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 618 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 619 CYS SG : rot 23:sc= -1.57! USER MOD Set 1.3: A 633 GLN : amide:sc= -1.52! C(o=-3.1!,f=-8.6!) USER MOD Single : A 559 CYS SG : rot 72:sc= 1.12 USER MOD Single : A 561 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 562 HIS : no HD1:sc= -0.0768 X(o=-0.077,f=0) USER MOD Single : A 564 TYR OH : rot 165:sc= -3.27! USER MOD Single : A 565 MET CE :methyl -146:sc= -0.462 (180deg=-6.13!) USER MOD Single : A 566 SER OG : rot -29:sc= 0.276! USER MOD Single : A 567 LYS NZ :NH3+ -122:sc= 0.259 (180deg=0) USER MOD Single : A 580 TYR OH : rot 180:sc= 0 USER MOD Single : A 582 TYR OH : rot 180:sc= 0 USER MOD Single : A 586 ASN : amide:sc= -4.88! C(o=-4.9!,f=-6.5!) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 603 MET CE :methyl 147:sc= -8.31! (180deg=-11.1!) USER MOD Single : A 607 GLN : amide:sc= 0.21 X(o=0.21,f=0) USER MOD Single : A 608 SER OG : rot 53:sc= 1.21 USER MOD Single : A 612 THR OG1 : rot 180:sc= -0.427 USER MOD Single : A 613 GLN : amide:sc= -0.0266 K(o=-0.027,f=-0.71) USER MOD Single : A 615 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= -1.05 K(o=-1,f=-2.8!) USER MOD Single : A 634 CYS SG : rot 50:sc= -4.28! USER MOD Single : A 636 SER OG : rot -130:sc= -0.026 USER MOD Single : A 642 GLN : amide:sc= -0.544 K(o=-0.54,f=-1.7) USER MOD Single : A 644 LYS NZ :NH3+ -170:sc= -8.01! (180deg=-8.61!) USER MOD Single : A 645 LYS NZ :NH3+ -160:sc= -0.0216 (180deg=-0.33) USER MOD Single : A 651 TYR OH : rot 0:sc= -3.12! USER MOD Single : A 655 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 96 N CYS A 559 -13.447 -5.286 0.274 1.00 1.00 N ATOM 97 CA CYS A 559 -14.574 -5.734 1.074 1.00 1.00 C ATOM 98 C CYS A 559 -14.043 -6.207 2.430 1.00 1.00 C ATOM 99 O CYS A 559 -13.078 -6.968 2.491 1.00 1.00 O ATOM 100 CB CYS A 559 -15.375 -6.828 0.363 1.00 1.00 C ATOM 101 SG CYS A 559 -17.104 -6.827 0.959 1.00 1.00 S ATOM 0 HA CYS A 559 -15.267 -4.907 1.224 1.00 1.00 H new ATOM 0 HB2 CYS A 559 -15.353 -6.664 -0.714 1.00 1.00 H new ATOM 0 HB3 CYS A 559 -14.919 -7.801 0.546 1.00 1.00 H new ATOM 0 HG CYS A 559 -17.723 -5.783 0.493 1.00 1.00 H new ATOM 107 N ILE A 560 -14.696 -5.736 3.482 1.00 1.00 N ATOM 108 CA ILE A 560 -14.302 -6.100 4.830 1.00 1.00 C ATOM 109 C ILE A 560 -15.155 -7.278 5.307 1.00 1.00 C ATOM 110 O ILE A 560 -14.648 -8.385 5.482 1.00 1.00 O ATOM 111 CB ILE A 560 -14.365 -4.882 5.755 1.00 1.00 C ATOM 112 CG1 ILE A 560 -13.428 -3.775 5.269 1.00 1.00 C ATOM 113 CG2 ILE A 560 -14.082 -5.279 7.205 1.00 1.00 C ATOM 114 CD1 ILE A 560 -13.885 -2.407 5.777 1.00 1.00 C ATOM 0 H ILE A 560 -15.496 -5.105 3.427 1.00 1.00 H new ATOM 0 HA ILE A 560 -13.263 -6.431 4.846 1.00 1.00 H new ATOM 0 HB ILE A 560 -15.378 -4.482 5.724 1.00 1.00 H new ATOM 0 HG12 ILE A 560 -12.414 -3.975 5.614 1.00 1.00 H new ATOM 0 HG13 ILE A 560 -13.399 -3.771 4.179 1.00 1.00 H new ATOM 0 HG21 ILE A 560 -14.133 -4.395 7.841 1.00 1.00 H new ATOM 0 HG22 ILE A 560 -14.824 -6.006 7.535 1.00 1.00 H new ATOM 0 HG23 ILE A 560 -13.087 -5.719 7.274 1.00 1.00 H new ATOM 0 HD11 ILE A 560 -13.201 -1.638 5.417 1.00 1.00 H new ATOM 0 HD12 ILE A 560 -14.890 -2.200 5.410 1.00 1.00 H new ATOM 0 HD13 ILE A 560 -13.890 -2.407 6.867 1.00 1.00 H new ATOM 126 N MET A 561 -16.436 -7.000 5.501 1.00 1.00 N ATOM 127 CA MET A 561 -17.363 -8.022 5.952 1.00 1.00 C ATOM 128 C MET A 561 -18.669 -7.966 5.159 1.00 1.00 C ATOM 129 O MET A 561 -19.081 -6.900 4.708 1.00 1.00 O ATOM 130 CB MET A 561 -17.660 -7.821 7.440 1.00 1.00 C ATOM 131 CG MET A 561 -17.660 -9.158 8.186 1.00 1.00 C ATOM 132 SD MET A 561 -16.139 -9.345 9.103 1.00 1.00 S ATOM 133 CE MET A 561 -15.512 -10.841 8.361 1.00 1.00 C ATOM 0 H MET A 561 -16.853 -6.081 5.354 1.00 1.00 H new ATOM 0 HA MET A 561 -16.905 -8.998 5.792 1.00 1.00 H new ATOM 0 HB2 MET A 561 -16.914 -7.157 7.877 1.00 1.00 H new ATOM 0 HB3 MET A 561 -18.628 -7.335 7.559 1.00 1.00 H new ATOM 0 HG2 MET A 561 -18.512 -9.205 8.865 1.00 1.00 H new ATOM 0 HG3 MET A 561 -17.771 -9.979 7.478 1.00 1.00 H new ATOM 0 HE1 MET A 561 -14.559 -11.103 8.821 1.00 1.00 H new ATOM 0 HE2 MET A 561 -16.225 -11.651 8.516 1.00 1.00 H new ATOM 0 HE3 MET A 561 -15.368 -10.684 7.292 1.00 1.00 H new ATOM 143 N HIS A 562 -19.285 -9.130 5.011 1.00 1.00 N ATOM 144 CA HIS A 562 -20.536 -9.229 4.280 1.00 1.00 C ATOM 145 C HIS A 562 -21.469 -10.212 4.986 1.00 1.00 C ATOM 146 O HIS A 562 -21.035 -10.976 5.847 1.00 1.00 O ATOM 147 CB HIS A 562 -20.283 -9.599 2.817 1.00 1.00 C ATOM 148 CG HIS A 562 -19.244 -10.678 2.628 1.00 1.00 C ATOM 149 ND1 HIS A 562 -19.573 -12.002 2.394 1.00 1.00 N ATOM 150 CD2 HIS A 562 -17.882 -10.615 2.638 1.00 1.00 C ATOM 151 CE1 HIS A 562 -18.451 -12.696 2.273 1.00 1.00 C ATOM 152 NE2 HIS A 562 -17.404 -11.836 2.425 1.00 1.00 N ATOM 0 H HIS A 562 -18.940 -10.014 5.386 1.00 1.00 H new ATOM 0 HA HIS A 562 -21.031 -8.258 4.269 1.00 1.00 H new ATOM 0 HB2 HIS A 562 -21.220 -9.929 2.369 1.00 1.00 H new ATOM 0 HB3 HIS A 562 -19.968 -8.707 2.276 1.00 1.00 H new ATOM 0 HD2 HIS A 562 -17.292 -9.724 2.793 1.00 1.00 H new ATOM 0 HE1 HIS A 562 -18.378 -13.757 2.087 1.00 1.00 H new ATOM 0 HE2 HIS A 562 -16.417 -12.088 2.382 1.00 1.00 H new ATOM 160 N GLY A 563 -22.735 -10.162 4.597 1.00 1.00 N ATOM 161 CA GLY A 563 -23.734 -11.041 5.183 1.00 1.00 C ATOM 162 C GLY A 563 -25.105 -10.364 5.221 1.00 1.00 C ATOM 163 O GLY A 563 -25.324 -9.358 4.548 1.00 1.00 O ATOM 0 H GLY A 563 -23.092 -9.527 3.883 1.00 1.00 H new ATOM 0 HA2 GLY A 563 -23.796 -11.963 4.605 1.00 1.00 H new ATOM 0 HA3 GLY A 563 -23.433 -11.317 6.193 1.00 1.00 H new ATOM 167 N TYR A 564 -25.993 -10.942 6.017 1.00 1.00 N ATOM 168 CA TYR A 564 -27.337 -10.408 6.151 1.00 1.00 C ATOM 169 C TYR A 564 -27.446 -9.503 7.380 1.00 1.00 C ATOM 170 O TYR A 564 -27.099 -9.910 8.487 1.00 1.00 O ATOM 171 CB TYR A 564 -28.255 -11.617 6.339 1.00 1.00 C ATOM 172 CG TYR A 564 -29.623 -11.470 5.669 1.00 1.00 C ATOM 173 CD1 TYR A 564 -30.141 -10.214 5.426 1.00 1.00 C ATOM 174 CD2 TYR A 564 -30.339 -12.593 5.308 1.00 1.00 C ATOM 175 CE1 TYR A 564 -31.428 -10.076 4.795 1.00 1.00 C ATOM 176 CE2 TYR A 564 -31.627 -12.454 4.677 1.00 1.00 C ATOM 177 CZ TYR A 564 -32.108 -11.203 4.452 1.00 1.00 C ATOM 178 OH TYR A 564 -33.323 -11.072 3.857 1.00 1.00 O ATOM 0 H TYR A 564 -25.807 -11.775 6.576 1.00 1.00 H new ATOM 0 HA TYR A 564 -27.603 -9.814 5.277 1.00 1.00 H new ATOM 0 HB2 TYR A 564 -27.760 -12.502 5.940 1.00 1.00 H new ATOM 0 HB3 TYR A 564 -28.401 -11.787 7.406 1.00 1.00 H new ATOM 0 HD1 TYR A 564 -29.581 -9.335 5.709 1.00 1.00 H new ATOM 0 HD2 TYR A 564 -29.934 -13.576 5.498 1.00 1.00 H new ATOM 0 HE1 TYR A 564 -31.844 -9.099 4.598 1.00 1.00 H new ATOM 0 HE2 TYR A 564 -32.197 -13.325 4.389 1.00 1.00 H new ATOM 0 HH TYR A 564 -33.584 -11.927 3.454 1.00 1.00 H new ATOM 188 N MET A 565 -27.931 -8.292 7.143 1.00 1.00 N ATOM 189 CA MET A 565 -28.091 -7.327 8.217 1.00 1.00 C ATOM 190 C MET A 565 -29.392 -6.537 8.056 1.00 1.00 C ATOM 191 O MET A 565 -29.698 -6.056 6.965 1.00 1.00 O ATOM 192 CB MET A 565 -26.904 -6.363 8.217 1.00 1.00 C ATOM 193 CG MET A 565 -26.069 -6.518 9.490 1.00 1.00 C ATOM 194 SD MET A 565 -25.721 -4.915 10.193 1.00 1.00 S ATOM 195 CE MET A 565 -25.072 -4.080 8.754 1.00 1.00 C ATOM 0 H MET A 565 -28.218 -7.958 6.223 1.00 1.00 H new ATOM 0 HA MET A 565 -28.132 -7.867 9.163 1.00 1.00 H new ATOM 0 HB2 MET A 565 -26.279 -6.550 7.344 1.00 1.00 H new ATOM 0 HB3 MET A 565 -27.264 -5.337 8.137 1.00 1.00 H new ATOM 0 HG2 MET A 565 -26.605 -7.133 10.213 1.00 1.00 H new ATOM 0 HG3 MET A 565 -25.136 -7.034 9.262 1.00 1.00 H new ATOM 0 HE1 MET A 565 -24.296 -3.378 9.060 1.00 1.00 H new ATOM 0 HE2 MET A 565 -24.648 -4.813 8.068 1.00 1.00 H new ATOM 0 HE3 MET A 565 -25.875 -3.538 8.255 1.00 1.00 H new ATOM 205 N SER A 566 -30.121 -6.428 9.157 1.00 1.00 N ATOM 206 CA SER A 566 -31.381 -5.704 9.150 1.00 1.00 C ATOM 207 C SER A 566 -31.250 -4.419 9.970 1.00 1.00 C ATOM 208 O SER A 566 -30.823 -4.455 11.123 1.00 1.00 O ATOM 209 CB SER A 566 -32.516 -6.571 9.699 1.00 1.00 C ATOM 210 OG SER A 566 -32.584 -6.524 11.123 1.00 1.00 O ATOM 0 H SER A 566 -29.864 -6.828 10.059 1.00 1.00 H new ATOM 0 HA SER A 566 -31.623 -5.446 8.119 1.00 1.00 H new ATOM 0 HB2 SER A 566 -33.464 -6.235 9.280 1.00 1.00 H new ATOM 0 HB3 SER A 566 -32.373 -7.602 9.377 1.00 1.00 H new ATOM 0 HG SER A 566 -31.691 -6.352 11.488 1.00 1.00 H new ATOM 216 N LYS A 567 -31.626 -3.314 9.342 1.00 1.00 N ATOM 217 CA LYS A 567 -31.555 -2.020 9.999 1.00 1.00 C ATOM 218 C LYS A 567 -32.854 -1.252 9.743 1.00 1.00 C ATOM 219 O LYS A 567 -33.448 -1.371 8.673 1.00 1.00 O ATOM 220 CB LYS A 567 -30.299 -1.266 9.562 1.00 1.00 C ATOM 221 CG LYS A 567 -30.423 0.229 9.865 1.00 1.00 C ATOM 222 CD LYS A 567 -30.625 1.034 8.579 1.00 1.00 C ATOM 223 CE LYS A 567 -32.099 1.058 8.172 1.00 1.00 C ATOM 224 NZ LYS A 567 -32.399 2.270 7.377 1.00 1.00 N ATOM 0 H LYS A 567 -31.980 -3.288 8.386 1.00 1.00 H new ATOM 0 HA LYS A 567 -31.464 -2.144 11.078 1.00 1.00 H new ATOM 0 HB2 LYS A 567 -29.429 -1.674 10.076 1.00 1.00 H new ATOM 0 HB3 LYS A 567 -30.136 -1.412 8.494 1.00 1.00 H new ATOM 0 HG2 LYS A 567 -31.262 0.399 10.540 1.00 1.00 H new ATOM 0 HG3 LYS A 567 -29.526 0.575 10.378 1.00 1.00 H new ATOM 0 HD2 LYS A 567 -30.268 2.053 8.724 1.00 1.00 H new ATOM 0 HD3 LYS A 567 -30.030 0.599 7.776 1.00 1.00 H new ATOM 0 HE2 LYS A 567 -32.336 0.167 7.591 1.00 1.00 H new ATOM 0 HE3 LYS A 567 -32.728 1.035 9.062 1.00 1.00 H new ATOM 0 HZ1 LYS A 567 -33.151 2.815 7.845 1.00 1.00 H new ATOM 0 HZ2 LYS A 567 -31.543 2.856 7.300 1.00 1.00 H new ATOM 0 HZ3 LYS A 567 -32.715 1.992 6.426 1.00 1.00 H new ATOM 401 N ARG A 578 -35.187 -5.548 6.962 1.00 1.00 N ATOM 402 CA ARG A 578 -34.173 -6.587 6.908 1.00 1.00 C ATOM 403 C ARG A 578 -33.753 -6.844 5.459 1.00 1.00 C ATOM 404 O ARG A 578 -34.590 -7.167 4.615 1.00 1.00 O ATOM 405 CB ARG A 578 -34.687 -7.892 7.522 1.00 1.00 C ATOM 406 CG ARG A 578 -34.028 -9.105 6.862 1.00 1.00 C ATOM 407 CD ARG A 578 -34.881 -9.631 5.707 1.00 1.00 C ATOM 408 NE ARG A 578 -34.977 -11.107 5.780 1.00 1.00 N ATOM 409 CZ ARG A 578 -35.819 -11.843 5.043 1.00 1.00 C ATOM 410 NH1 ARG A 578 -36.644 -11.244 4.171 1.00 1.00 N ATOM 411 NH2 ARG A 578 -35.838 -13.176 5.175 1.00 1.00 N ATOM 0 HA ARG A 578 -33.314 -6.242 7.483 1.00 1.00 H new ATOM 0 HB2 ARG A 578 -34.482 -7.900 8.593 1.00 1.00 H new ATOM 0 HB3 ARG A 578 -35.769 -7.952 7.404 1.00 1.00 H new ATOM 0 HG2 ARG A 578 -33.040 -8.831 6.493 1.00 1.00 H new ATOM 0 HG3 ARG A 578 -33.885 -9.893 7.601 1.00 1.00 H new ATOM 0 HD2 ARG A 578 -35.877 -9.191 5.750 1.00 1.00 H new ATOM 0 HD3 ARG A 578 -34.442 -9.333 4.755 1.00 1.00 H new ATOM 0 HE ARG A 578 -34.363 -11.594 6.433 1.00 1.00 H new ATOM 0 HH11 ARG A 578 -36.630 -10.229 4.070 1.00 1.00 H new ATOM 0 HH12 ARG A 578 -37.286 -11.803 3.609 1.00 1.00 H new ATOM 0 HH21 ARG A 578 -35.211 -13.632 5.838 1.00 1.00 H new ATOM 0 HH22 ARG A 578 -36.480 -13.735 4.613 1.00 1.00 H new ATOM 425 N ARG A 579 -32.461 -6.692 5.214 1.00 1.00 N ATOM 426 CA ARG A 579 -31.921 -6.904 3.882 1.00 1.00 C ATOM 427 C ARG A 579 -30.440 -7.277 3.963 1.00 1.00 C ATOM 428 O ARG A 579 -29.883 -7.394 5.055 1.00 1.00 O ATOM 429 CB ARG A 579 -32.078 -5.649 3.019 1.00 1.00 C ATOM 430 CG ARG A 579 -33.548 -5.246 2.898 1.00 1.00 C ATOM 431 CD ARG A 579 -33.765 -4.316 1.704 1.00 1.00 C ATOM 432 NE ARG A 579 -35.015 -3.543 1.885 1.00 1.00 N ATOM 433 CZ ARG A 579 -35.234 -2.334 1.351 1.00 1.00 C ATOM 434 NH1 ARG A 579 -34.290 -1.752 0.600 1.00 1.00 N ATOM 435 NH2 ARG A 579 -36.399 -1.707 1.568 1.00 1.00 N ATOM 0 H ARG A 579 -31.771 -6.424 5.916 1.00 1.00 H new ATOM 0 HA ARG A 579 -32.480 -7.720 3.423 1.00 1.00 H new ATOM 0 HB2 ARG A 579 -31.508 -4.829 3.456 1.00 1.00 H new ATOM 0 HB3 ARG A 579 -31.665 -5.832 2.027 1.00 1.00 H new ATOM 0 HG2 ARG A 579 -34.165 -6.137 2.786 1.00 1.00 H new ATOM 0 HG3 ARG A 579 -33.869 -4.749 3.814 1.00 1.00 H new ATOM 0 HD2 ARG A 579 -32.919 -3.636 1.603 1.00 1.00 H new ATOM 0 HD3 ARG A 579 -33.818 -4.898 0.784 1.00 1.00 H new ATOM 0 HE ARG A 579 -35.755 -3.957 2.452 1.00 1.00 H new ATOM 0 HH11 ARG A 579 -33.404 -2.229 0.434 1.00 1.00 H new ATOM 0 HH12 ARG A 579 -34.457 -0.832 0.194 1.00 1.00 H new ATOM 0 HH21 ARG A 579 -37.118 -2.150 2.139 1.00 1.00 H new ATOM 0 HH22 ARG A 579 -36.566 -0.786 1.162 1.00 1.00 H new ATOM 449 N TYR A 580 -29.842 -7.455 2.794 1.00 1.00 N ATOM 450 CA TYR A 580 -28.437 -7.813 2.718 1.00 1.00 C ATOM 451 C TYR A 580 -27.552 -6.564 2.698 1.00 1.00 C ATOM 452 O TYR A 580 -27.800 -5.636 1.930 1.00 1.00 O ATOM 453 CB TYR A 580 -28.263 -8.566 1.397 1.00 1.00 C ATOM 454 CG TYR A 580 -27.257 -9.716 1.465 1.00 1.00 C ATOM 455 CD1 TYR A 580 -25.903 -9.449 1.480 1.00 1.00 C ATOM 456 CD2 TYR A 580 -27.703 -11.023 1.511 1.00 1.00 C ATOM 457 CE1 TYR A 580 -24.956 -10.532 1.543 1.00 1.00 C ATOM 458 CE2 TYR A 580 -26.755 -12.105 1.574 1.00 1.00 C ATOM 459 CZ TYR A 580 -25.429 -11.806 1.587 1.00 1.00 C ATOM 460 OH TYR A 580 -24.534 -12.829 1.647 1.00 1.00 O ATOM 0 H TYR A 580 -30.306 -7.358 1.891 1.00 1.00 H new ATOM 0 HA TYR A 580 -28.148 -8.411 3.582 1.00 1.00 H new ATOM 0 HB2 TYR A 580 -29.230 -8.961 1.085 1.00 1.00 H new ATOM 0 HB3 TYR A 580 -27.943 -7.862 0.629 1.00 1.00 H new ATOM 0 HD1 TYR A 580 -25.554 -8.428 1.444 1.00 1.00 H new ATOM 0 HD2 TYR A 580 -28.762 -11.233 1.500 1.00 1.00 H new ATOM 0 HE1 TYR A 580 -23.894 -10.337 1.555 1.00 1.00 H new ATOM 0 HE2 TYR A 580 -27.090 -13.131 1.610 1.00 1.00 H new ATOM 0 HH TYR A 580 -25.014 -13.683 1.675 1.00 1.00 H new ATOM 470 N PHE A 581 -26.540 -6.582 3.552 1.00 1.00 N ATOM 471 CA PHE A 581 -25.617 -5.462 3.643 1.00 1.00 C ATOM 472 C PHE A 581 -24.197 -5.889 3.271 1.00 1.00 C ATOM 473 O PHE A 581 -23.904 -7.082 3.198 1.00 1.00 O ATOM 474 CB PHE A 581 -25.631 -4.989 5.098 1.00 1.00 C ATOM 475 CG PHE A 581 -26.580 -3.819 5.363 1.00 1.00 C ATOM 476 CD1 PHE A 581 -26.262 -2.573 4.923 1.00 1.00 C ATOM 477 CD2 PHE A 581 -27.740 -4.025 6.042 1.00 1.00 C ATOM 478 CE1 PHE A 581 -27.143 -1.486 5.171 1.00 1.00 C ATOM 479 CE2 PHE A 581 -28.622 -2.939 6.289 1.00 1.00 C ATOM 480 CZ PHE A 581 -28.304 -1.693 5.848 1.00 1.00 C ATOM 0 H PHE A 581 -26.338 -7.354 4.187 1.00 1.00 H new ATOM 0 HA PHE A 581 -25.921 -4.673 2.955 1.00 1.00 H new ATOM 0 HB2 PHE A 581 -25.914 -5.825 5.738 1.00 1.00 H new ATOM 0 HB3 PHE A 581 -24.621 -4.696 5.384 1.00 1.00 H new ATOM 0 HD1 PHE A 581 -25.340 -2.409 4.385 1.00 1.00 H new ATOM 0 HD2 PHE A 581 -27.991 -5.015 6.394 1.00 1.00 H new ATOM 0 HE1 PHE A 581 -26.891 -0.496 4.822 1.00 1.00 H new ATOM 0 HE2 PHE A 581 -29.544 -3.103 6.827 1.00 1.00 H new ATOM 0 HZ PHE A 581 -28.974 -0.867 6.035 1.00 1.00 H new ATOM 490 N TYR A 582 -23.354 -4.894 3.044 1.00 1.00 N ATOM 491 CA TYR A 582 -21.970 -5.153 2.681 1.00 1.00 C ATOM 492 C TYR A 582 -21.044 -4.076 3.249 1.00 1.00 C ATOM 493 O TYR A 582 -21.153 -2.905 2.887 1.00 1.00 O ATOM 494 CB TYR A 582 -21.919 -5.100 1.152 1.00 1.00 C ATOM 495 CG TYR A 582 -22.026 -6.469 0.479 1.00 1.00 C ATOM 496 CD1 TYR A 582 -20.901 -7.251 0.321 1.00 1.00 C ATOM 497 CD2 TYR A 582 -23.250 -6.923 0.029 1.00 1.00 C ATOM 498 CE1 TYR A 582 -21.001 -8.540 -0.313 1.00 1.00 C ATOM 499 CE2 TYR A 582 -23.351 -8.212 -0.606 1.00 1.00 C ATOM 500 CZ TYR A 582 -22.222 -8.957 -0.746 1.00 1.00 C ATOM 501 OH TYR A 582 -22.318 -10.174 -1.345 1.00 1.00 O ATOM 0 H TYR A 582 -23.601 -3.906 3.104 1.00 1.00 H new ATOM 0 HA TYR A 582 -21.642 -6.114 3.077 1.00 1.00 H new ATOM 0 HB2 TYR A 582 -22.730 -4.466 0.793 1.00 1.00 H new ATOM 0 HB3 TYR A 582 -20.985 -4.628 0.846 1.00 1.00 H new ATOM 0 HD1 TYR A 582 -19.944 -6.896 0.673 1.00 1.00 H new ATOM 0 HD2 TYR A 582 -24.132 -6.312 0.153 1.00 1.00 H new ATOM 0 HE1 TYR A 582 -20.127 -9.162 -0.442 1.00 1.00 H new ATOM 0 HE2 TYR A 582 -24.302 -8.579 -0.963 1.00 1.00 H new ATOM 0 HH TYR A 582 -23.249 -10.340 -1.601 1.00 1.00 H new ATOM 511 N LEU A 583 -20.153 -4.510 4.128 1.00 1.00 N ATOM 512 CA LEU A 583 -19.208 -3.597 4.747 1.00 1.00 C ATOM 513 C LEU A 583 -17.929 -3.545 3.909 1.00 1.00 C ATOM 514 O LEU A 583 -17.229 -4.548 3.776 1.00 1.00 O ATOM 515 CB LEU A 583 -18.970 -3.983 6.209 1.00 1.00 C ATOM 516 CG LEU A 583 -18.847 -2.824 7.199 1.00 1.00 C ATOM 517 CD1 LEU A 583 -20.142 -2.010 7.253 1.00 1.00 C ATOM 518 CD2 LEU A 583 -18.427 -3.325 8.582 1.00 1.00 C ATOM 0 H LEU A 583 -20.066 -5.482 4.426 1.00 1.00 H new ATOM 0 HA LEU A 583 -19.615 -2.586 4.769 1.00 1.00 H new ATOM 0 HB2 LEU A 583 -19.790 -4.625 6.532 1.00 1.00 H new ATOM 0 HB3 LEU A 583 -18.059 -4.578 6.263 1.00 1.00 H new ATOM 0 HG LEU A 583 -18.061 -2.156 6.847 1.00 1.00 H new ATOM 0 HD11 LEU A 583 -20.028 -1.192 7.964 1.00 1.00 H new ATOM 0 HD12 LEU A 583 -20.358 -1.604 6.265 1.00 1.00 H new ATOM 0 HD13 LEU A 583 -20.963 -2.653 7.568 1.00 1.00 H new ATOM 0 HD21 LEU A 583 -18.347 -2.480 9.266 1.00 1.00 H new ATOM 0 HD22 LEU A 583 -19.173 -4.026 8.957 1.00 1.00 H new ATOM 0 HD23 LEU A 583 -17.462 -3.826 8.510 1.00 1.00 H new ATOM 530 N PHE A 584 -17.663 -2.367 3.366 1.00 1.00 N ATOM 531 CA PHE A 584 -16.481 -2.172 2.543 1.00 1.00 C ATOM 532 C PHE A 584 -15.443 -1.314 3.270 1.00 1.00 C ATOM 533 O PHE A 584 -15.707 -0.803 4.357 1.00 1.00 O ATOM 534 CB PHE A 584 -16.932 -1.441 1.277 1.00 1.00 C ATOM 535 CG PHE A 584 -16.936 -2.314 0.022 1.00 1.00 C ATOM 536 CD1 PHE A 584 -17.663 -3.464 -0.005 1.00 1.00 C ATOM 537 CD2 PHE A 584 -16.212 -1.942 -1.069 1.00 1.00 C ATOM 538 CE1 PHE A 584 -17.666 -4.274 -1.172 1.00 1.00 C ATOM 539 CE2 PHE A 584 -16.216 -2.753 -2.233 1.00 1.00 C ATOM 540 CZ PHE A 584 -16.943 -3.903 -2.261 1.00 1.00 C ATOM 0 H PHE A 584 -18.245 -1.537 3.479 1.00 1.00 H new ATOM 0 HA PHE A 584 -16.023 -3.135 2.315 1.00 1.00 H new ATOM 0 HB2 PHE A 584 -17.936 -1.047 1.436 1.00 1.00 H new ATOM 0 HB3 PHE A 584 -16.276 -0.586 1.110 1.00 1.00 H new ATOM 0 HD1 PHE A 584 -18.237 -3.761 0.860 1.00 1.00 H new ATOM 0 HD2 PHE A 584 -15.635 -1.030 -1.049 1.00 1.00 H new ATOM 0 HE1 PHE A 584 -18.244 -5.186 -1.194 1.00 1.00 H new ATOM 0 HE2 PHE A 584 -15.641 -2.457 -3.098 1.00 1.00 H new ATOM 0 HZ PHE A 584 -16.945 -4.520 -3.147 1.00 1.00 H new ATOM 550 N PRO A 585 -14.253 -1.182 2.625 1.00 1.00 N ATOM 551 CA PRO A 585 -13.175 -0.397 3.199 1.00 1.00 C ATOM 552 C PRO A 585 -13.455 1.102 3.062 1.00 1.00 C ATOM 553 O PRO A 585 -12.665 1.929 3.515 1.00 1.00 O ATOM 554 CB PRO A 585 -11.926 -0.837 2.450 1.00 1.00 C ATOM 555 CG PRO A 585 -12.417 -1.507 1.177 1.00 1.00 C ATOM 556 CD PRO A 585 -13.906 -1.774 1.336 1.00 1.00 C ATOM 0 HA PRO A 585 -13.060 -0.561 4.271 1.00 1.00 H new ATOM 0 HB2 PRO A 585 -11.287 0.016 2.221 1.00 1.00 H new ATOM 0 HB3 PRO A 585 -11.333 -1.527 3.051 1.00 1.00 H new ATOM 0 HG2 PRO A 585 -12.234 -0.867 0.314 1.00 1.00 H new ATOM 0 HG3 PRO A 585 -11.878 -2.439 1.004 1.00 1.00 H new ATOM 0 HD2 PRO A 585 -14.478 -1.322 0.526 1.00 1.00 H new ATOM 0 HD3 PRO A 585 -14.121 -2.843 1.320 1.00 1.00 H new ATOM 564 N ASN A 586 -14.582 1.405 2.436 1.00 1.00 N ATOM 565 CA ASN A 586 -14.976 2.790 2.234 1.00 1.00 C ATOM 566 C ASN A 586 -16.447 2.840 1.818 1.00 1.00 C ATOM 567 O ASN A 586 -17.194 3.709 2.268 1.00 1.00 O ATOM 568 CB ASN A 586 -14.149 3.442 1.126 1.00 1.00 C ATOM 569 CG ASN A 586 -12.672 3.057 1.244 1.00 1.00 C ATOM 570 OD1 ASN A 586 -12.253 1.978 0.861 1.00 1.00 O ATOM 571 ND2 ASN A 586 -11.910 3.998 1.795 1.00 1.00 N ATOM 0 H ASN A 586 -15.235 0.716 2.062 1.00 1.00 H new ATOM 0 HA ASN A 586 -14.813 3.327 3.168 1.00 1.00 H new ATOM 0 HB2 ASN A 586 -14.532 3.135 0.153 1.00 1.00 H new ATOM 0 HB3 ASN A 586 -14.251 4.526 1.181 1.00 1.00 H new ATOM 0 HD21 ASN A 586 -10.910 3.837 1.918 1.00 1.00 H new ATOM 0 HD22 ASN A 586 -12.325 4.880 2.094 1.00 1.00 H new ATOM 578 N ARG A 587 -16.821 1.898 0.964 1.00 1.00 N ATOM 579 CA ARG A 587 -18.190 1.826 0.482 1.00 1.00 C ATOM 580 C ARG A 587 -19.030 0.939 1.402 1.00 1.00 C ATOM 581 O ARG A 587 -18.596 0.590 2.500 1.00 1.00 O ATOM 582 CB ARG A 587 -18.243 1.266 -0.941 1.00 1.00 C ATOM 583 CG ARG A 587 -16.876 1.366 -1.622 1.00 1.00 C ATOM 584 CD ARG A 587 -16.912 0.744 -3.018 1.00 1.00 C ATOM 585 NE ARG A 587 -17.434 1.724 -3.996 1.00 1.00 N ATOM 586 CZ ARG A 587 -17.402 1.550 -5.325 1.00 1.00 C ATOM 587 NH1 ARG A 587 -16.874 0.432 -5.842 1.00 1.00 N ATOM 588 NH2 ARG A 587 -17.899 2.493 -6.137 1.00 1.00 N ATOM 0 H ARG A 587 -16.200 1.179 0.594 1.00 1.00 H new ATOM 0 HA ARG A 587 -18.594 2.838 0.478 1.00 1.00 H new ATOM 0 HB2 ARG A 587 -18.564 0.225 -0.914 1.00 1.00 H new ATOM 0 HB3 ARG A 587 -18.984 1.813 -1.523 1.00 1.00 H new ATOM 0 HG2 ARG A 587 -16.577 2.412 -1.694 1.00 1.00 H new ATOM 0 HG3 ARG A 587 -16.125 0.861 -1.014 1.00 1.00 H new ATOM 0 HD2 ARG A 587 -15.911 0.426 -3.309 1.00 1.00 H new ATOM 0 HD3 ARG A 587 -17.541 -0.146 -3.012 1.00 1.00 H new ATOM 0 HE ARG A 587 -17.844 2.586 -3.637 1.00 1.00 H new ATOM 0 HH11 ARG A 587 -16.496 -0.287 -5.224 1.00 1.00 H new ATOM 0 HH12 ARG A 587 -16.850 0.300 -6.853 1.00 1.00 H new ATOM 0 HH21 ARG A 587 -18.302 3.344 -5.744 1.00 1.00 H new ATOM 0 HH22 ARG A 587 -17.874 2.360 -7.148 1.00 1.00 H new ATOM 602 N LEU A 588 -20.217 0.599 0.924 1.00 1.00 N ATOM 603 CA LEU A 588 -21.122 -0.240 1.689 1.00 1.00 C ATOM 604 C LEU A 588 -22.443 -0.385 0.931 1.00 1.00 C ATOM 605 O LEU A 588 -23.180 0.585 0.770 1.00 1.00 O ATOM 606 CB LEU A 588 -21.286 0.305 3.109 1.00 1.00 C ATOM 607 CG LEU A 588 -22.724 0.465 3.604 1.00 1.00 C ATOM 608 CD1 LEU A 588 -23.427 -0.891 3.694 1.00 1.00 C ATOM 609 CD2 LEU A 588 -22.767 1.220 4.934 1.00 1.00 C ATOM 0 H LEU A 588 -20.574 0.890 0.014 1.00 1.00 H new ATOM 0 HA LEU A 588 -20.707 -1.242 1.801 1.00 1.00 H new ATOM 0 HB2 LEU A 588 -20.759 -0.358 3.795 1.00 1.00 H new ATOM 0 HB3 LEU A 588 -20.794 1.276 3.163 1.00 1.00 H new ATOM 0 HG LEU A 588 -23.270 1.065 2.875 1.00 1.00 H new ATOM 0 HD11 LEU A 588 -24.448 -0.749 4.048 1.00 1.00 H new ATOM 0 HD12 LEU A 588 -23.447 -1.357 2.709 1.00 1.00 H new ATOM 0 HD13 LEU A 588 -22.888 -1.535 4.389 1.00 1.00 H new ATOM 0 HD21 LEU A 588 -23.802 1.319 5.263 1.00 1.00 H new ATOM 0 HD22 LEU A 588 -22.199 0.669 5.684 1.00 1.00 H new ATOM 0 HD23 LEU A 588 -22.331 2.210 4.804 1.00 1.00 H new ATOM 799 N LEU A 601 -23.748 3.243 0.029 1.00 1.00 N ATOM 800 CA LEU A 601 -23.134 4.431 0.596 1.00 1.00 C ATOM 801 C LEU A 601 -21.671 4.136 0.929 1.00 1.00 C ATOM 802 O LEU A 601 -21.124 3.122 0.495 1.00 1.00 O ATOM 803 CB LEU A 601 -23.947 4.936 1.791 1.00 1.00 C ATOM 804 CG LEU A 601 -24.012 4.002 3.000 1.00 1.00 C ATOM 805 CD1 LEU A 601 -23.781 4.772 4.301 1.00 1.00 C ATOM 806 CD2 LEU A 601 -25.330 3.223 3.022 1.00 1.00 C ATOM 0 HA LEU A 601 -23.138 5.244 -0.130 1.00 1.00 H new ATOM 0 HB2 LEU A 601 -23.527 5.888 2.115 1.00 1.00 H new ATOM 0 HB3 LEU A 601 -24.965 5.134 1.455 1.00 1.00 H new ATOM 0 HG LEU A 601 -23.208 3.272 2.910 1.00 1.00 H new ATOM 0 HD11 LEU A 601 -23.832 4.084 5.145 1.00 1.00 H new ATOM 0 HD12 LEU A 601 -22.798 5.242 4.276 1.00 1.00 H new ATOM 0 HD13 LEU A 601 -24.548 5.539 4.411 1.00 1.00 H new ATOM 0 HD21 LEU A 601 -25.350 2.566 3.892 1.00 1.00 H new ATOM 0 HD22 LEU A 601 -26.165 3.922 3.075 1.00 1.00 H new ATOM 0 HD23 LEU A 601 -25.415 2.625 2.114 1.00 1.00 H new ATOM 818 N THR A 602 -21.078 5.038 1.697 1.00 1.00 N ATOM 819 CA THR A 602 -19.688 4.886 2.094 1.00 1.00 C ATOM 820 C THR A 602 -19.577 4.772 3.616 1.00 1.00 C ATOM 821 O THR A 602 -20.555 4.457 4.292 1.00 1.00 O ATOM 822 CB THR A 602 -18.898 6.061 1.513 1.00 1.00 C ATOM 823 OG1 THR A 602 -19.839 6.732 0.678 1.00 1.00 O ATOM 824 CG2 THR A 602 -17.799 5.609 0.550 1.00 1.00 C ATOM 0 H THR A 602 -21.534 5.877 2.055 1.00 1.00 H new ATOM 0 HA THR A 602 -19.263 3.963 1.699 1.00 1.00 H new ATOM 0 HB THR A 602 -18.453 6.637 2.325 1.00 1.00 H new ATOM 0 HG1 THR A 602 -19.411 7.509 0.262 1.00 1.00 H new ATOM 0 HG21 THR A 602 -17.270 6.481 0.167 1.00 1.00 H new ATOM 0 HG22 THR A 602 -17.098 4.961 1.076 1.00 1.00 H new ATOM 0 HG23 THR A 602 -18.245 5.062 -0.280 1.00 1.00 H new ATOM 832 N MET A 603 -18.377 5.035 4.111 1.00 1.00 N ATOM 833 CA MET A 603 -18.124 4.966 5.540 1.00 1.00 C ATOM 834 C MET A 603 -17.267 6.145 6.004 1.00 1.00 C ATOM 835 O MET A 603 -16.412 5.992 6.875 1.00 1.00 O ATOM 836 CB MET A 603 -17.409 3.655 5.871 1.00 1.00 C ATOM 837 CG MET A 603 -16.337 3.336 4.826 1.00 1.00 C ATOM 838 SD MET A 603 -14.837 2.806 5.635 1.00 1.00 S ATOM 839 CE MET A 603 -13.758 4.164 5.208 1.00 1.00 C ATOM 0 H MET A 603 -17.568 5.297 3.547 1.00 1.00 H new ATOM 0 HA MET A 603 -19.081 5.010 6.060 1.00 1.00 H new ATOM 0 HB2 MET A 603 -16.951 3.726 6.857 1.00 1.00 H new ATOM 0 HB3 MET A 603 -18.134 2.842 5.914 1.00 1.00 H new ATOM 0 HG2 MET A 603 -16.693 2.555 4.154 1.00 1.00 H new ATOM 0 HG3 MET A 603 -16.139 4.217 4.215 1.00 1.00 H new ATOM 0 HE1 MET A 603 -13.050 4.335 6.019 1.00 1.00 H new ATOM 0 HE2 MET A 603 -13.213 3.923 4.295 1.00 1.00 H new ATOM 0 HE3 MET A 603 -14.352 5.064 5.049 1.00 1.00 H new ATOM 849 N GLU A 604 -17.525 7.297 5.401 1.00 1.00 N ATOM 850 CA GLU A 604 -16.788 8.501 5.740 1.00 1.00 C ATOM 851 C GLU A 604 -17.753 9.622 6.132 1.00 1.00 C ATOM 852 O GLU A 604 -17.745 10.694 5.527 1.00 1.00 O ATOM 853 CB GLU A 604 -15.884 8.936 4.583 1.00 1.00 C ATOM 854 CG GLU A 604 -16.713 9.335 3.362 1.00 1.00 C ATOM 855 CD GLU A 604 -15.892 9.205 2.077 1.00 1.00 C ATOM 856 OE1 GLU A 604 -14.815 9.837 2.023 1.00 1.00 O ATOM 857 OE2 GLU A 604 -16.360 8.476 1.176 1.00 1.00 O ATOM 0 H GLU A 604 -18.235 7.421 4.679 1.00 1.00 H new ATOM 0 HA GLU A 604 -16.149 8.282 6.595 1.00 1.00 H new ATOM 0 HB2 GLU A 604 -15.264 9.776 4.897 1.00 1.00 H new ATOM 0 HB3 GLU A 604 -15.208 8.123 4.319 1.00 1.00 H new ATOM 0 HG2 GLU A 604 -17.599 8.704 3.297 1.00 1.00 H new ATOM 0 HG3 GLU A 604 -17.061 10.362 3.474 1.00 1.00 H new ATOM 864 N GLU A 605 -18.562 9.337 7.142 1.00 1.00 N ATOM 865 CA GLU A 605 -19.532 10.307 7.622 1.00 1.00 C ATOM 866 C GLU A 605 -19.950 9.974 9.055 1.00 1.00 C ATOM 867 O GLU A 605 -19.837 10.813 9.948 1.00 1.00 O ATOM 868 CB GLU A 605 -20.748 10.370 6.695 1.00 1.00 C ATOM 869 CG GLU A 605 -21.090 8.984 6.145 1.00 1.00 C ATOM 870 CD GLU A 605 -21.993 9.091 4.914 1.00 1.00 C ATOM 871 OE1 GLU A 605 -21.856 10.105 4.197 1.00 1.00 O ATOM 872 OE2 GLU A 605 -22.799 8.156 4.719 1.00 1.00 O ATOM 0 H GLU A 605 -18.566 8.448 7.641 1.00 1.00 H new ATOM 0 HA GLU A 605 -19.065 11.292 7.621 1.00 1.00 H new ATOM 0 HB2 GLU A 605 -21.604 10.771 7.238 1.00 1.00 H new ATOM 0 HB3 GLU A 605 -20.546 11.053 5.870 1.00 1.00 H new ATOM 0 HG2 GLU A 605 -20.173 8.456 5.883 1.00 1.00 H new ATOM 0 HG3 GLU A 605 -21.588 8.395 6.916 1.00 1.00 H new ATOM 879 N ILE A 606 -20.424 8.749 9.231 1.00 1.00 N ATOM 880 CA ILE A 606 -20.860 8.296 10.540 1.00 1.00 C ATOM 881 C ILE A 606 -20.032 8.998 11.620 1.00 1.00 C ATOM 882 O ILE A 606 -18.817 9.137 11.484 1.00 1.00 O ATOM 883 CB ILE A 606 -20.810 6.769 10.623 1.00 1.00 C ATOM 884 CG1 ILE A 606 -22.110 6.151 10.106 1.00 1.00 C ATOM 885 CG2 ILE A 606 -20.481 6.308 12.044 1.00 1.00 C ATOM 886 CD1 ILE A 606 -21.941 5.640 8.673 1.00 1.00 C ATOM 0 H ILE A 606 -20.515 8.056 8.488 1.00 1.00 H new ATOM 0 HA ILE A 606 -21.902 8.567 10.709 1.00 1.00 H new ATOM 0 HB ILE A 606 -20.006 6.417 9.977 1.00 1.00 H new ATOM 0 HG12 ILE A 606 -22.410 5.329 10.756 1.00 1.00 H new ATOM 0 HG13 ILE A 606 -22.908 6.892 10.140 1.00 1.00 H new ATOM 0 HG21 ILE A 606 -20.452 5.219 12.076 1.00 1.00 H new ATOM 0 HG22 ILE A 606 -19.510 6.706 12.340 1.00 1.00 H new ATOM 0 HG23 ILE A 606 -21.246 6.670 12.730 1.00 1.00 H new ATOM 0 HD11 ILE A 606 -22.879 5.205 8.329 1.00 1.00 H new ATOM 0 HD12 ILE A 606 -21.664 6.469 8.021 1.00 1.00 H new ATOM 0 HD13 ILE A 606 -21.159 4.881 8.647 1.00 1.00 H new ATOM 898 N GLN A 607 -20.723 9.422 12.667 1.00 1.00 N ATOM 899 CA GLN A 607 -20.066 10.106 13.769 1.00 1.00 C ATOM 900 C GLN A 607 -19.560 9.091 14.797 1.00 1.00 C ATOM 901 O GLN A 607 -18.471 9.251 15.347 1.00 1.00 O ATOM 902 CB GLN A 607 -21.005 11.124 14.420 1.00 1.00 C ATOM 903 CG GLN A 607 -20.386 12.523 14.413 1.00 1.00 C ATOM 904 CD GLN A 607 -19.742 12.845 15.763 1.00 1.00 C ATOM 905 OE1 GLN A 607 -20.182 13.713 16.498 1.00 1.00 O ATOM 906 NE2 GLN A 607 -18.679 12.098 16.047 1.00 1.00 N ATOM 0 H GLN A 607 -21.730 9.306 12.776 1.00 1.00 H new ATOM 0 HA GLN A 607 -19.209 10.652 13.374 1.00 1.00 H new ATOM 0 HB2 GLN A 607 -21.956 11.140 13.887 1.00 1.00 H new ATOM 0 HB3 GLN A 607 -21.220 10.822 15.445 1.00 1.00 H new ATOM 0 HG2 GLN A 607 -19.637 12.589 13.624 1.00 1.00 H new ATOM 0 HG3 GLN A 607 -21.154 13.263 14.187 1.00 1.00 H new ATOM 0 HE21 GLN A 607 -18.363 11.388 15.386 1.00 1.00 H new ATOM 0 HE22 GLN A 607 -18.179 12.235 16.926 1.00 1.00 H new ATOM 915 N SER A 608 -20.374 8.071 15.025 1.00 1.00 N ATOM 916 CA SER A 608 -20.023 7.032 15.977 1.00 1.00 C ATOM 917 C SER A 608 -21.072 5.920 15.949 1.00 1.00 C ATOM 918 O SER A 608 -22.271 6.192 15.935 1.00 1.00 O ATOM 919 CB SER A 608 -19.891 7.601 17.392 1.00 1.00 C ATOM 920 OG SER A 608 -18.556 8.009 17.681 1.00 1.00 O ATOM 0 H SER A 608 -21.276 7.942 14.566 1.00 1.00 H new ATOM 0 HA SER A 608 -19.056 6.619 15.689 1.00 1.00 H new ATOM 0 HB2 SER A 608 -20.563 8.452 17.505 1.00 1.00 H new ATOM 0 HB3 SER A 608 -20.205 6.849 18.116 1.00 1.00 H new ATOM 0 HG SER A 608 -18.241 8.617 16.980 1.00 1.00 H new ATOM 926 N VAL A 609 -20.582 4.688 15.941 1.00 1.00 N ATOM 927 CA VAL A 609 -21.464 3.533 15.914 1.00 1.00 C ATOM 928 C VAL A 609 -21.442 2.850 17.283 1.00 1.00 C ATOM 929 O VAL A 609 -20.392 2.748 17.914 1.00 1.00 O ATOM 930 CB VAL A 609 -21.064 2.597 14.772 1.00 1.00 C ATOM 931 CG1 VAL A 609 -19.569 2.277 14.823 1.00 1.00 C ATOM 932 CG2 VAL A 609 -21.900 1.315 14.797 1.00 1.00 C ATOM 0 H VAL A 609 -19.587 4.465 15.953 1.00 1.00 H new ATOM 0 HA VAL A 609 -22.492 3.840 15.720 1.00 1.00 H new ATOM 0 HB VAL A 609 -21.264 3.111 13.832 1.00 1.00 H new ATOM 0 HG11 VAL A 609 -19.311 1.610 14.000 1.00 1.00 H new ATOM 0 HG12 VAL A 609 -18.996 3.200 14.735 1.00 1.00 H new ATOM 0 HG13 VAL A 609 -19.333 1.793 15.770 1.00 1.00 H new ATOM 0 HG21 VAL A 609 -21.596 0.667 13.975 1.00 1.00 H new ATOM 0 HG22 VAL A 609 -21.745 0.798 15.744 1.00 1.00 H new ATOM 0 HG23 VAL A 609 -22.955 1.567 14.690 1.00 1.00 H new ATOM 942 N GLU A 610 -22.616 2.398 17.701 1.00 1.00 N ATOM 943 CA GLU A 610 -22.746 1.726 18.983 1.00 1.00 C ATOM 944 C GLU A 610 -24.005 0.859 19.003 1.00 1.00 C ATOM 945 O GLU A 610 -24.621 0.626 17.964 1.00 1.00 O ATOM 946 CB GLU A 610 -22.758 2.737 20.132 1.00 1.00 C ATOM 947 CG GLU A 610 -22.873 4.168 19.602 1.00 1.00 C ATOM 948 CD GLU A 610 -23.027 5.167 20.751 1.00 1.00 C ATOM 949 OE1 GLU A 610 -22.899 4.722 21.912 1.00 1.00 O ATOM 950 OE2 GLU A 610 -23.273 6.353 20.443 1.00 1.00 O ATOM 0 H GLU A 610 -23.485 2.484 17.174 1.00 1.00 H new ATOM 0 HA GLU A 610 -21.881 1.078 19.121 1.00 1.00 H new ATOM 0 HB2 GLU A 610 -23.593 2.524 20.800 1.00 1.00 H new ATOM 0 HB3 GLU A 610 -21.846 2.635 20.720 1.00 1.00 H new ATOM 0 HG2 GLU A 610 -21.987 4.415 19.017 1.00 1.00 H new ATOM 0 HG3 GLU A 610 -23.729 4.244 18.932 1.00 1.00 H new ATOM 957 N GLU A 611 -24.353 0.403 20.198 1.00 1.00 N ATOM 958 CA GLU A 611 -25.528 -0.434 20.366 1.00 1.00 C ATOM 959 C GLU A 611 -26.272 -0.055 21.649 1.00 1.00 C ATOM 960 O GLU A 611 -25.656 0.381 22.620 1.00 1.00 O ATOM 961 CB GLU A 611 -25.150 -1.917 20.370 1.00 1.00 C ATOM 962 CG GLU A 611 -26.397 -2.801 20.400 1.00 1.00 C ATOM 963 CD GLU A 611 -26.037 -4.245 20.756 1.00 1.00 C ATOM 964 OE1 GLU A 611 -25.412 -4.429 21.822 1.00 1.00 O ATOM 965 OE2 GLU A 611 -26.397 -5.134 19.953 1.00 1.00 O ATOM 0 H GLU A 611 -23.841 0.598 21.059 1.00 1.00 H new ATOM 0 HA GLU A 611 -26.193 -0.265 19.519 1.00 1.00 H new ATOM 0 HB2 GLU A 611 -24.558 -2.147 19.484 1.00 1.00 H new ATOM 0 HB3 GLU A 611 -24.525 -2.134 21.236 1.00 1.00 H new ATOM 0 HG2 GLU A 611 -27.107 -2.409 21.128 1.00 1.00 H new ATOM 0 HG3 GLU A 611 -26.890 -2.774 19.428 1.00 1.00 H new ATOM 972 N THR A 612 -27.583 -0.233 21.610 1.00 1.00 N ATOM 973 CA THR A 612 -28.416 0.086 22.757 1.00 1.00 C ATOM 974 C THR A 612 -29.067 -1.183 23.313 1.00 1.00 C ATOM 975 O THR A 612 -29.087 -2.218 22.647 1.00 1.00 O ATOM 976 CB THR A 612 -29.428 1.149 22.325 1.00 1.00 C ATOM 977 OG1 THR A 612 -30.522 0.971 23.222 1.00 1.00 O ATOM 978 CG2 THR A 612 -30.025 0.865 20.946 1.00 1.00 C ATOM 0 H THR A 612 -28.090 -0.594 20.802 1.00 1.00 H new ATOM 0 HA THR A 612 -27.823 0.495 23.575 1.00 1.00 H new ATOM 0 HB THR A 612 -28.946 2.126 22.316 1.00 1.00 H new ATOM 0 HG1 THR A 612 -31.225 1.622 23.014 1.00 1.00 H new ATOM 0 HG21 THR A 612 -30.736 1.650 20.689 1.00 1.00 H new ATOM 0 HG22 THR A 612 -29.228 0.840 20.203 1.00 1.00 H new ATOM 0 HG23 THR A 612 -30.537 -0.097 20.962 1.00 1.00 H new ATOM 986 N GLN A 613 -29.584 -1.062 24.527 1.00 1.00 N ATOM 987 CA GLN A 613 -30.234 -2.185 25.179 1.00 1.00 C ATOM 988 C GLN A 613 -31.619 -1.778 25.683 1.00 1.00 C ATOM 989 O GLN A 613 -31.923 -0.590 25.782 1.00 1.00 O ATOM 990 CB GLN A 613 -29.374 -2.730 26.320 1.00 1.00 C ATOM 991 CG GLN A 613 -27.955 -3.041 25.838 1.00 1.00 C ATOM 992 CD GLN A 613 -26.954 -2.020 26.384 1.00 1.00 C ATOM 993 OE1 GLN A 613 -27.259 -0.854 26.575 1.00 1.00 O ATOM 994 NE2 GLN A 613 -25.746 -2.521 26.622 1.00 1.00 N ATOM 0 H GLN A 613 -29.566 -0.203 25.076 1.00 1.00 H new ATOM 0 HA GLN A 613 -30.356 -2.983 24.447 1.00 1.00 H new ATOM 0 HB2 GLN A 613 -29.335 -2.002 27.130 1.00 1.00 H new ATOM 0 HB3 GLN A 613 -29.831 -3.633 26.725 1.00 1.00 H new ATOM 0 HG2 GLN A 613 -27.670 -4.043 26.159 1.00 1.00 H new ATOM 0 HG3 GLN A 613 -27.928 -3.035 24.748 1.00 1.00 H new ATOM 0 HE21 GLN A 613 -25.558 -3.507 26.440 1.00 1.00 H new ATOM 0 HE22 GLN A 613 -25.007 -1.920 26.987 1.00 1.00 H new ATOM 1003 N ILE A 614 -32.424 -2.785 25.989 1.00 1.00 N ATOM 1004 CA ILE A 614 -33.769 -2.547 26.480 1.00 1.00 C ATOM 1005 C ILE A 614 -34.161 -3.666 27.447 1.00 1.00 C ATOM 1006 O ILE A 614 -34.824 -4.626 27.056 1.00 1.00 O ATOM 1007 CB ILE A 614 -34.744 -2.373 25.313 1.00 1.00 C ATOM 1008 CG1 ILE A 614 -35.149 -0.908 25.151 1.00 1.00 C ATOM 1009 CG2 ILE A 614 -35.959 -3.290 25.473 1.00 1.00 C ATOM 1010 CD1 ILE A 614 -34.510 -0.297 23.902 1.00 1.00 C ATOM 0 H ILE A 614 -32.169 -3.769 25.906 1.00 1.00 H new ATOM 0 HA ILE A 614 -33.809 -1.613 27.040 1.00 1.00 H new ATOM 0 HB ILE A 614 -34.235 -2.669 24.395 1.00 1.00 H new ATOM 0 HG12 ILE A 614 -36.234 -0.833 25.083 1.00 1.00 H new ATOM 0 HG13 ILE A 614 -34.845 -0.343 26.032 1.00 1.00 H new ATOM 0 HG21 ILE A 614 -36.636 -3.147 24.631 1.00 1.00 H new ATOM 0 HG22 ILE A 614 -35.630 -4.329 25.501 1.00 1.00 H new ATOM 0 HG23 ILE A 614 -36.478 -3.048 26.401 1.00 1.00 H new ATOM 0 HD11 ILE A 614 -34.815 0.746 23.810 1.00 1.00 H new ATOM 0 HD12 ILE A 614 -33.425 -0.352 23.985 1.00 1.00 H new ATOM 0 HD13 ILE A 614 -34.835 -0.849 23.020 1.00 1.00 H new ATOM 1022 N LYS A 615 -33.734 -3.507 28.692 1.00 1.00 N ATOM 1023 CA LYS A 615 -34.033 -4.492 29.717 1.00 1.00 C ATOM 1024 C LYS A 615 -33.043 -5.653 29.605 1.00 1.00 C ATOM 1025 O LYS A 615 -32.674 -6.258 30.610 1.00 1.00 O ATOM 1026 CB LYS A 615 -35.498 -4.922 29.638 1.00 1.00 C ATOM 1027 CG LYS A 615 -35.922 -5.660 30.908 1.00 1.00 C ATOM 1028 CD LYS A 615 -37.435 -5.888 30.931 1.00 1.00 C ATOM 1029 CE LYS A 615 -38.104 -5.019 31.997 1.00 1.00 C ATOM 1030 NZ LYS A 615 -39.517 -5.419 32.180 1.00 1.00 N ATOM 0 H LYS A 615 -33.183 -2.711 29.013 1.00 1.00 H new ATOM 0 HA LYS A 615 -33.907 -4.059 30.709 1.00 1.00 H new ATOM 0 HB2 LYS A 615 -36.130 -4.046 29.494 1.00 1.00 H new ATOM 0 HB3 LYS A 615 -35.645 -5.567 28.772 1.00 1.00 H new ATOM 0 HG2 LYS A 615 -35.405 -6.618 30.966 1.00 1.00 H new ATOM 0 HG3 LYS A 615 -35.624 -5.084 31.784 1.00 1.00 H new ATOM 0 HD2 LYS A 615 -37.856 -5.658 29.952 1.00 1.00 H new ATOM 0 HD3 LYS A 615 -37.645 -6.939 31.129 1.00 1.00 H new ATOM 0 HE2 LYS A 615 -37.568 -5.114 32.941 1.00 1.00 H new ATOM 0 HE3 LYS A 615 -38.052 -3.970 31.705 1.00 1.00 H new ATOM 0 HZ1 LYS A 615 -39.956 -4.819 32.907 1.00 1.00 H new ATOM 0 HZ2 LYS A 615 -40.029 -5.306 31.282 1.00 1.00 H new ATOM 0 HZ3 LYS A 615 -39.560 -6.414 32.480 1.00 1.00 H new ATOM 1044 N GLU A 616 -32.641 -5.929 28.373 1.00 1.00 N ATOM 1045 CA GLU A 616 -31.702 -7.008 28.115 1.00 1.00 C ATOM 1046 C GLU A 616 -30.973 -6.772 26.790 1.00 1.00 C ATOM 1047 O GLU A 616 -29.749 -6.885 26.723 1.00 1.00 O ATOM 1048 CB GLU A 616 -32.410 -8.364 28.118 1.00 1.00 C ATOM 1049 CG GLU A 616 -31.662 -9.373 27.246 1.00 1.00 C ATOM 1050 CD GLU A 616 -31.798 -10.790 27.810 1.00 1.00 C ATOM 1051 OE1 GLU A 616 -32.822 -11.433 27.490 1.00 1.00 O ATOM 1052 OE2 GLU A 616 -30.877 -11.199 28.549 1.00 1.00 O ATOM 0 H GLU A 616 -32.949 -5.424 27.542 1.00 1.00 H new ATOM 0 HA GLU A 616 -30.963 -7.020 28.916 1.00 1.00 H new ATOM 0 HB2 GLU A 616 -32.479 -8.740 29.139 1.00 1.00 H new ATOM 0 HB3 GLU A 616 -33.430 -8.247 27.752 1.00 1.00 H new ATOM 0 HG2 GLU A 616 -32.055 -9.343 26.230 1.00 1.00 H new ATOM 0 HG3 GLU A 616 -30.608 -9.100 27.189 1.00 1.00 H new ATOM 1059 N ARG A 617 -31.755 -6.449 25.771 1.00 1.00 N ATOM 1060 CA ARG A 617 -31.198 -6.197 24.453 1.00 1.00 C ATOM 1061 C ARG A 617 -32.145 -5.313 23.638 1.00 1.00 C ATOM 1062 O ARG A 617 -33.359 -5.511 23.660 1.00 1.00 O ATOM 1063 CB ARG A 617 -30.958 -7.505 23.697 1.00 1.00 C ATOM 1064 CG ARG A 617 -29.835 -7.346 22.671 1.00 1.00 C ATOM 1065 CD ARG A 617 -29.655 -8.628 21.852 1.00 1.00 C ATOM 1066 NE ARG A 617 -28.229 -8.802 21.494 1.00 1.00 N ATOM 1067 CZ ARG A 617 -27.587 -8.062 20.580 1.00 1.00 C ATOM 1068 NH1 ARG A 617 -28.240 -7.091 19.927 1.00 1.00 N ATOM 1069 NH2 ARG A 617 -26.293 -8.292 20.320 1.00 1.00 N ATOM 0 H ARG A 617 -32.769 -6.356 25.831 1.00 1.00 H new ATOM 0 HA ARG A 617 -30.244 -5.688 24.588 1.00 1.00 H new ATOM 0 HB2 ARG A 617 -30.702 -8.295 24.403 1.00 1.00 H new ATOM 0 HB3 ARG A 617 -31.875 -7.812 23.194 1.00 1.00 H new ATOM 0 HG2 ARG A 617 -30.061 -6.513 22.005 1.00 1.00 H new ATOM 0 HG3 ARG A 617 -28.903 -7.102 23.181 1.00 1.00 H new ATOM 0 HD2 ARG A 617 -30.002 -9.488 22.425 1.00 1.00 H new ATOM 0 HD3 ARG A 617 -30.263 -8.581 20.948 1.00 1.00 H new ATOM 0 HE ARG A 617 -27.702 -9.532 21.974 1.00 1.00 H new ATOM 0 HH11 ARG A 617 -29.225 -6.916 20.126 1.00 1.00 H new ATOM 0 HH12 ARG A 617 -27.752 -6.527 19.231 1.00 1.00 H new ATOM 0 HH21 ARG A 617 -25.796 -9.031 20.818 1.00 1.00 H new ATOM 0 HH22 ARG A 617 -25.805 -7.728 19.624 1.00 1.00 H new ATOM 1083 N LYS A 618 -31.553 -4.355 22.939 1.00 1.00 N ATOM 1084 CA LYS A 618 -32.328 -3.439 22.120 1.00 1.00 C ATOM 1085 C LYS A 618 -31.921 -3.605 20.653 1.00 1.00 C ATOM 1086 O LYS A 618 -32.397 -4.512 19.973 1.00 1.00 O ATOM 1087 CB LYS A 618 -32.188 -2.006 22.637 1.00 1.00 C ATOM 1088 CG LYS A 618 -32.713 -0.998 21.612 1.00 1.00 C ATOM 1089 CD LYS A 618 -33.906 -1.569 20.844 1.00 1.00 C ATOM 1090 CE LYS A 618 -34.868 -0.455 20.423 1.00 1.00 C ATOM 1091 NZ LYS A 618 -35.507 -0.784 19.129 1.00 1.00 N ATOM 0 H LYS A 618 -30.546 -4.194 22.923 1.00 1.00 H new ATOM 0 HA LYS A 618 -33.390 -3.675 22.187 1.00 1.00 H new ATOM 0 HB2 LYS A 618 -32.737 -1.898 23.572 1.00 1.00 H new ATOM 0 HB3 LYS A 618 -31.141 -1.795 22.856 1.00 1.00 H new ATOM 0 HG2 LYS A 618 -33.008 -0.079 22.118 1.00 1.00 H new ATOM 0 HG3 LYS A 618 -31.918 -0.736 20.914 1.00 1.00 H new ATOM 0 HD2 LYS A 618 -33.554 -2.103 19.962 1.00 1.00 H new ATOM 0 HD3 LYS A 618 -34.432 -2.293 21.467 1.00 1.00 H new ATOM 0 HE2 LYS A 618 -35.632 -0.318 21.188 1.00 1.00 H new ATOM 0 HE3 LYS A 618 -34.328 0.488 20.339 1.00 1.00 H new ATOM 0 HZ1 LYS A 618 -36.156 -0.018 18.858 1.00 1.00 H new ATOM 0 HZ2 LYS A 618 -34.775 -0.892 18.398 1.00 1.00 H new ATOM 0 HZ3 LYS A 618 -36.039 -1.673 19.221 1.00 1.00 H new ATOM 1105 N CYS A 619 -31.046 -2.715 20.212 1.00 1.00 N ATOM 1106 CA CYS A 619 -30.570 -2.751 18.839 1.00 1.00 C ATOM 1107 C CYS A 619 -29.223 -2.028 18.778 1.00 1.00 C ATOM 1108 O CYS A 619 -28.670 -1.652 19.810 1.00 1.00 O ATOM 1109 CB CYS A 619 -31.588 -2.144 17.871 1.00 1.00 C ATOM 1110 SG CYS A 619 -32.911 -3.354 17.512 1.00 1.00 S ATOM 0 H CYS A 619 -30.654 -1.964 20.780 1.00 1.00 H new ATOM 0 HA CYS A 619 -30.440 -3.786 18.524 1.00 1.00 H new ATOM 0 HB2 CYS A 619 -32.018 -1.240 18.303 1.00 1.00 H new ATOM 0 HB3 CYS A 619 -31.092 -1.850 16.946 1.00 1.00 H new ATOM 0 HG CYS A 619 -32.982 -4.219 18.480 1.00 1.00 H new ATOM 1116 N LEU A 620 -28.733 -1.858 17.559 1.00 1.00 N ATOM 1117 CA LEU A 620 -27.462 -1.187 17.351 1.00 1.00 C ATOM 1118 C LEU A 620 -27.716 0.241 16.864 1.00 1.00 C ATOM 1119 O LEU A 620 -28.589 0.470 16.028 1.00 1.00 O ATOM 1120 CB LEU A 620 -26.571 -2.006 16.413 1.00 1.00 C ATOM 1121 CG LEU A 620 -25.093 -2.093 16.798 1.00 1.00 C ATOM 1122 CD1 LEU A 620 -24.690 -3.537 17.104 1.00 1.00 C ATOM 1123 CD2 LEU A 620 -24.208 -1.467 15.718 1.00 1.00 C ATOM 0 H LEU A 620 -29.194 -2.174 16.705 1.00 1.00 H new ATOM 0 HA LEU A 620 -26.914 -1.111 18.290 1.00 1.00 H new ATOM 0 HB2 LEU A 620 -26.971 -3.018 16.356 1.00 1.00 H new ATOM 0 HB3 LEU A 620 -26.641 -1.579 15.413 1.00 1.00 H new ATOM 0 HG LEU A 620 -24.943 -1.517 17.711 1.00 1.00 H new ATOM 0 HD11 LEU A 620 -23.635 -3.571 17.375 1.00 1.00 H new ATOM 0 HD12 LEU A 620 -25.289 -3.914 17.932 1.00 1.00 H new ATOM 0 HD13 LEU A 620 -24.858 -4.156 16.223 1.00 1.00 H new ATOM 0 HD21 LEU A 620 -23.162 -1.542 16.016 1.00 1.00 H new ATOM 0 HD22 LEU A 620 -24.355 -1.995 14.776 1.00 1.00 H new ATOM 0 HD23 LEU A 620 -24.475 -0.418 15.592 1.00 1.00 H new ATOM 1135 N LEU A 621 -26.937 1.165 17.410 1.00 1.00 N ATOM 1136 CA LEU A 621 -27.069 2.564 17.042 1.00 1.00 C ATOM 1137 C LEU A 621 -26.123 2.872 15.878 1.00 1.00 C ATOM 1138 O LEU A 621 -25.175 2.128 15.631 1.00 1.00 O ATOM 1139 CB LEU A 621 -26.854 3.461 18.263 1.00 1.00 C ATOM 1140 CG LEU A 621 -26.306 4.862 17.978 1.00 1.00 C ATOM 1141 CD1 LEU A 621 -27.384 5.759 17.366 1.00 1.00 C ATOM 1142 CD2 LEU A 621 -25.696 5.478 19.238 1.00 1.00 C ATOM 0 H LEU A 621 -26.214 0.972 18.103 1.00 1.00 H new ATOM 0 HA LEU A 621 -28.081 2.773 16.695 1.00 1.00 H new ATOM 0 HB2 LEU A 621 -27.805 3.564 18.786 1.00 1.00 H new ATOM 0 HB3 LEU A 621 -26.169 2.956 18.944 1.00 1.00 H new ATOM 0 HG LEU A 621 -25.506 4.773 17.243 1.00 1.00 H new ATOM 0 HD11 LEU A 621 -26.968 6.748 17.174 1.00 1.00 H new ATOM 0 HD12 LEU A 621 -27.732 5.323 16.429 1.00 1.00 H new ATOM 0 HD13 LEU A 621 -28.221 5.846 18.058 1.00 1.00 H new ATOM 0 HD21 LEU A 621 -25.314 6.473 19.008 1.00 1.00 H new ATOM 0 HD22 LEU A 621 -26.459 5.552 20.013 1.00 1.00 H new ATOM 0 HD23 LEU A 621 -24.879 4.849 19.592 1.00 1.00 H new ATOM 1154 N LEU A 622 -26.413 3.970 15.196 1.00 1.00 N ATOM 1155 CA LEU A 622 -25.601 4.385 14.066 1.00 1.00 C ATOM 1156 C LEU A 622 -25.867 5.862 13.766 1.00 1.00 C ATOM 1157 O LEU A 622 -26.672 6.187 12.894 1.00 1.00 O ATOM 1158 CB LEU A 622 -25.838 3.462 12.867 1.00 1.00 C ATOM 1159 CG LEU A 622 -24.593 2.799 12.275 1.00 1.00 C ATOM 1160 CD1 LEU A 622 -24.941 2.008 11.014 1.00 1.00 C ATOM 1161 CD2 LEU A 622 -23.491 3.831 12.019 1.00 1.00 C ATOM 0 H LEU A 622 -27.200 4.585 15.405 1.00 1.00 H new ATOM 0 HA LEU A 622 -24.542 4.294 14.305 1.00 1.00 H new ATOM 0 HB2 LEU A 622 -26.534 2.679 13.168 1.00 1.00 H new ATOM 0 HB3 LEU A 622 -26.327 4.038 12.081 1.00 1.00 H new ATOM 0 HG LEU A 622 -24.205 2.088 13.004 1.00 1.00 H new ATOM 0 HD11 LEU A 622 -24.038 1.547 10.613 1.00 1.00 H new ATOM 0 HD12 LEU A 622 -25.666 1.232 11.260 1.00 1.00 H new ATOM 0 HD13 LEU A 622 -25.367 2.680 10.269 1.00 1.00 H new ATOM 0 HD21 LEU A 622 -22.617 3.333 11.598 1.00 1.00 H new ATOM 0 HD22 LEU A 622 -23.853 4.583 11.318 1.00 1.00 H new ATOM 0 HD23 LEU A 622 -23.217 4.312 12.958 1.00 1.00 H new ATOM 1173 N LYS A 623 -25.175 6.717 14.506 1.00 1.00 N ATOM 1174 CA LYS A 623 -25.327 8.151 14.330 1.00 1.00 C ATOM 1175 C LYS A 623 -24.352 8.635 13.255 1.00 1.00 C ATOM 1176 O LYS A 623 -23.202 8.202 13.215 1.00 1.00 O ATOM 1177 CB LYS A 623 -25.174 8.873 15.670 1.00 1.00 C ATOM 1178 CG LYS A 623 -23.709 8.918 16.105 1.00 1.00 C ATOM 1179 CD LYS A 623 -23.543 8.392 17.532 1.00 1.00 C ATOM 1180 CE LYS A 623 -24.249 9.303 18.537 1.00 1.00 C ATOM 1181 NZ LYS A 623 -23.268 9.904 19.469 1.00 1.00 N ATOM 0 H LYS A 623 -24.508 6.444 15.228 1.00 1.00 H new ATOM 0 HA LYS A 623 -26.331 8.388 13.979 1.00 1.00 H new ATOM 0 HB2 LYS A 623 -25.564 9.888 15.587 1.00 1.00 H new ATOM 0 HB3 LYS A 623 -25.767 8.365 16.430 1.00 1.00 H new ATOM 0 HG2 LYS A 623 -23.105 8.322 15.421 1.00 1.00 H new ATOM 0 HG3 LYS A 623 -23.340 9.942 16.046 1.00 1.00 H new ATOM 0 HD2 LYS A 623 -23.950 7.383 17.601 1.00 1.00 H new ATOM 0 HD3 LYS A 623 -22.483 8.325 17.778 1.00 1.00 H new ATOM 0 HE2 LYS A 623 -24.787 10.090 18.008 1.00 1.00 H new ATOM 0 HE3 LYS A 623 -24.989 8.732 19.097 1.00 1.00 H new ATOM 0 HZ1 LYS A 623 -23.763 10.520 20.145 1.00 1.00 H new ATOM 0 HZ2 LYS A 623 -22.773 9.150 19.986 1.00 1.00 H new ATOM 0 HZ3 LYS A 623 -22.577 10.465 18.931 1.00 1.00 H new ATOM 1195 N ILE A 624 -24.848 9.526 12.410 1.00 1.00 N ATOM 1196 CA ILE A 624 -24.034 10.075 11.338 1.00 1.00 C ATOM 1197 C ILE A 624 -23.575 11.482 11.720 1.00 1.00 C ATOM 1198 O ILE A 624 -24.303 12.219 12.382 1.00 1.00 O ATOM 1199 CB ILE A 624 -24.789 10.014 10.008 1.00 1.00 C ATOM 1200 CG1 ILE A 624 -25.177 8.576 9.663 1.00 1.00 C ATOM 1201 CG2 ILE A 624 -23.982 10.675 8.889 1.00 1.00 C ATOM 1202 CD1 ILE A 624 -25.948 8.517 8.342 1.00 1.00 C ATOM 0 H ILE A 624 -25.803 9.882 12.445 1.00 1.00 H new ATOM 0 HA ILE A 624 -23.135 9.475 11.197 1.00 1.00 H new ATOM 0 HB ILE A 624 -25.715 10.580 10.114 1.00 1.00 H new ATOM 0 HG12 ILE A 624 -24.280 7.961 9.592 1.00 1.00 H new ATOM 0 HG13 ILE A 624 -25.788 8.158 10.463 1.00 1.00 H new ATOM 0 HG21 ILE A 624 -24.541 10.618 7.955 1.00 1.00 H new ATOM 0 HG22 ILE A 624 -23.800 11.720 9.140 1.00 1.00 H new ATOM 0 HG23 ILE A 624 -23.029 10.159 8.774 1.00 1.00 H new ATOM 0 HD11 ILE A 624 -26.212 7.483 8.120 1.00 1.00 H new ATOM 0 HD12 ILE A 624 -26.857 9.114 8.424 1.00 1.00 H new ATOM 0 HD13 ILE A 624 -25.326 8.913 7.539 1.00 1.00 H new ATOM 1214 N ARG A 625 -22.368 11.815 11.287 1.00 1.00 N ATOM 1215 CA ARG A 625 -21.802 13.121 11.575 1.00 1.00 C ATOM 1216 C ARG A 625 -22.386 14.173 10.631 1.00 1.00 C ATOM 1217 O ARG A 625 -21.997 15.340 10.677 1.00 1.00 O ATOM 1218 CB ARG A 625 -20.279 13.106 11.432 1.00 1.00 C ATOM 1219 CG ARG A 625 -19.860 13.418 9.994 1.00 1.00 C ATOM 1220 CD ARG A 625 -18.354 13.228 9.807 1.00 1.00 C ATOM 1221 NE ARG A 625 -17.717 14.520 9.469 1.00 1.00 N ATOM 1222 CZ ARG A 625 -17.631 15.013 8.227 1.00 1.00 C ATOM 1223 NH1 ARG A 625 -18.139 14.324 7.196 1.00 1.00 N ATOM 1224 NH2 ARG A 625 -17.036 16.196 8.016 1.00 1.00 N ATOM 0 H ARG A 625 -21.766 11.202 10.738 1.00 1.00 H new ATOM 0 HA ARG A 625 -22.056 13.372 12.605 1.00 1.00 H new ATOM 0 HB2 ARG A 625 -19.839 13.838 12.110 1.00 1.00 H new ATOM 0 HB3 ARG A 625 -19.892 12.129 11.723 1.00 1.00 H new ATOM 0 HG2 ARG A 625 -20.400 12.768 9.305 1.00 1.00 H new ATOM 0 HG3 ARG A 625 -20.134 14.443 9.746 1.00 1.00 H new ATOM 0 HD2 ARG A 625 -17.914 12.824 10.719 1.00 1.00 H new ATOM 0 HD3 ARG A 625 -18.167 12.503 9.015 1.00 1.00 H new ATOM 0 HE ARG A 625 -17.318 15.070 10.230 1.00 1.00 H new ATOM 0 HH11 ARG A 625 -18.591 13.424 7.357 1.00 1.00 H new ATOM 0 HH12 ARG A 625 -18.074 14.700 6.250 1.00 1.00 H new ATOM 0 HH21 ARG A 625 -16.649 16.720 8.801 1.00 1.00 H new ATOM 0 HH22 ARG A 625 -16.970 16.572 7.070 1.00 1.00 H new ATOM 1238 N GLY A 626 -23.310 13.723 9.794 1.00 1.00 N ATOM 1239 CA GLY A 626 -23.951 14.611 8.840 1.00 1.00 C ATOM 1240 C GLY A 626 -25.231 15.214 9.424 1.00 1.00 C ATOM 1241 O GLY A 626 -25.680 16.270 8.984 1.00 1.00 O ATOM 0 H GLY A 626 -23.630 12.755 9.757 1.00 1.00 H new ATOM 0 HA2 GLY A 626 -23.263 15.409 8.562 1.00 1.00 H new ATOM 0 HA3 GLY A 626 -24.187 14.062 7.928 1.00 1.00 H new ATOM 1245 N GLY A 627 -25.779 14.516 10.408 1.00 1.00 N ATOM 1246 CA GLY A 627 -26.996 14.968 11.058 1.00 1.00 C ATOM 1247 C GLY A 627 -28.130 13.959 10.862 1.00 1.00 C ATOM 1248 O GLY A 627 -29.246 14.335 10.506 1.00 1.00 O ATOM 0 H GLY A 627 -25.402 13.640 10.771 1.00 1.00 H new ATOM 0 HA2 GLY A 627 -26.812 15.111 12.123 1.00 1.00 H new ATOM 0 HA3 GLY A 627 -27.291 15.936 10.652 1.00 1.00 H new ATOM 1252 N LYS A 628 -27.805 12.698 11.104 1.00 1.00 N ATOM 1253 CA LYS A 628 -28.781 11.631 10.958 1.00 1.00 C ATOM 1254 C LYS A 628 -28.533 10.570 12.032 1.00 1.00 C ATOM 1255 O LYS A 628 -27.508 10.596 12.710 1.00 1.00 O ATOM 1256 CB LYS A 628 -28.763 11.080 9.532 1.00 1.00 C ATOM 1257 CG LYS A 628 -29.986 11.555 8.744 1.00 1.00 C ATOM 1258 CD LYS A 628 -30.233 10.667 7.525 1.00 1.00 C ATOM 1259 CE LYS A 628 -29.142 10.862 6.471 1.00 1.00 C ATOM 1260 NZ LYS A 628 -29.713 10.773 5.109 1.00 1.00 N ATOM 0 H LYS A 628 -26.879 12.391 11.400 1.00 1.00 H new ATOM 0 HA LYS A 628 -29.790 12.013 11.114 1.00 1.00 H new ATOM 0 HB2 LYS A 628 -27.853 11.401 9.026 1.00 1.00 H new ATOM 0 HB3 LYS A 628 -28.745 9.991 9.560 1.00 1.00 H new ATOM 0 HG2 LYS A 628 -30.865 11.545 9.389 1.00 1.00 H new ATOM 0 HG3 LYS A 628 -29.838 12.586 8.423 1.00 1.00 H new ATOM 0 HD2 LYS A 628 -30.263 9.622 7.833 1.00 1.00 H new ATOM 0 HD3 LYS A 628 -31.206 10.900 7.093 1.00 1.00 H new ATOM 0 HE2 LYS A 628 -28.665 11.832 6.609 1.00 1.00 H new ATOM 0 HE3 LYS A 628 -28.368 10.105 6.597 1.00 1.00 H new ATOM 0 HZ1 LYS A 628 -28.958 10.908 4.407 1.00 1.00 H new ATOM 0 HZ2 LYS A 628 -30.147 9.838 4.975 1.00 1.00 H new ATOM 0 HZ3 LYS A 628 -30.435 11.511 4.987 1.00 1.00 H new ATOM 1274 N GLN A 629 -29.491 9.662 12.151 1.00 1.00 N ATOM 1275 CA GLN A 629 -29.389 8.593 13.130 1.00 1.00 C ATOM 1276 C GLN A 629 -29.959 7.293 12.559 1.00 1.00 C ATOM 1277 O GLN A 629 -31.062 7.280 12.016 1.00 1.00 O ATOM 1278 CB GLN A 629 -30.095 8.973 14.433 1.00 1.00 C ATOM 1279 CG GLN A 629 -29.294 10.027 15.203 1.00 1.00 C ATOM 1280 CD GLN A 629 -29.852 11.430 14.951 1.00 1.00 C ATOM 1281 OE1 GLN A 629 -29.338 12.198 14.154 1.00 1.00 O ATOM 1282 NE2 GLN A 629 -30.930 11.721 15.675 1.00 1.00 N ATOM 0 H GLN A 629 -30.340 9.645 11.586 1.00 1.00 H new ATOM 0 HA GLN A 629 -28.335 8.436 13.358 1.00 1.00 H new ATOM 0 HB2 GLN A 629 -31.091 9.357 14.213 1.00 1.00 H new ATOM 0 HB3 GLN A 629 -30.225 8.086 15.052 1.00 1.00 H new ATOM 0 HG2 GLN A 629 -29.325 9.805 16.270 1.00 1.00 H new ATOM 0 HG3 GLN A 629 -28.248 9.988 14.900 1.00 1.00 H new ATOM 0 HE21 GLN A 629 -31.310 11.032 16.324 1.00 1.00 H new ATOM 0 HE22 GLN A 629 -31.377 12.633 15.581 1.00 1.00 H new ATOM 1291 N PHE A 630 -29.180 6.230 12.699 1.00 1.00 N ATOM 1292 CA PHE A 630 -29.593 4.929 12.203 1.00 1.00 C ATOM 1293 C PHE A 630 -29.518 3.872 13.307 1.00 1.00 C ATOM 1294 O PHE A 630 -28.691 3.974 14.213 1.00 1.00 O ATOM 1295 CB PHE A 630 -28.624 4.548 11.083 1.00 1.00 C ATOM 1296 CG PHE A 630 -29.167 4.805 9.676 1.00 1.00 C ATOM 1297 CD1 PHE A 630 -29.896 5.925 9.422 1.00 1.00 C ATOM 1298 CD2 PHE A 630 -28.921 3.914 8.679 1.00 1.00 C ATOM 1299 CE1 PHE A 630 -30.401 6.164 8.117 1.00 1.00 C ATOM 1300 CE2 PHE A 630 -29.425 4.152 7.373 1.00 1.00 C ATOM 1301 CZ PHE A 630 -30.155 5.272 7.120 1.00 1.00 C ATOM 0 H PHE A 630 -28.265 6.244 13.149 1.00 1.00 H new ATOM 0 HA PHE A 630 -30.623 4.976 11.851 1.00 1.00 H new ATOM 0 HB2 PHE A 630 -27.698 5.108 11.212 1.00 1.00 H new ATOM 0 HB3 PHE A 630 -28.373 3.491 11.177 1.00 1.00 H new ATOM 0 HD1 PHE A 630 -30.091 6.633 10.214 1.00 1.00 H new ATOM 0 HD2 PHE A 630 -28.342 3.025 8.880 1.00 1.00 H new ATOM 0 HE1 PHE A 630 -30.980 7.053 7.916 1.00 1.00 H new ATOM 0 HE2 PHE A 630 -29.229 3.444 6.581 1.00 1.00 H new ATOM 0 HZ PHE A 630 -30.539 5.453 6.127 1.00 1.00 H new ATOM 1311 N ILE A 631 -30.390 2.881 13.196 1.00 1.00 N ATOM 1312 CA ILE A 631 -30.432 1.807 14.172 1.00 1.00 C ATOM 1313 C ILE A 631 -30.408 0.460 13.447 1.00 1.00 C ATOM 1314 O ILE A 631 -31.316 0.150 12.676 1.00 1.00 O ATOM 1315 CB ILE A 631 -31.630 1.980 15.108 1.00 1.00 C ATOM 1316 CG1 ILE A 631 -31.185 2.472 16.486 1.00 1.00 C ATOM 1317 CG2 ILE A 631 -32.447 0.689 15.197 1.00 1.00 C ATOM 1318 CD1 ILE A 631 -31.562 3.941 16.691 1.00 1.00 C ATOM 0 H ILE A 631 -31.074 2.800 12.444 1.00 1.00 H new ATOM 0 HA ILE A 631 -29.549 1.840 14.811 1.00 1.00 H new ATOM 0 HB ILE A 631 -32.282 2.746 14.689 1.00 1.00 H new ATOM 0 HG12 ILE A 631 -31.649 1.862 17.261 1.00 1.00 H new ATOM 0 HG13 ILE A 631 -30.107 2.352 16.588 1.00 1.00 H new ATOM 0 HG21 ILE A 631 -33.292 0.839 15.868 1.00 1.00 H new ATOM 0 HG22 ILE A 631 -32.814 0.421 14.206 1.00 1.00 H new ATOM 0 HG23 ILE A 631 -31.818 -0.114 15.580 1.00 1.00 H new ATOM 0 HD11 ILE A 631 -31.235 4.266 17.678 1.00 1.00 H new ATOM 0 HD12 ILE A 631 -31.077 4.551 15.929 1.00 1.00 H new ATOM 0 HD13 ILE A 631 -32.643 4.054 16.612 1.00 1.00 H new ATOM 1330 N LEU A 632 -29.359 -0.302 13.715 1.00 1.00 N ATOM 1331 CA LEU A 632 -29.205 -1.608 13.096 1.00 1.00 C ATOM 1332 C LEU A 632 -29.816 -2.675 14.006 1.00 1.00 C ATOM 1333 O LEU A 632 -30.003 -2.444 15.201 1.00 1.00 O ATOM 1334 CB LEU A 632 -27.738 -1.865 12.747 1.00 1.00 C ATOM 1335 CG LEU A 632 -26.977 -0.687 12.132 1.00 1.00 C ATOM 1336 CD1 LEU A 632 -25.995 -0.084 13.139 1.00 1.00 C ATOM 1337 CD2 LEU A 632 -26.285 -1.102 10.832 1.00 1.00 C ATOM 0 H LEU A 632 -28.607 -0.041 14.352 1.00 1.00 H new ATOM 0 HA LEU A 632 -29.746 -1.647 12.151 1.00 1.00 H new ATOM 0 HB2 LEU A 632 -27.218 -2.174 13.654 1.00 1.00 H new ATOM 0 HB3 LEU A 632 -27.692 -2.704 12.052 1.00 1.00 H new ATOM 0 HG LEU A 632 -27.696 0.092 11.879 1.00 1.00 H new ATOM 0 HD11 LEU A 632 -25.467 0.751 12.678 1.00 1.00 H new ATOM 0 HD12 LEU A 632 -26.542 0.271 14.013 1.00 1.00 H new ATOM 0 HD13 LEU A 632 -25.276 -0.843 13.445 1.00 1.00 H new ATOM 0 HD21 LEU A 632 -25.752 -0.248 10.415 1.00 1.00 H new ATOM 0 HD22 LEU A 632 -25.578 -1.906 11.037 1.00 1.00 H new ATOM 0 HD23 LEU A 632 -27.031 -1.448 10.117 1.00 1.00 H new ATOM 1349 N GLN A 633 -30.112 -3.820 13.409 1.00 1.00 N ATOM 1350 CA GLN A 633 -30.698 -4.923 14.150 1.00 1.00 C ATOM 1351 C GLN A 633 -30.445 -6.245 13.424 1.00 1.00 C ATOM 1352 O GLN A 633 -30.785 -6.388 12.251 1.00 1.00 O ATOM 1353 CB GLN A 633 -32.195 -4.697 14.374 1.00 1.00 C ATOM 1354 CG GLN A 633 -32.884 -5.992 14.810 1.00 1.00 C ATOM 1355 CD GLN A 633 -32.321 -6.493 16.142 1.00 1.00 C ATOM 1356 OE1 GLN A 633 -31.331 -5.997 16.652 1.00 1.00 O ATOM 1357 NE2 GLN A 633 -33.006 -7.501 16.673 1.00 1.00 N ATOM 0 H GLN A 633 -29.956 -4.008 12.419 1.00 1.00 H new ATOM 0 HA GLN A 633 -30.220 -4.973 15.129 1.00 1.00 H new ATOM 0 HB2 GLN A 633 -32.341 -3.929 15.134 1.00 1.00 H new ATOM 0 HB3 GLN A 633 -32.653 -4.328 13.456 1.00 1.00 H new ATOM 0 HG2 GLN A 633 -33.957 -5.823 14.905 1.00 1.00 H new ATOM 0 HG3 GLN A 633 -32.749 -6.756 14.044 1.00 1.00 H new ATOM 0 HE21 GLN A 633 -33.827 -7.869 16.192 1.00 1.00 H new ATOM 0 HE22 GLN A 633 -32.711 -7.906 17.561 1.00 1.00 H new ATOM 1366 N CYS A 634 -29.851 -7.179 14.152 1.00 1.00 N ATOM 1367 CA CYS A 634 -29.549 -8.485 13.593 1.00 1.00 C ATOM 1368 C CYS A 634 -30.058 -9.554 14.561 1.00 1.00 C ATOM 1369 O CYS A 634 -30.158 -9.309 15.763 1.00 1.00 O ATOM 1370 CB CYS A 634 -28.055 -8.643 13.303 1.00 1.00 C ATOM 1371 SG CYS A 634 -27.132 -8.860 14.869 1.00 1.00 S ATOM 0 H CYS A 634 -29.571 -7.057 15.125 1.00 1.00 H new ATOM 0 HA CYS A 634 -30.054 -8.597 12.633 1.00 1.00 H new ATOM 0 HB2 CYS A 634 -27.891 -9.502 12.653 1.00 1.00 H new ATOM 0 HB3 CYS A 634 -27.685 -7.766 12.772 1.00 1.00 H new ATOM 0 HG CYS A 634 -27.698 -9.789 15.581 1.00 1.00 H new ATOM 1377 N ASP A 635 -30.368 -10.714 14.003 1.00 1.00 N ATOM 1378 CA ASP A 635 -30.866 -11.820 14.803 1.00 1.00 C ATOM 1379 C ASP A 635 -29.687 -12.530 15.471 1.00 1.00 C ATOM 1380 O ASP A 635 -29.881 -13.344 16.373 1.00 1.00 O ATOM 1381 CB ASP A 635 -31.602 -12.841 13.932 1.00 1.00 C ATOM 1382 CG ASP A 635 -30.707 -13.661 13.000 1.00 1.00 C ATOM 1383 OD1 ASP A 635 -30.472 -13.180 11.871 1.00 1.00 O ATOM 1384 OD2 ASP A 635 -30.279 -14.750 13.438 1.00 1.00 O ATOM 0 H ASP A 635 -30.284 -10.913 13.006 1.00 1.00 H new ATOM 0 HA ASP A 635 -31.554 -11.417 15.546 1.00 1.00 H new ATOM 0 HB2 ASP A 635 -32.147 -13.525 14.582 1.00 1.00 H new ATOM 0 HB3 ASP A 635 -32.343 -12.315 13.330 1.00 1.00 H new ATOM 1389 N SER A 636 -28.494 -12.199 15.002 1.00 1.00 N ATOM 1390 CA SER A 636 -27.285 -12.795 15.543 1.00 1.00 C ATOM 1391 C SER A 636 -26.737 -11.927 16.679 1.00 1.00 C ATOM 1392 O SER A 636 -27.147 -10.779 16.841 1.00 1.00 O ATOM 1393 CB SER A 636 -26.225 -12.975 14.455 1.00 1.00 C ATOM 1394 OG SER A 636 -26.126 -14.330 14.025 1.00 1.00 O ATOM 0 H SER A 636 -28.338 -11.525 14.252 1.00 1.00 H new ATOM 0 HA SER A 636 -27.536 -13.781 15.935 1.00 1.00 H new ATOM 0 HB2 SER A 636 -26.469 -12.341 13.603 1.00 1.00 H new ATOM 0 HB3 SER A 636 -25.258 -12.643 14.833 1.00 1.00 H new ATOM 0 HG SER A 636 -25.187 -14.610 14.038 1.00 1.00 H new ATOM 1400 N ASP A 637 -25.819 -12.511 17.435 1.00 1.00 N ATOM 1401 CA ASP A 637 -25.212 -11.806 18.551 1.00 1.00 C ATOM 1402 C ASP A 637 -23.898 -11.167 18.091 1.00 1.00 C ATOM 1403 O ASP A 637 -23.675 -9.977 18.304 1.00 1.00 O ATOM 1404 CB ASP A 637 -24.893 -12.763 19.701 1.00 1.00 C ATOM 1405 CG ASP A 637 -25.678 -12.509 20.989 1.00 1.00 C ATOM 1406 OD1 ASP A 637 -25.619 -11.357 21.472 1.00 1.00 O ATOM 1407 OD2 ASP A 637 -26.318 -13.473 21.464 1.00 1.00 O ATOM 0 H ASP A 637 -25.481 -13.463 17.297 1.00 1.00 H new ATOM 0 HA ASP A 637 -25.918 -11.051 18.896 1.00 1.00 H new ATOM 0 HB2 ASP A 637 -25.088 -13.783 19.370 1.00 1.00 H new ATOM 0 HB3 ASP A 637 -23.828 -12.698 19.923 1.00 1.00 H new ATOM 1412 N PRO A 638 -23.043 -12.009 17.453 1.00 1.00 N ATOM 1413 CA PRO A 638 -21.758 -11.540 16.961 1.00 1.00 C ATOM 1414 C PRO A 638 -21.932 -10.698 15.694 1.00 1.00 C ATOM 1415 O PRO A 638 -21.330 -9.633 15.566 1.00 1.00 O ATOM 1416 CB PRO A 638 -20.941 -12.801 16.731 1.00 1.00 C ATOM 1417 CG PRO A 638 -21.944 -13.941 16.657 1.00 1.00 C ATOM 1418 CD PRO A 638 -23.275 -13.425 17.182 1.00 1.00 C ATOM 0 HA PRO A 638 -21.253 -10.878 17.664 1.00 1.00 H new ATOM 0 HB2 PRO A 638 -20.363 -12.729 15.810 1.00 1.00 H new ATOM 0 HB3 PRO A 638 -20.230 -12.959 17.542 1.00 1.00 H new ATOM 0 HG2 PRO A 638 -22.049 -14.292 15.630 1.00 1.00 H new ATOM 0 HG3 PRO A 638 -21.602 -14.789 17.250 1.00 1.00 H new ATOM 0 HD2 PRO A 638 -24.070 -13.563 16.449 1.00 1.00 H new ATOM 0 HD3 PRO A 638 -23.578 -13.956 18.084 1.00 1.00 H new ATOM 1426 N GLU A 639 -22.754 -11.210 14.791 1.00 1.00 N ATOM 1427 CA GLU A 639 -23.013 -10.518 13.539 1.00 1.00 C ATOM 1428 C GLU A 639 -22.742 -9.021 13.694 1.00 1.00 C ATOM 1429 O GLU A 639 -21.747 -8.511 13.182 1.00 1.00 O ATOM 1430 CB GLU A 639 -24.443 -10.770 13.060 1.00 1.00 C ATOM 1431 CG GLU A 639 -24.503 -11.971 12.115 1.00 1.00 C ATOM 1432 CD GLU A 639 -25.613 -11.798 11.076 1.00 1.00 C ATOM 1433 OE1 GLU A 639 -26.790 -11.913 11.480 1.00 1.00 O ATOM 1434 OE2 GLU A 639 -25.260 -11.556 9.902 1.00 1.00 O ATOM 0 H GLU A 639 -23.249 -12.095 14.900 1.00 1.00 H new ATOM 0 HA GLU A 639 -22.336 -10.913 12.781 1.00 1.00 H new ATOM 0 HB2 GLU A 639 -25.092 -10.946 13.918 1.00 1.00 H new ATOM 0 HB3 GLU A 639 -24.821 -9.883 12.551 1.00 1.00 H new ATOM 0 HG2 GLU A 639 -23.544 -12.090 11.611 1.00 1.00 H new ATOM 0 HG3 GLU A 639 -24.676 -12.881 12.689 1.00 1.00 H new ATOM 1441 N LEU A 640 -23.644 -8.358 14.402 1.00 1.00 N ATOM 1442 CA LEU A 640 -23.515 -6.929 14.629 1.00 1.00 C ATOM 1443 C LEU A 640 -22.170 -6.644 15.302 1.00 1.00 C ATOM 1444 O LEU A 640 -21.403 -5.806 14.833 1.00 1.00 O ATOM 1445 CB LEU A 640 -24.719 -6.400 15.413 1.00 1.00 C ATOM 1446 CG LEU A 640 -25.552 -5.323 14.715 1.00 1.00 C ATOM 1447 CD1 LEU A 640 -24.659 -4.210 14.164 1.00 1.00 C ATOM 1448 CD2 LEU A 640 -26.440 -5.935 13.631 1.00 1.00 C ATOM 0 H LEU A 640 -24.468 -8.784 14.826 1.00 1.00 H new ATOM 0 HA LEU A 640 -23.519 -6.390 13.681 1.00 1.00 H new ATOM 0 HB2 LEU A 640 -25.372 -7.240 15.649 1.00 1.00 H new ATOM 0 HB3 LEU A 640 -24.362 -5.998 16.361 1.00 1.00 H new ATOM 0 HG LEU A 640 -26.212 -4.869 15.454 1.00 1.00 H new ATOM 0 HD11 LEU A 640 -25.276 -3.458 13.673 1.00 1.00 H new ATOM 0 HD12 LEU A 640 -24.106 -3.748 14.982 1.00 1.00 H new ATOM 0 HD13 LEU A 640 -23.957 -4.630 13.444 1.00 1.00 H new ATOM 0 HD21 LEU A 640 -27.022 -5.148 13.150 1.00 1.00 H new ATOM 0 HD22 LEU A 640 -25.817 -6.431 12.887 1.00 1.00 H new ATOM 0 HD23 LEU A 640 -27.116 -6.662 14.082 1.00 1.00 H new ATOM 1460 N VAL A 641 -21.928 -7.358 16.391 1.00 1.00 N ATOM 1461 CA VAL A 641 -20.689 -7.192 17.133 1.00 1.00 C ATOM 1462 C VAL A 641 -19.527 -7.038 16.150 1.00 1.00 C ATOM 1463 O VAL A 641 -18.767 -6.074 16.227 1.00 1.00 O ATOM 1464 CB VAL A 641 -20.500 -8.360 18.104 1.00 1.00 C ATOM 1465 CG1 VAL A 641 -19.264 -9.183 17.736 1.00 1.00 C ATOM 1466 CG2 VAL A 641 -20.419 -7.864 19.548 1.00 1.00 C ATOM 0 H VAL A 641 -22.568 -8.052 16.778 1.00 1.00 H new ATOM 0 HA VAL A 641 -20.725 -6.286 17.738 1.00 1.00 H new ATOM 0 HB VAL A 641 -21.372 -9.009 18.022 1.00 1.00 H new ATOM 0 HG11 VAL A 641 -19.152 -10.007 18.441 1.00 1.00 H new ATOM 0 HG12 VAL A 641 -19.379 -9.581 16.728 1.00 1.00 H new ATOM 0 HG13 VAL A 641 -18.379 -8.548 17.776 1.00 1.00 H new ATOM 0 HG21 VAL A 641 -20.285 -8.714 20.218 1.00 1.00 H new ATOM 0 HG22 VAL A 641 -19.574 -7.183 19.652 1.00 1.00 H new ATOM 0 HG23 VAL A 641 -21.340 -7.341 19.805 1.00 1.00 H new ATOM 1476 N GLN A 642 -19.426 -8.003 15.247 1.00 1.00 N ATOM 1477 CA GLN A 642 -18.370 -7.987 14.250 1.00 1.00 C ATOM 1478 C GLN A 642 -18.610 -6.862 13.240 1.00 1.00 C ATOM 1479 O GLN A 642 -17.675 -6.164 12.848 1.00 1.00 O ATOM 1480 CB GLN A 642 -18.259 -9.341 13.546 1.00 1.00 C ATOM 1481 CG GLN A 642 -16.958 -10.051 13.924 1.00 1.00 C ATOM 1482 CD GLN A 642 -17.011 -10.562 15.365 1.00 1.00 C ATOM 1483 OE1 GLN A 642 -17.971 -11.180 15.796 1.00 1.00 O ATOM 1484 NE2 GLN A 642 -15.931 -10.270 16.084 1.00 1.00 N ATOM 0 H GLN A 642 -20.059 -8.801 15.186 1.00 1.00 H new ATOM 0 HA GLN A 642 -17.423 -7.799 14.756 1.00 1.00 H new ATOM 0 HB2 GLN A 642 -19.110 -9.966 13.816 1.00 1.00 H new ATOM 0 HB3 GLN A 642 -18.299 -9.198 12.466 1.00 1.00 H new ATOM 0 HG2 GLN A 642 -16.784 -10.885 13.245 1.00 1.00 H new ATOM 0 HG3 GLN A 642 -16.118 -9.366 13.808 1.00 1.00 H new ATOM 0 HE21 GLN A 642 -15.162 -9.749 15.661 1.00 1.00 H new ATOM 0 HE22 GLN A 642 -15.871 -10.567 17.058 1.00 1.00 H new ATOM 1493 N TRP A 643 -19.867 -6.720 12.849 1.00 1.00 N ATOM 1494 CA TRP A 643 -20.243 -5.691 11.894 1.00 1.00 C ATOM 1495 C TRP A 643 -19.774 -4.342 12.442 1.00 1.00 C ATOM 1496 O TRP A 643 -19.268 -3.505 11.695 1.00 1.00 O ATOM 1497 CB TRP A 643 -21.744 -5.730 11.607 1.00 1.00 C ATOM 1498 CG TRP A 643 -22.119 -6.527 10.355 1.00 1.00 C ATOM 1499 CD1 TRP A 643 -22.501 -7.809 10.277 1.00 1.00 C ATOM 1500 CD2 TRP A 643 -22.130 -6.039 8.998 1.00 1.00 C ATOM 1501 NE1 TRP A 643 -22.758 -8.182 8.974 1.00 1.00 N ATOM 1502 CE2 TRP A 643 -22.524 -7.072 8.171 1.00 1.00 C ATOM 1503 CE3 TRP A 643 -21.818 -4.769 8.484 1.00 1.00 C ATOM 1504 CZ2 TRP A 643 -22.644 -6.939 6.782 1.00 1.00 C ATOM 1505 CZ3 TRP A 643 -21.942 -4.651 7.094 1.00 1.00 C ATOM 1506 CH2 TRP A 643 -22.338 -5.681 6.247 1.00 1.00 C ATOM 0 H TRP A 643 -20.639 -7.301 13.176 1.00 1.00 H new ATOM 0 HA TRP A 643 -19.759 -5.863 10.933 1.00 1.00 H new ATOM 0 HB2 TRP A 643 -22.257 -6.162 12.467 1.00 1.00 H new ATOM 0 HB3 TRP A 643 -22.109 -4.709 11.498 1.00 1.00 H new ATOM 0 HD1 TRP A 643 -22.596 -8.468 11.128 1.00 1.00 H new ATOM 0 HE1 TRP A 643 -23.063 -9.103 8.658 1.00 1.00 H new ATOM 0 HE3 TRP A 643 -21.507 -3.947 9.112 1.00 1.00 H new ATOM 0 HZ2 TRP A 643 -22.956 -7.762 6.157 1.00 1.00 H new ATOM 0 HZ3 TRP A 643 -21.714 -3.694 6.649 1.00 1.00 H new ATOM 0 HH2 TRP A 643 -22.409 -5.512 5.183 1.00 1.00 H new ATOM 1517 N LYS A 644 -19.958 -4.172 13.743 1.00 1.00 N ATOM 1518 CA LYS A 644 -19.559 -2.939 14.400 1.00 1.00 C ATOM 1519 C LYS A 644 -18.038 -2.798 14.333 1.00 1.00 C ATOM 1520 O LYS A 644 -17.526 -1.809 13.809 1.00 1.00 O ATOM 1521 CB LYS A 644 -20.119 -2.885 15.824 1.00 1.00 C ATOM 1522 CG LYS A 644 -19.858 -1.521 16.465 1.00 1.00 C ATOM 1523 CD LYS A 644 -21.168 -0.771 16.709 1.00 1.00 C ATOM 1524 CE LYS A 644 -21.866 -1.279 17.973 1.00 1.00 C ATOM 1525 NZ LYS A 644 -21.910 -2.759 17.979 1.00 1.00 N ATOM 0 H LYS A 644 -20.378 -4.867 14.360 1.00 1.00 H new ATOM 0 HA LYS A 644 -19.982 -2.078 13.882 1.00 1.00 H new ATOM 0 HB2 LYS A 644 -21.191 -3.082 15.805 1.00 1.00 H new ATOM 0 HB3 LYS A 644 -19.661 -3.668 16.428 1.00 1.00 H new ATOM 0 HG2 LYS A 644 -19.330 -1.654 17.409 1.00 1.00 H new ATOM 0 HG3 LYS A 644 -19.211 -0.929 15.818 1.00 1.00 H new ATOM 0 HD2 LYS A 644 -20.967 0.296 16.804 1.00 1.00 H new ATOM 0 HD3 LYS A 644 -21.828 -0.896 15.850 1.00 1.00 H new ATOM 0 HE2 LYS A 644 -21.338 -0.921 18.857 1.00 1.00 H new ATOM 0 HE3 LYS A 644 -22.879 -0.879 18.023 1.00 1.00 H new ATOM 0 HZ1 LYS A 644 -22.529 -3.085 18.749 1.00 1.00 H new ATOM 0 HZ2 LYS A 644 -22.281 -3.099 17.069 1.00 1.00 H new ATOM 0 HZ3 LYS A 644 -20.951 -3.134 18.124 1.00 1.00 H new ATOM 1539 N LYS A 645 -17.359 -3.800 14.869 1.00 1.00 N ATOM 1540 CA LYS A 645 -15.906 -3.800 14.876 1.00 1.00 C ATOM 1541 C LYS A 645 -15.393 -3.307 13.522 1.00 1.00 C ATOM 1542 O LYS A 645 -14.607 -2.365 13.456 1.00 1.00 O ATOM 1543 CB LYS A 645 -15.372 -5.179 15.272 1.00 1.00 C ATOM 1544 CG LYS A 645 -13.947 -5.076 15.824 1.00 1.00 C ATOM 1545 CD LYS A 645 -12.922 -5.020 14.690 1.00 1.00 C ATOM 1546 CE LYS A 645 -11.545 -4.608 15.215 1.00 1.00 C ATOM 1547 NZ LYS A 645 -11.554 -3.188 15.632 1.00 1.00 N ATOM 0 H LYS A 645 -17.788 -4.618 15.302 1.00 1.00 H new ATOM 0 HA LYS A 645 -15.529 -3.109 15.630 1.00 1.00 H new ATOM 0 HB2 LYS A 645 -16.025 -5.625 16.022 1.00 1.00 H new ATOM 0 HB3 LYS A 645 -15.384 -5.840 14.406 1.00 1.00 H new ATOM 0 HG2 LYS A 645 -13.857 -4.184 16.444 1.00 1.00 H new ATOM 0 HG3 LYS A 645 -13.739 -5.933 16.465 1.00 1.00 H new ATOM 0 HD2 LYS A 645 -12.854 -5.995 14.208 1.00 1.00 H new ATOM 0 HD3 LYS A 645 -13.253 -4.311 13.931 1.00 1.00 H new ATOM 0 HE2 LYS A 645 -11.267 -5.239 16.059 1.00 1.00 H new ATOM 0 HE3 LYS A 645 -10.793 -4.761 14.441 1.00 1.00 H new ATOM 0 HZ1 LYS A 645 -10.579 -2.828 15.661 1.00 1.00 H new ATOM 0 HZ2 LYS A 645 -12.109 -2.630 14.952 1.00 1.00 H new ATOM 0 HZ3 LYS A 645 -11.981 -3.106 16.577 1.00 1.00 H new ATOM 1561 N GLU A 646 -15.861 -3.969 12.473 1.00 1.00 N ATOM 1562 CA GLU A 646 -15.460 -3.611 11.123 1.00 1.00 C ATOM 1563 C GLU A 646 -16.071 -2.265 10.727 1.00 1.00 C ATOM 1564 O GLU A 646 -15.523 -1.554 9.886 1.00 1.00 O ATOM 1565 CB GLU A 646 -15.850 -4.704 10.127 1.00 1.00 C ATOM 1566 CG GLU A 646 -14.941 -5.926 10.270 1.00 1.00 C ATOM 1567 CD GLU A 646 -15.097 -6.566 11.651 1.00 1.00 C ATOM 1568 OE1 GLU A 646 -16.009 -7.410 11.786 1.00 1.00 O ATOM 1569 OE2 GLU A 646 -14.299 -6.198 12.540 1.00 1.00 O ATOM 0 H GLU A 646 -16.514 -4.751 12.531 1.00 1.00 H new ATOM 0 HA GLU A 646 -14.374 -3.516 11.101 1.00 1.00 H new ATOM 0 HB2 GLU A 646 -16.887 -4.997 10.291 1.00 1.00 H new ATOM 0 HB3 GLU A 646 -15.785 -4.315 9.111 1.00 1.00 H new ATOM 0 HG2 GLU A 646 -15.183 -6.656 9.497 1.00 1.00 H new ATOM 0 HG3 GLU A 646 -13.903 -5.632 10.117 1.00 1.00 H new ATOM 1576 N LEU A 647 -17.198 -1.957 11.352 1.00 1.00 N ATOM 1577 CA LEU A 647 -17.890 -0.709 11.075 1.00 1.00 C ATOM 1578 C LEU A 647 -17.107 0.452 11.696 1.00 1.00 C ATOM 1579 O LEU A 647 -16.631 1.333 10.984 1.00 1.00 O ATOM 1580 CB LEU A 647 -19.345 -0.789 11.540 1.00 1.00 C ATOM 1581 CG LEU A 647 -20.370 -1.179 10.476 1.00 1.00 C ATOM 1582 CD1 LEU A 647 -21.456 -2.081 11.064 1.00 1.00 C ATOM 1583 CD2 LEU A 647 -20.959 0.062 9.800 1.00 1.00 C ATOM 0 H LEU A 647 -17.649 -2.550 12.049 1.00 1.00 H new ATOM 0 HA LEU A 647 -17.933 -0.527 10.001 1.00 1.00 H new ATOM 0 HB2 LEU A 647 -19.406 -1.510 12.355 1.00 1.00 H new ATOM 0 HB3 LEU A 647 -19.628 0.180 11.950 1.00 1.00 H new ATOM 0 HG LEU A 647 -19.858 -1.754 9.704 1.00 1.00 H new ATOM 0 HD11 LEU A 647 -22.172 -2.343 10.285 1.00 1.00 H new ATOM 0 HD12 LEU A 647 -21.000 -2.989 11.459 1.00 1.00 H new ATOM 0 HD13 LEU A 647 -21.971 -1.554 11.868 1.00 1.00 H new ATOM 0 HD21 LEU A 647 -21.685 -0.244 9.047 1.00 1.00 H new ATOM 0 HD22 LEU A 647 -21.451 0.684 10.547 1.00 1.00 H new ATOM 0 HD23 LEU A 647 -20.160 0.630 9.324 1.00 1.00 H new ATOM 1595 N ARG A 648 -17.000 0.411 13.016 1.00 1.00 N ATOM 1596 CA ARG A 648 -16.285 1.448 13.739 1.00 1.00 C ATOM 1597 C ARG A 648 -15.022 1.853 12.977 1.00 1.00 C ATOM 1598 O ARG A 648 -14.802 3.034 12.716 1.00 1.00 O ATOM 1599 CB ARG A 648 -15.896 0.972 15.142 1.00 1.00 C ATOM 1600 CG ARG A 648 -16.224 2.036 16.192 1.00 1.00 C ATOM 1601 CD ARG A 648 -15.413 1.812 17.470 1.00 1.00 C ATOM 1602 NE ARG A 648 -13.967 1.945 17.182 1.00 1.00 N ATOM 1603 CZ ARG A 648 -13.165 0.916 16.872 1.00 1.00 C ATOM 1604 NH1 ARG A 648 -13.662 -0.326 16.810 1.00 1.00 N ATOM 1605 NH2 ARG A 648 -11.865 1.131 16.627 1.00 1.00 N ATOM 0 H ARG A 648 -17.396 -0.323 13.603 1.00 1.00 H new ATOM 0 HA ARG A 648 -16.949 2.307 13.830 1.00 1.00 H new ATOM 0 HB2 ARG A 648 -16.426 0.049 15.377 1.00 1.00 H new ATOM 0 HB3 ARG A 648 -14.830 0.744 15.170 1.00 1.00 H new ATOM 0 HG2 ARG A 648 -16.011 3.027 15.790 1.00 1.00 H new ATOM 0 HG3 ARG A 648 -17.289 2.008 16.423 1.00 1.00 H new ATOM 0 HD2 ARG A 648 -15.709 2.535 18.230 1.00 1.00 H new ATOM 0 HD3 ARG A 648 -15.622 0.822 17.874 1.00 1.00 H new ATOM 0 HE ARG A 648 -13.555 2.877 17.222 1.00 1.00 H new ATOM 0 HH11 ARG A 648 -14.651 -0.490 16.999 1.00 1.00 H new ATOM 0 HH12 ARG A 648 -13.052 -1.108 16.574 1.00 1.00 H new ATOM 0 HH21 ARG A 648 -11.486 2.077 16.676 1.00 1.00 H new ATOM 0 HH22 ARG A 648 -11.254 0.349 16.391 1.00 1.00 H new ATOM 1619 N ASP A 649 -14.224 0.849 12.641 1.00 1.00 N ATOM 1620 CA ASP A 649 -12.989 1.086 11.913 1.00 1.00 C ATOM 1621 C ASP A 649 -13.307 1.795 10.595 1.00 1.00 C ATOM 1622 O ASP A 649 -12.663 2.783 10.248 1.00 1.00 O ATOM 1623 CB ASP A 649 -12.284 -0.232 11.583 1.00 1.00 C ATOM 1624 CG ASP A 649 -10.823 -0.091 11.149 1.00 1.00 C ATOM 1625 OD1 ASP A 649 -10.043 0.462 11.953 1.00 1.00 O ATOM 1626 OD2 ASP A 649 -10.521 -0.541 10.022 1.00 1.00 O ATOM 0 H ASP A 649 -14.409 -0.130 12.860 1.00 1.00 H new ATOM 0 HA ASP A 649 -12.339 1.696 12.540 1.00 1.00 H new ATOM 0 HB2 ASP A 649 -12.327 -0.879 12.459 1.00 1.00 H new ATOM 0 HB3 ASP A 649 -12.837 -0.734 10.789 1.00 1.00 H new ATOM 1631 N ALA A 650 -14.300 1.262 9.898 1.00 1.00 N ATOM 1632 CA ALA A 650 -14.711 1.832 8.626 1.00 1.00 C ATOM 1633 C ALA A 650 -14.896 3.342 8.785 1.00 1.00 C ATOM 1634 O ALA A 650 -14.266 4.127 8.079 1.00 1.00 O ATOM 1635 CB ALA A 650 -15.983 1.136 8.141 1.00 1.00 C ATOM 0 H ALA A 650 -14.832 0.442 10.190 1.00 1.00 H new ATOM 0 HA ALA A 650 -13.944 1.672 7.868 1.00 1.00 H new ATOM 0 HB1 ALA A 650 -16.291 1.564 7.187 1.00 1.00 H new ATOM 0 HB2 ALA A 650 -15.790 0.071 8.015 1.00 1.00 H new ATOM 0 HB3 ALA A 650 -16.777 1.276 8.875 1.00 1.00 H new ATOM 1641 N TYR A 651 -15.766 3.704 9.718 1.00 1.00 N ATOM 1642 CA TYR A 651 -16.044 5.106 9.979 1.00 1.00 C ATOM 1643 C TYR A 651 -14.821 5.805 10.574 1.00 1.00 C ATOM 1644 O TYR A 651 -14.652 7.013 10.414 1.00 1.00 O ATOM 1645 CB TYR A 651 -17.178 5.128 11.004 1.00 1.00 C ATOM 1646 CG TYR A 651 -18.443 4.397 10.548 1.00 1.00 C ATOM 1647 CD1 TYR A 651 -18.613 4.078 9.216 1.00 1.00 C ATOM 1648 CD2 TYR A 651 -19.413 4.055 11.470 1.00 1.00 C ATOM 1649 CE1 TYR A 651 -19.804 3.390 8.788 1.00 1.00 C ATOM 1650 CE2 TYR A 651 -20.603 3.368 11.040 1.00 1.00 C ATOM 1651 CZ TYR A 651 -20.740 3.068 9.721 1.00 1.00 C ATOM 1652 OH TYR A 651 -21.864 2.419 9.316 1.00 1.00 O ATOM 0 H TYR A 651 -16.287 3.050 10.302 1.00 1.00 H new ATOM 0 HA TYR A 651 -16.306 5.624 9.056 1.00 1.00 H new ATOM 0 HB2 TYR A 651 -16.825 4.677 11.931 1.00 1.00 H new ATOM 0 HB3 TYR A 651 -17.431 6.164 11.229 1.00 1.00 H new ATOM 0 HD1 TYR A 651 -17.854 4.344 8.495 1.00 1.00 H new ATOM 0 HD2 TYR A 651 -19.279 4.303 12.513 1.00 1.00 H new ATOM 0 HE1 TYR A 651 -19.951 3.135 7.749 1.00 1.00 H new ATOM 0 HE2 TYR A 651 -21.370 3.097 11.750 1.00 1.00 H new ATOM 0 HH TYR A 651 -21.826 2.273 8.348 1.00 1.00 H new ATOM 1662 N ARG A 652 -13.997 5.016 11.249 1.00 1.00 N ATOM 1663 CA ARG A 652 -12.795 5.545 11.869 1.00 1.00 C ATOM 1664 C ARG A 652 -11.733 5.838 10.807 1.00 1.00 C ATOM 1665 O ARG A 652 -11.403 6.996 10.557 1.00 1.00 O ATOM 1666 CB ARG A 652 -12.224 4.560 12.892 1.00 1.00 C ATOM 1667 CG ARG A 652 -13.147 4.433 14.106 1.00 1.00 C ATOM 1668 CD ARG A 652 -12.604 5.232 15.293 1.00 1.00 C ATOM 1669 NE ARG A 652 -11.303 4.674 15.726 1.00 1.00 N ATOM 1670 CZ ARG A 652 -10.433 5.320 16.514 1.00 1.00 C ATOM 1671 NH1 ARG A 652 -10.718 6.551 16.958 1.00 1.00 N ATOM 1672 NH2 ARG A 652 -9.278 4.736 16.856 1.00 1.00 N ATOM 0 H ARG A 652 -14.139 4.014 11.380 1.00 1.00 H new ATOM 0 HA ARG A 652 -13.066 6.468 12.381 1.00 1.00 H new ATOM 0 HB2 ARG A 652 -12.092 3.583 12.427 1.00 1.00 H new ATOM 0 HB3 ARG A 652 -11.238 4.895 13.214 1.00 1.00 H new ATOM 0 HG2 ARG A 652 -14.144 4.790 13.848 1.00 1.00 H new ATOM 0 HG3 ARG A 652 -13.246 3.384 14.384 1.00 1.00 H new ATOM 0 HD2 ARG A 652 -12.485 6.279 15.013 1.00 1.00 H new ATOM 0 HD3 ARG A 652 -13.315 5.201 16.119 1.00 1.00 H new ATOM 0 HE ARG A 652 -11.053 3.739 15.404 1.00 1.00 H new ATOM 0 HH11 ARG A 652 -11.597 6.997 16.696 1.00 1.00 H new ATOM 0 HH12 ARG A 652 -10.056 7.043 17.558 1.00 1.00 H new ATOM 0 HH21 ARG A 652 -9.060 3.799 16.517 1.00 1.00 H new ATOM 0 HH22 ARG A 652 -8.616 5.228 17.456 1.00 1.00 H new ATOM 1686 N GLU A 653 -11.229 4.768 10.209 1.00 1.00 N ATOM 1687 CA GLU A 653 -10.212 4.897 9.179 1.00 1.00 C ATOM 1688 C GLU A 653 -10.579 6.019 8.207 1.00 1.00 C ATOM 1689 O GLU A 653 -9.701 6.668 7.642 1.00 1.00 O ATOM 1690 CB GLU A 653 -10.013 3.572 8.439 1.00 1.00 C ATOM 1691 CG GLU A 653 -9.000 2.684 9.164 1.00 1.00 C ATOM 1692 CD GLU A 653 -8.417 1.631 8.218 1.00 1.00 C ATOM 1693 OE1 GLU A 653 -7.537 2.013 7.418 1.00 1.00 O ATOM 1694 OE2 GLU A 653 -8.867 0.469 8.317 1.00 1.00 O ATOM 0 H GLU A 653 -11.506 3.809 10.418 1.00 1.00 H new ATOM 0 HA GLU A 653 -9.267 5.154 9.658 1.00 1.00 H new ATOM 0 HB2 GLU A 653 -10.967 3.050 8.358 1.00 1.00 H new ATOM 0 HB3 GLU A 653 -9.669 3.767 7.423 1.00 1.00 H new ATOM 0 HG2 GLU A 653 -8.196 3.299 9.569 1.00 1.00 H new ATOM 0 HG3 GLU A 653 -9.482 2.192 10.009 1.00 1.00 H new ATOM 1701 N ALA A 654 -11.880 6.214 8.043 1.00 1.00 N ATOM 1702 CA ALA A 654 -12.375 7.248 7.150 1.00 1.00 C ATOM 1703 C ALA A 654 -12.190 8.617 7.807 1.00 1.00 C ATOM 1704 O ALA A 654 -11.922 9.606 7.127 1.00 1.00 O ATOM 1705 CB ALA A 654 -13.836 6.962 6.799 1.00 1.00 C ATOM 0 H ALA A 654 -12.606 5.673 8.513 1.00 1.00 H new ATOM 0 HA ALA A 654 -11.810 7.252 6.218 1.00 1.00 H new ATOM 0 HB1 ALA A 654 -14.208 7.737 6.129 1.00 1.00 H new ATOM 0 HB2 ALA A 654 -13.909 5.992 6.307 1.00 1.00 H new ATOM 0 HB3 ALA A 654 -14.434 6.953 7.710 1.00 1.00 H new ATOM 1711 N GLN A 655 -12.340 8.629 9.124 1.00 1.00 N ATOM 1712 CA GLN A 655 -12.192 9.861 9.882 1.00 1.00 C ATOM 1713 C GLN A 655 -10.910 10.586 9.473 1.00 1.00 C ATOM 1714 O GLN A 655 -10.921 11.794 9.246 1.00 1.00 O ATOM 1715 CB GLN A 655 -12.210 9.584 11.387 1.00 1.00 C ATOM 1716 CG GLN A 655 -10.790 9.406 11.928 1.00 1.00 C ATOM 1717 CD GLN A 655 -10.793 9.301 13.454 1.00 1.00 C ATOM 1718 OE1 GLN A 655 -11.529 8.531 14.047 1.00 1.00 O ATOM 1719 NE2 GLN A 655 -9.930 10.116 14.054 1.00 1.00 N ATOM 0 H GLN A 655 -12.562 7.807 9.685 1.00 1.00 H new ATOM 0 HA GLN A 655 -13.039 10.508 9.655 1.00 1.00 H new ATOM 0 HB2 GLN A 655 -12.700 10.407 11.906 1.00 1.00 H new ATOM 0 HB3 GLN A 655 -12.795 8.687 11.588 1.00 1.00 H new ATOM 0 HG2 GLN A 655 -10.344 8.509 11.499 1.00 1.00 H new ATOM 0 HG3 GLN A 655 -10.171 10.249 11.619 1.00 1.00 H new ATOM 0 HE21 GLN A 655 -9.342 10.736 13.497 1.00 1.00 H new ATOM 0 HE22 GLN A 655 -9.856 10.121 15.071 1.00 1.00 H new