.00 1.00 H new ATOM 0 HG3 LYS A 645 -13.571 -5.917 16.073 1.00 1.00 H new ATOM 0 HD2 LYS A 645 -13.020 -5.802 13.650 1.00 1.00 H new ATOM 0 HD3 LYS A 645 -13.177 -4.057 13.680 1.00 1.00 H new ATOM 0 HE2 LYS A 645 -10.977 -3.939 14.222 1.00 1.00 H new ATOM 0 HE3 LYS A 645 -11.381 -4.618 15.787 1.00 1.00 H new ATOM 0 HZ1 LYS A 645 -9.696 -5.926 14.674 1.00 1.00 H new ATOM 0 HZ2 LYS A 645 -11.114 -6.841 14.861 1.00 1.00 H new ATOM 0 HZ3 LYS A 645 -10.722 -6.183 13.345 1.00 1.00 H new ATOM 1561 N GLU A 646 -15.918 -3.711 12.318 1.00 1.00 N ATOM 1562 CA GLU A 646 -15.559 -3.307 10.970 1.00 1.00 C ATOM 1563 C GLU A 646 -16.126 -1.920 10.662 1.00 1.00 C ATOM 1564 O GLU A 646 -15.481 -1.116 9.989 1.00 1.00 O ATOM 1565 CB GLU A 646 -16.038 -4.336 9.944 1.00 1.00 C ATOM 1566 CG GLU A 646 -15.490 -5.728 10.267 1.00 1.00 C ATOM 1567 CD GLU A 646 -16.623 -6.748 10.392 1.00 1.00 C ATOM 1568 OE1 GLU A 646 -17.655 -6.536 9.719 1.00 1.00 O ATOM 1569 OE2 GLU A 646 -16.432 -7.716 11.159 1.00 1.00 O ATOM 0 H GLU A 646 -16.638 -4.431 12.370 1.00 1.00 H new ATOM 0 HA GLU A 646 -14.472 -3.256 10.904 1.00 1.00 H new ATOM 0 HB2 GLU A 646 -17.128 -4.364 9.933 1.00 1.00 H new ATOM 0 HB3 GLU A 646 -15.716 -4.037 8.946 1.00 1.00 H new ATOM 0 HG2 GLU A 646 -14.799 -6.041 9.485 1.00 1.00 H new ATOM 0 HG3 GLU A 646 -14.923 -5.693 11.197 1.00 1.00 H new ATOM 1576 N LEU A 647 -17.327 -1.681 11.168 1.00 1.00 N ATOM 1577 CA LEU A 647 -17.990 -0.405 10.953 1.00 1.00 C ATOM 1578 C LEU A 647 -17.222 0.692 11.693 1.00 1.00 C ATOM 1579 O LEU A 647 -16.697 1.615 11.071 1.00 1.00 O ATOM 1580 CB LEU A 647 -19.465 -0.495 11.346 1.00 1.00 C ATOM 1581 CG LEU A 647 -20.421 -0.988 10.259 1.00 1.00 C ATOM 1582 CD1 LEU A 647 -21.311 -2.117 10.779 1.00 1.00 C ATOM 1583 CD2 LEU A 647 -21.239 0.169 9.683 1.00 1.00 C ATOM 0 H LEU A 647 -17.858 -2.349 11.726 1.00 1.00 H new ATOM 0 HA LEU A 647 -17.982 -0.144 9.895 1.00 1.00 H new ATOM 0 HB2 LEU A 647 -19.551 -1.159 12.206 1.00 1.00 H new ATOM 0 HB3 LEU A 647 -19.794 0.492 11.671 1.00 1.00 H new ATOM 0 HG LEU A 647 -19.826 -1.400 9.443 1.00 1.00 H new ATOM 0 HD11 LEU A 647 -21.980 -2.448 9.985 1.00 1.00 H new ATOM 0 HD12 LEU A 647 -20.689 -2.952 11.100 1.00 1.00 H new ATOM 0 HD13 LEU A 647 -21.899 -1.757 11.623 1.00 1.00 H new ATOM 0 HD21 LEU A 647 -21.911 -0.209 8.912 1.00 1.00 H new ATOM 0 HD22 LEU A 647 -21.823 0.633 10.478 1.00 1.00 H new ATOM 0 HD23 LEU A 647 -20.567 0.909 9.248 1.00 1.00 H new ATOM 1595 N ARG A 648 -17.179 0.555 13.012 1.00 1.00 N ATOM 1596 CA ARG A 648 -16.485 1.524 13.842 1.00 1.00 C ATOM 1597 C ARG A 648 -15.191 1.976 13.161 1.00 1.00 C ATOM 1598 O ARG A 648 -14.938 3.174 13.034 1.00 1.00 O ATOM 1599 CB ARG A 648 -16.151 0.934 15.213 1.00 1.00 C ATOM 1600 CG ARG A 648 -16.027 2.035 16.268 1.00 1.00 C ATOM 1601 CD ARG A 648 -14.990 1.663 17.331 1.00 1.00 C ATOM 1602 NE ARG A 648 -13.873 2.633 17.309 1.00 1.00 N ATOM 1603 CZ ARG A 648 -12.747 2.500 18.025 1.00 1.00 C ATOM 1604 NH1 ARG A 648 -12.584 1.435 18.823 1.00 1.00 N ATOM 1605 NH2 ARG A 648 -11.786 3.430 17.940 1.00 1.00 N ATOM 0 H ARG A 648 -17.614 -0.212 13.525 1.00 1.00 H new ATOM 0 HA ARG A 648 -17.147 2.379 13.978 1.00 1.00 H new ATOM 0 HB2 ARG A 648 -16.928 0.228 15.508 1.00 1.00 H new ATOM 0 HB3 ARG A 648 -15.217 0.375 15.155 1.00 1.00 H new ATOM 0 HG2 ARG A 648 -15.742 2.972 15.789 1.00 1.00 H new ATOM 0 HG3 ARG A 648 -16.995 2.201 16.741 1.00 1.00 H new ATOM 0 HD2 ARG A 648 -15.455 1.653 18.317 1.00 1.00 H new ATOM 0 HD3 ARG A 648 -14.613 0.657 17.147 1.00 1.00 H new ATOM 0 HE ARG A 648 -13.965 3.455 16.712 1.00 1.00 H new ATOM 0 HH11 ARG A 648 -13.316 0.727 18.885 1.00 1.00 H new ATOM 0 HH12 ARG A 648 -11.728 1.332 19.368 1.00 1.00 H new ATOM 0 HH21 ARG A 648 -11.911 4.239 17.331 1.00 1.00 H new ATOM 0 HH22 ARG A 648 -10.929 3.329 18.484 1.00 1.00 H new ATOM 1619 N ASP A 649 -14.406 0.995 12.741 1.00 1.00 N ATOM 1620 CA ASP A 649 -13.145 1.278 12.076 1.00 1.00 C ATOM 1621 C ASP A 649 -13.422 1.960 10.734 1.00 1.00 C ATOM 1622 O ASP A 649 -12.910 3.044 10.469 1.00 1.00 O ATOM 1623 CB ASP A 649 -12.368 -0.011 11.800 1.00 1.00 C ATOM 1624 CG ASP A 649 -10.967 0.191 11.217 1.00 1.00 C ATOM 1625 OD1 ASP A 649 -10.890 0.405 9.988 1.00 1.00 O ATOM 1626 OD2 ASP A 649 -10.006 0.129 12.014 1.00 1.00 O ATOM 0 H ASP A 649 -14.619 0.003 12.848 1.00 1.00 H new ATOM 0 HA ASP A 649 -12.556 1.922 12.729 1.00 1.00 H new ATOM 0 HB2 ASP A 649 -12.281 -0.571 12.731 1.00 1.00 H new ATOM 0 HB3 ASP A 649 -12.947 -0.626 11.111 1.00 1.00 H new ATOM 1631 N ALA A 650 -14.233 1.292 9.926 1.00 1.00 N ATOM 1632 CA ALA A 650 -14.585 1.822 8.619 1.00 1.00 C ATOM 1633 C ALA A 650 -14.753 3.339 8.713 1.00 1.00 C ATOM 1634 O ALA A 650 -14.334 4.071 7.819 1.00 1.00 O ATOM 1635 CB ALA A 650 -15.849 1.125 8.110 1.00 1.00 C ATOM 0 H ALA A 650 -14.655 0.391 10.150 1.00 1.00 H new ATOM 0 HA ALA A 650 -13.790 1.625 7.899 1.00 1.00 H new ATOM 0 HB1 ALA A 650 -16.114 1.522 7.130 1.00 1.00 H new ATOM 0 HB2 ALA A 650 -15.667 0.053 8.030 1.00 1.00 H new ATOM 0 HB3 ALA A 650 -16.668 1.303 8.807 1.00 1.00 H new ATOM 1641 N TYR A 651 -15.366 3.766 9.808 1.00 1.00 N ATOM 1642 CA TYR A 651 -15.595 5.184 10.032 1.00 1.00 C ATOM 1643 C TYR A 651 -14.332 5.866 10.563 1.00 1.00 C ATOM 1644 O TYR A 651 -14.008 6.980 10.159 1.00 1.00 O ATOM 1645 CB TYR A 651 -16.693 5.270 11.094 1.00 1.00 C ATOM 1646 CG TYR A 651 -17.998 4.577 10.698 1.00 1.00 C ATOM 1647 CD1 TYR A 651 -18.223 4.230 9.382 1.00 1.00 C ATOM 1648 CD2 TYR A 651 -18.951 4.300 11.657 1.00 1.00 C ATOM 1649 CE1 TYR A 651 -19.452 3.577 9.009 1.00 1.00 C ATOM 1650 CE2 TYR A 651 -20.179 3.647 11.285 1.00 1.00 C ATOM 1651 CZ TYR A 651 -20.369 3.319 9.978 1.00 1.00 C ATOM 1652 OH TYR A 651 -21.530 2.702 9.628 1.00 1.00 O ATOM 0 H TYR A 651 -15.711 3.156 10.549 1.00 1.00 H new ATOM 0 HA TYR A 651 -15.873 5.680 9.102 1.00 1.00 H new ATOM 0 HB2 TYR A 651 -16.325 4.827 12.019 1.00 1.00 H new ATOM 0 HB3 TYR A 651 -16.900 6.319 11.304 1.00 1.00 H new ATOM 0 HD1 TYR A 651 -17.478 4.448 8.631 1.00 1.00 H new ATOM 0 HD2 TYR A 651 -18.776 4.573 12.687 1.00 1.00 H new ATOM 0 HE1 TYR A 651 -19.640 3.299 7.983 1.00 1.00 H new ATOM 0 HE2 TYR A 651 -20.932 3.423 12.026 1.00 1.00 H new ATOM 0 HH TYR A 651 -21.640 2.740 8.655 1.00 1.00 H new ATOM 1662 N ARG A 652 -13.655 5.166 11.463 1.00 1.00 N ATOM 1663 CA ARG A 652 -12.436 5.689 12.055 1.00 1.00 C ATOM 1664 C ARG A 652 -11.315 5.728 11.013 1.00 1.00 C ATOM 1665 O ARG A 652 -10.483 6.633 11.026 1.00 1.00 O ATOM 1666 CB ARG A 652 -11.989 4.835 13.243 1.00 1.00 C ATOM 1667 CG ARG A 652 -10.956 3.792 12.811 1.00 1.00 C ATOM 1668 CD ARG A 652 -10.735 2.752 13.911 1.00 1.00 C ATOM 1669 NE ARG A 652 -9.448 3.008 14.597 1.00 1.00 N ATOM 1670 CZ ARG A 652 -8.254 2.965 13.992 1.00 1.00 C ATOM 1671 NH1 ARG A 652 -8.173 2.676 12.686 1.00 1.00 N ATOM 1672 NH2 ARG A 652 -7.138 3.210 14.694 1.00 1.00 N ATOM 0 H ARG A 652 -13.928 4.241 11.796 1.00 1.00 H new ATOM 0 HA ARG A 652 -12.645 6.699 12.408 1.00 1.00 H new ATOM 0 HB2 ARG A 652 -11.563 5.475 14.016 1.00 1.00 H new ATOM 0 HB3 ARG A 652 -12.853 4.336 13.682 1.00 1.00 H new ATOM 0 HG2 ARG A 652 -11.292 3.297 11.900 1.00 1.00 H new ATOM 0 HG3 ARG A 652 -10.012 4.285 12.576 1.00 1.00 H new ATOM 0 HD2 ARG A 652 -11.554 2.791 14.630 1.00 1.00 H new ATOM 0 HD3 ARG A 652 -10.735 1.750 13.481 1.00 1.00 H new ATOM 0 HE ARG A 652 -9.472 3.231 15.592 1.00 1.00 H new ATOM 0 HH11 ARG A 652 -9.021 2.488 12.152 1.00 1.00 H new ATOM 0 HH12 ARG A 652 -7.263 2.644 12.226 1.00 1.00 H new ATOM 0 HH21 ARG A 652 -7.199 3.429 15.688 1.00 1.00 H new ATOM 0 HH22 ARG A 652 -6.228 3.177 14.234 1.00 1.00 H new ATOM 1686 N GLU A 653 -11.330 4.734 10.138 1.00 1.00 N ATOM 1687 CA GLU A 653 -10.325 4.644 9.091 1.00 1.00 C ATOM 1688 C GLU A 653 -10.548 5.738 8.045 1.00 1.00 C ATOM 1689 O GLU A 653 -9.591 6.280 7.496 1.00 1.00 O ATOM 1690 CB GLU A 653 -10.332 3.258 8.444 1.00 1.00 C ATOM 1691 CG GLU A 653 -8.971 2.936 7.823 1.00 1.00 C ATOM 1692 CD GLU A 653 -8.259 1.829 8.605 1.00 1.00 C ATOM 1693 OE1 GLU A 653 -8.766 0.688 8.560 1.00 1.00 O ATOM 1694 OE2 GLU A 653 -7.226 2.150 9.229 1.00 1.00 O ATOM 0 H GLU A 653 -12.021 3.984 10.132 1.00 1.00 H new ATOM 0 HA GLU A 653 -9.344 4.795 9.542 1.00 1.00 H new ATOM 0 HB2 GLU A 653 -10.582 2.505 9.191 1.00 1.00 H new ATOM 0 HB3 GLU A 653 -11.105 3.215 7.677 1.00 1.00 H new ATOM 0 HG2 GLU A 653 -9.104 2.626 6.787 1.00 1.00 H new ATOM 0 HG3 GLU A 653 -8.352 3.833 7.810 1.00 1.00 H new ATOM 1701 N ALA A 654 -11.817 6.030 7.801 1.00 1.00 N ATOM 1702 CA ALA A 654 -12.178 7.050 6.831 1.00 1.00 C ATOM 1703 C ALA A 654 -12.001 8.433 7.461 1.00 1.00 C ATOM 1704 O ALA A 654 -11.314 9.289 6.906 1.00 1.00 O ATOM 1705 CB ALA A 654 -13.608 6.810 6.344 1.00 1.00 C ATOM 0 H ALA A 654 -12.609 5.578 8.259 1.00 1.00 H new ATOM 0 HA ALA A 654 -11.525 6.998 5.960 1.00 1.00 H new ATOM 0 HB1 ALA A 654 -13.878 7.576 5.617 1.00 1.00 H new ATOM 0 HB2 ALA A 654 -13.673 5.827 5.878 1.00 1.00 H new ATOM 0 HB3 ALA A 654 -14.293 6.856 7.190 1.00 1.00 H new ATOM 1711 N GLN A 655 -12.633 8.608 8.612 1.00 1.00 N ATOM 1712 CA GLN A 655 -12.554 9.872 9.324 1.00 1.00 C ATOM 1713 C GLN A 655 -11.106 10.362 9.379 1.00 1.00 C ATOM 1714 O GLN A 655 -10.827 11.521 9.079 1.00 1.00 O ATOM 1715 CB GLN A 655 -13.144 9.747 10.731 1.00 1.00 C ATOM 1716 CG GLN A 655 -12.170 9.034 11.672 1.00 1.00 C ATOM 1717 CD GLN A 655 -12.730 8.972 13.095 1.00 1.00 C ATOM 1718 OE1 GLN A 655 -12.081 9.336 14.062 1.00 1.00 O ATOM 1719 NE2 GLN A 655 -13.967 8.490 13.169 1.00 1.00 N ATOM 0 H GLN A 655 -13.202 7.896 9.069 1.00 1.00 H new ATOM 0 HA GLN A 655 -13.146 10.609 8.781 1.00 1.00 H new ATOM 0 HB2 GLN A 655 -13.374 10.738 11.122 1.00 1.00 H new ATOM 0 HB3 GLN A 655 -14.083 9.196 10.688 1.00 1.00 H new ATOM 0 HG2 GLN A 655 -11.980 8.024 11.308 1.00 1.00 H new ATOM 0 HG3 GLN A 655 -11.214 9.557 11.676 1.00 1.00 H new ATOM 0 HE21 GLN A 655 -14.454 8.203 12.320 1.00 1.00 H new ATOM 0 HE22 GLN A 655 -14.429 8.407 14.075 1.00 1.00 H new