USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 832 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 672 GLN : amide:sc= -2.16! K(o=-2.1!,f=-0.54) USER MOD Set 1.2: A 679 THR OG1 : rot -76:sc= 0.0167! USER MOD Set 2.1: A 602 THR OG1 : rot -140:sc= 0 USER MOD Set 2.2: A 651 HIS : no HE2:sc= -3.53! C(o=-3.5!,f=-9!) USER MOD Set 2.3: A 652 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 638 ASN : amide:sc=-0.00602 K(o=0.78,f=1.3) USER MOD Set 3.2: A 660 ASN : amide:sc= 0.789 K(o=0.78,f=1.3) USER MOD Single : A 573 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 577 HIS : no HD1:sc= -0.212 K(o=-0.21,f=-0.85) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 LYS NZ :NH3+ 173:sc= 1.22 (180deg=1.01) USER MOD Single : A 586 GLN : amide:sc= -0.961 K(o=-0.96,f=-0.044) USER MOD Single : A 587 TYR OH : rot 154:sc= -0.298! USER MOD Single : A 588 LYS NZ :NH3+ 159:sc= 1.19 (180deg=0.902) USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 SER OG : rot -6:sc= 1.22 USER MOD Single : A 598 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 607 ASN : amide:sc= -0.0554 K(o=-0.055,f=-2.1) USER MOD Single : A 608 SER OG : rot 180:sc= -0.722 USER MOD Single : A 610 GLN : amide:sc= -5.71! K(o=-5.7!,f=-1.3) USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : no HD1:sc= -0.169 X(o=-0.17,f=-0.011) USER MOD Single : A 617 SER OG : rot 180:sc= -1.96! USER MOD Single : A 624 LYS NZ :NH3+ -168:sc= 1.19 (180deg=1.06) USER MOD Single : A 626 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 628 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 640 ASN : amide:sc= -1.69 K(o=-1.7,f=-0.054) USER MOD Single : A 642 LYS NZ :NH3+ -163:sc= 2.52 (180deg=2.28) USER MOD Single : A 644 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 THR OG1 : rot 180:sc= 0.0852 USER MOD Single : A 646 LYS NZ :NH3+ 178:sc= 1.3 (180deg=1.26) USER MOD Single : A 649 TYR OH : rot -74:sc= 0.389 USER MOD Single : A 657 TYR OH : rot 3:sc= 0.795 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 665 MET CE :methyl 146:sc= -1.35 (180deg=-3.97!) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -0.641 K(o=-0.64,f=-6.3!) USER MOD Single : A 670 LYS NZ :NH3+ -177:sc= 1.29 (180deg=1.28) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 25.082 -11.628 -2.702 1.00 0.00 N ATOM 85 CA GLU A 568 24.405 -11.186 -1.520 1.00 0.00 C ATOM 86 C GLU A 568 23.844 -9.824 -1.962 1.00 0.00 C ATOM 87 O GLU A 568 23.794 -9.568 -3.171 1.00 0.00 O ATOM 88 CB GLU A 568 25.436 -10.977 -0.400 1.00 0.00 C ATOM 89 CG GLU A 568 24.868 -10.923 1.014 1.00 0.00 C ATOM 90 CD GLU A 568 24.645 -12.293 1.617 1.00 0.00 C ATOM 91 OE1 GLU A 568 25.611 -12.834 2.217 1.00 0.00 O ATOM 92 OE2 GLU A 568 23.532 -12.848 1.551 1.00 0.00 O ATOM 0 HA GLU A 568 23.649 -11.878 -1.148 1.00 0.00 H new ATOM 0 HB2 GLU A 568 26.167 -11.784 -0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 568 25.973 -10.048 -0.593 1.00 0.00 H new ATOM 0 HG2 GLU A 568 25.549 -10.359 1.651 1.00 0.00 H new ATOM 0 HG3 GLU A 568 23.922 -10.381 0.999 1.00 0.00 H new ATOM 99 N CYS A 569 23.468 -8.963 -1.062 1.00 0.00 N ATOM 100 CA CYS A 569 22.973 -7.660 -1.455 1.00 0.00 C ATOM 101 C CYS A 569 23.480 -6.565 -0.580 1.00 0.00 C ATOM 102 O CYS A 569 23.932 -6.782 0.545 1.00 0.00 O ATOM 103 CB CYS A 569 21.464 -7.602 -1.372 1.00 0.00 C ATOM 104 SG CYS A 569 20.590 -8.670 -2.484 1.00 0.00 S ATOM 0 H CYS A 569 23.491 -9.130 -0.056 1.00 0.00 H new ATOM 0 HA CYS A 569 23.326 -7.518 -2.476 1.00 0.00 H new ATOM 0 HB2 CYS A 569 21.165 -7.847 -0.353 1.00 0.00 H new ATOM 0 HB3 CYS A 569 21.148 -6.576 -1.559 1.00 0.00 H new ATOM 109 N GLU A 570 23.388 -5.393 -1.100 1.00 0.00 N ATOM 110 CA GLU A 570 23.578 -4.197 -0.374 1.00 0.00 C ATOM 111 C GLU A 570 22.488 -3.274 -0.871 1.00 0.00 C ATOM 112 O GLU A 570 22.414 -3.047 -2.072 1.00 0.00 O ATOM 113 CB GLU A 570 24.952 -3.576 -0.638 1.00 0.00 C ATOM 114 CG GLU A 570 25.239 -2.399 0.276 1.00 0.00 C ATOM 115 CD GLU A 570 26.537 -1.705 -0.020 1.00 0.00 C ATOM 116 OE1 GLU A 570 27.616 -2.282 0.237 1.00 0.00 O ATOM 117 OE2 GLU A 570 26.504 -0.539 -0.464 1.00 0.00 O ATOM 0 H GLU A 570 23.169 -5.239 -2.084 1.00 0.00 H new ATOM 0 HA GLU A 570 23.533 -4.376 0.700 1.00 0.00 H new ATOM 0 HB2 GLU A 570 25.723 -4.335 -0.502 1.00 0.00 H new ATOM 0 HB3 GLU A 570 25.006 -3.248 -1.676 1.00 0.00 H new ATOM 0 HG2 GLU A 570 24.425 -1.679 0.192 1.00 0.00 H new ATOM 0 HG3 GLU A 570 25.251 -2.747 1.309 1.00 0.00 H new ATOM 124 N LEU A 571 21.591 -2.863 0.034 1.00 0.00 N ATOM 125 CA LEU A 571 20.462 -1.934 -0.234 1.00 0.00 C ATOM 126 C LEU A 571 20.890 -0.892 -1.282 1.00 0.00 C ATOM 127 O LEU A 571 21.894 -0.178 -1.079 1.00 0.00 O ATOM 128 CB LEU A 571 20.117 -1.209 1.096 1.00 0.00 C ATOM 129 CG LEU A 571 18.693 -0.628 1.319 1.00 0.00 C ATOM 130 CD1 LEU A 571 18.622 0.059 2.664 1.00 0.00 C ATOM 131 CD2 LEU A 571 18.261 0.333 0.241 1.00 0.00 C ATOM 0 H LEU A 571 21.623 -3.171 1.006 1.00 0.00 H new ATOM 0 HA LEU A 571 19.599 -2.483 -0.610 1.00 0.00 H new ATOM 0 HB2 LEU A 571 20.311 -1.911 1.907 1.00 0.00 H new ATOM 0 HB3 LEU A 571 20.824 -0.387 1.210 1.00 0.00 H new ATOM 0 HG LEU A 571 18.006 -1.474 1.283 1.00 0.00 H new ATOM 0 HD11 LEU A 571 17.621 0.464 2.813 1.00 0.00 H new ATOM 0 HD12 LEU A 571 18.844 -0.660 3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 571 19.350 0.870 2.697 1.00 0.00 H new ATOM 0 HD21 LEU A 571 17.258 0.699 0.461 1.00 0.00 H new ATOM 0 HD22 LEU A 571 18.954 1.173 0.204 1.00 0.00 H new ATOM 0 HD23 LEU A 571 18.258 -0.178 -0.722 1.00 0.00 H new ATOM 143 N PRO A 572 20.171 -0.811 -2.417 1.00 0.00 N ATOM 144 CA PRO A 572 20.502 0.130 -3.489 1.00 0.00 C ATOM 145 C PRO A 572 20.227 1.582 -3.070 1.00 0.00 C ATOM 146 O PRO A 572 19.948 1.870 -1.898 1.00 0.00 O ATOM 147 CB PRO A 572 19.563 -0.291 -4.622 1.00 0.00 C ATOM 148 CG PRO A 572 18.395 -0.877 -3.929 1.00 0.00 C ATOM 149 CD PRO A 572 18.954 -1.597 -2.737 1.00 0.00 C ATOM 0 HA PRO A 572 21.557 0.101 -3.763 1.00 0.00 H new ATOM 0 HB2 PRO A 572 19.274 0.561 -5.237 1.00 0.00 H new ATOM 0 HB3 PRO A 572 20.038 -1.015 -5.284 1.00 0.00 H new ATOM 0 HG2 PRO A 572 17.690 -0.103 -3.625 1.00 0.00 H new ATOM 0 HG3 PRO A 572 17.854 -1.561 -4.582 1.00 0.00 H new ATOM 0 HD2 PRO A 572 18.250 -1.609 -1.905 1.00 0.00 H new ATOM 0 HD3 PRO A 572 19.192 -2.635 -2.967 1.00 0.00 H new ATOM 157 N LYS A 573 20.287 2.485 -3.986 1.00 0.00 N ATOM 158 CA LYS A 573 20.074 3.852 -3.638 1.00 0.00 C ATOM 159 C LYS A 573 18.599 4.167 -3.702 1.00 0.00 C ATOM 160 O LYS A 573 18.031 4.308 -4.790 1.00 0.00 O ATOM 161 CB LYS A 573 20.893 4.796 -4.532 1.00 0.00 C ATOM 162 CG LYS A 573 22.377 4.442 -4.600 1.00 0.00 C ATOM 163 CD LYS A 573 22.999 4.320 -3.214 1.00 0.00 C ATOM 164 CE LYS A 573 24.443 3.866 -3.304 1.00 0.00 C ATOM 165 NZ LYS A 573 25.028 3.617 -1.974 1.00 0.00 N ATOM 0 H LYS A 573 20.479 2.308 -4.972 1.00 0.00 H new ATOM 0 HA LYS A 573 20.421 4.011 -2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 573 20.478 4.779 -5.540 1.00 0.00 H new ATOM 0 HB3 LYS A 573 20.788 5.816 -4.161 1.00 0.00 H new ATOM 0 HG2 LYS A 573 22.501 3.502 -5.137 1.00 0.00 H new ATOM 0 HG3 LYS A 573 22.906 5.206 -5.169 1.00 0.00 H new ATOM 0 HD2 LYS A 573 22.948 5.281 -2.703 1.00 0.00 H new ATOM 0 HD3 LYS A 573 22.427 3.610 -2.616 1.00 0.00 H new ATOM 0 HE2 LYS A 573 24.500 2.956 -3.901 1.00 0.00 H new ATOM 0 HE3 LYS A 573 25.030 4.625 -3.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 26.015 3.309 -2.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 24.997 4.492 -1.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 24.484 2.875 -1.489 1.00 0.00 H new ATOM 179 N ILE A 574 17.965 4.205 -2.532 1.00 0.00 N ATOM 180 CA ILE A 574 16.543 4.538 -2.415 1.00 0.00 C ATOM 181 C ILE A 574 16.298 6.001 -2.791 1.00 0.00 C ATOM 182 O ILE A 574 17.211 6.727 -3.234 1.00 0.00 O ATOM 183 CB ILE A 574 15.987 4.341 -0.950 1.00 0.00 C ATOM 184 CG1 ILE A 574 16.805 5.185 0.045 1.00 0.00 C ATOM 185 CG2 ILE A 574 16.004 2.883 -0.551 1.00 0.00 C ATOM 186 CD1 ILE A 574 16.277 5.169 1.456 1.00 0.00 C ATOM 0 H ILE A 574 18.419 4.007 -1.640 1.00 0.00 H new ATOM 0 HA ILE A 574 16.027 3.858 -3.093 1.00 0.00 H new ATOM 0 HB ILE A 574 14.951 4.679 -0.930 1.00 0.00 H new ATOM 0 HG12 ILE A 574 17.833 4.823 0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 574 16.832 6.216 -0.308 1.00 0.00 H new ATOM 0 HG21 ILE A 574 15.616 2.778 0.462 1.00 0.00 H new ATOM 0 HG22 ILE A 574 15.382 2.310 -1.239 1.00 0.00 H new ATOM 0 HG23 ILE A 574 17.027 2.508 -0.588 1.00 0.00 H new ATOM 0 HD11 ILE A 574 16.912 5.788 2.089 1.00 0.00 H new ATOM 0 HD12 ILE A 574 15.260 5.561 1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 574 16.276 4.146 1.833 1.00 0.00 H new ATOM 193 N ASP A 575 15.084 6.422 -2.574 1.00 0.00 N ATOM 194 CA ASP A 575 14.646 7.788 -2.775 1.00 0.00 C ATOM 195 C ASP A 575 15.362 8.704 -1.752 1.00 0.00 C ATOM 196 O ASP A 575 16.197 8.258 -0.947 1.00 0.00 O ATOM 197 CB ASP A 575 13.146 7.857 -2.500 1.00 0.00 C ATOM 198 CG ASP A 575 12.451 9.039 -3.139 1.00 0.00 C ATOM 199 OD1 ASP A 575 12.464 10.139 -2.540 1.00 0.00 O ATOM 200 OD2 ASP A 575 11.892 8.896 -4.244 1.00 0.00 O ATOM 0 H ASP A 575 14.341 5.808 -2.241 1.00 0.00 H new ATOM 0 HA ASP A 575 14.872 8.106 -3.793 1.00 0.00 H new ATOM 0 HB2 ASP A 575 12.680 6.939 -2.858 1.00 0.00 H new ATOM 0 HB3 ASP A 575 12.987 7.896 -1.422 1.00 0.00 H new ATOM 205 N VAL A 576 15.008 9.943 -1.735 1.00 0.00 N ATOM 206 CA VAL A 576 15.591 10.863 -0.816 1.00 0.00 C ATOM 207 C VAL A 576 14.726 10.937 0.446 1.00 0.00 C ATOM 208 O VAL A 576 15.218 11.164 1.539 1.00 0.00 O ATOM 209 CB VAL A 576 15.819 12.273 -1.455 1.00 0.00 C ATOM 210 CG1 VAL A 576 14.522 12.906 -1.930 1.00 0.00 C ATOM 211 CG2 VAL A 576 16.554 13.196 -0.501 1.00 0.00 C ATOM 0 H VAL A 576 14.308 10.348 -2.356 1.00 0.00 H new ATOM 0 HA VAL A 576 16.581 10.500 -0.542 1.00 0.00 H new ATOM 0 HB VAL A 576 16.444 12.123 -2.335 1.00 0.00 H new ATOM 0 HG11 VAL A 576 14.732 13.883 -2.366 1.00 0.00 H new ATOM 0 HG12 VAL A 576 14.058 12.266 -2.681 1.00 0.00 H new ATOM 0 HG13 VAL A 576 13.844 13.024 -1.085 1.00 0.00 H new ATOM 0 HG21 VAL A 576 16.698 14.168 -0.973 1.00 0.00 H new ATOM 0 HG22 VAL A 576 15.969 13.318 0.410 1.00 0.00 H new ATOM 0 HG23 VAL A 576 17.525 12.766 -0.254 1.00 0.00 H new ATOM 215 N HIS A 577 13.440 10.667 0.296 1.00 0.00 N ATOM 216 CA HIS A 577 12.516 10.725 1.433 1.00 0.00 C ATOM 217 C HIS A 577 12.046 9.357 1.843 1.00 0.00 C ATOM 218 O HIS A 577 11.147 9.226 2.668 1.00 0.00 O ATOM 219 CB HIS A 577 11.325 11.629 1.139 1.00 0.00 C ATOM 220 CG HIS A 577 11.660 13.080 1.179 1.00 0.00 C ATOM 221 ND1 HIS A 577 11.703 13.865 0.065 1.00 0.00 N ATOM 222 CD2 HIS A 577 11.940 13.892 2.225 1.00 0.00 C ATOM 223 CE1 HIS A 577 11.999 15.096 0.408 1.00 0.00 C ATOM 224 NE2 HIS A 577 12.146 15.143 1.715 1.00 0.00 N ATOM 0 H HIS A 577 13.008 10.407 -0.591 1.00 0.00 H new ATOM 0 HA HIS A 577 13.072 11.152 2.267 1.00 0.00 H new ATOM 0 HB2 HIS A 577 10.926 11.383 0.155 1.00 0.00 H new ATOM 0 HB3 HIS A 577 10.536 11.426 1.863 1.00 0.00 H new ATOM 0 HD2 HIS A 577 11.991 13.606 3.265 1.00 0.00 H new ATOM 0 HE1 HIS A 577 12.104 15.931 -0.269 1.00 0.00 H new ATOM 0 HE2 HIS A 577 12.376 15.976 2.258 1.00 0.00 H new ATOM 233 N LEU A 578 12.664 8.363 1.287 1.00 0.00 N ATOM 234 CA LEU A 578 12.322 6.988 1.557 1.00 0.00 C ATOM 235 C LEU A 578 13.180 6.547 2.748 1.00 0.00 C ATOM 236 O LEU A 578 14.259 7.103 2.971 1.00 0.00 O ATOM 237 CB LEU A 578 12.640 6.168 0.277 1.00 0.00 C ATOM 238 CG LEU A 578 11.996 4.796 0.041 1.00 0.00 C ATOM 239 CD1 LEU A 578 12.466 3.795 0.958 1.00 0.00 C ATOM 240 CD2 LEU A 578 10.507 4.872 -0.005 1.00 0.00 C ATOM 0 H LEU A 578 13.431 8.477 0.624 1.00 0.00 H new ATOM 0 HA LEU A 578 11.270 6.844 1.803 1.00 0.00 H new ATOM 0 HB2 LEU A 578 12.381 6.794 -0.577 1.00 0.00 H new ATOM 0 HB3 LEU A 578 13.720 6.023 0.250 1.00 0.00 H new ATOM 0 HG LEU A 578 12.322 4.473 -0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 578 11.976 2.846 0.743 1.00 0.00 H new ATOM 0 HD12 LEU A 578 13.544 3.679 0.849 1.00 0.00 H new ATOM 0 HD13 LEU A 578 12.235 4.100 1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 578 10.097 3.876 -0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 578 10.133 5.262 0.942 1.00 0.00 H new ATOM 0 HD23 LEU A 578 10.201 5.533 -0.816 1.00 0.00 H new ATOM 252 N VAL A 579 12.689 5.625 3.511 1.00 0.00 N ATOM 253 CA VAL A 579 13.366 5.089 4.653 1.00 0.00 C ATOM 254 C VAL A 579 12.956 3.613 4.843 1.00 0.00 C ATOM 255 O VAL A 579 11.772 3.290 4.976 1.00 0.00 O ATOM 256 CB VAL A 579 13.097 5.939 5.949 1.00 0.00 C ATOM 257 CG1 VAL A 579 11.607 6.075 6.263 1.00 0.00 C ATOM 258 CG2 VAL A 579 13.847 5.373 7.143 1.00 0.00 C ATOM 0 H VAL A 579 11.772 5.207 3.352 1.00 0.00 H new ATOM 0 HA VAL A 579 14.441 5.138 4.477 1.00 0.00 H new ATOM 0 HB VAL A 579 13.474 6.941 5.745 1.00 0.00 H new ATOM 0 HG11 VAL A 579 11.479 6.671 7.167 1.00 0.00 H new ATOM 0 HG12 VAL A 579 11.103 6.566 5.430 1.00 0.00 H new ATOM 0 HG13 VAL A 579 11.176 5.086 6.416 1.00 0.00 H new ATOM 0 HG21 VAL A 579 13.641 5.982 8.024 1.00 0.00 H new ATOM 0 HG22 VAL A 579 13.521 4.349 7.325 1.00 0.00 H new ATOM 0 HG23 VAL A 579 14.917 5.382 6.938 1.00 0.00 H new ATOM 262 N PRO A 580 13.913 2.699 4.736 1.00 0.00 N ATOM 263 CA PRO A 580 13.667 1.270 4.941 1.00 0.00 C ATOM 264 C PRO A 580 13.501 0.897 6.427 1.00 0.00 C ATOM 265 O PRO A 580 14.060 1.558 7.325 1.00 0.00 O ATOM 266 CB PRO A 580 14.949 0.623 4.405 1.00 0.00 C ATOM 267 CG PRO A 580 15.996 1.662 4.602 1.00 0.00 C ATOM 268 CD PRO A 580 15.313 2.970 4.349 1.00 0.00 C ATOM 0 HA PRO A 580 12.746 0.950 4.454 1.00 0.00 H new ATOM 0 HB2 PRO A 580 15.189 -0.292 4.947 1.00 0.00 H new ATOM 0 HB3 PRO A 580 14.849 0.354 3.354 1.00 0.00 H new ATOM 0 HG2 PRO A 580 16.404 1.621 5.612 1.00 0.00 H new ATOM 0 HG3 PRO A 580 16.829 1.515 3.915 1.00 0.00 H new ATOM 0 HD2 PRO A 580 15.747 3.773 4.944 1.00 0.00 H new ATOM 0 HD3 PRO A 580 15.391 3.270 3.304 1.00 0.00 H new ATOM 276 N ASP A 581 12.697 -0.117 6.685 1.00 0.00 N ATOM 277 CA ASP A 581 12.584 -0.699 8.019 1.00 0.00 C ATOM 278 C ASP A 581 13.866 -1.424 8.341 1.00 0.00 C ATOM 279 O ASP A 581 14.522 -1.147 9.343 1.00 0.00 O ATOM 280 CB ASP A 581 11.417 -1.688 8.095 1.00 0.00 C ATOM 281 CG ASP A 581 11.381 -2.429 9.416 1.00 0.00 C ATOM 282 OD1 ASP A 581 10.739 -1.951 10.370 1.00 0.00 O ATOM 283 OD2 ASP A 581 11.990 -3.510 9.519 1.00 0.00 O ATOM 0 H ASP A 581 12.105 -0.562 5.984 1.00 0.00 H new ATOM 0 HA ASP A 581 12.401 0.102 8.735 1.00 0.00 H new ATOM 0 HB2 ASP A 581 10.478 -1.152 7.955 1.00 0.00 H new ATOM 0 HB3 ASP A 581 11.498 -2.406 7.279 1.00 0.00 H new ATOM 288 N ARG A 582 14.222 -2.350 7.475 1.00 0.00 N ATOM 289 CA ARG A 582 15.457 -3.067 7.610 1.00 0.00 C ATOM 290 C ARG A 582 16.579 -2.176 7.205 1.00 0.00 C ATOM 291 O ARG A 582 16.711 -1.871 6.030 1.00 0.00 O ATOM 292 CB ARG A 582 15.512 -4.303 6.704 1.00 0.00 C ATOM 293 CG ARG A 582 14.621 -5.468 7.067 1.00 0.00 C ATOM 294 CD ARG A 582 14.914 -5.986 8.453 1.00 0.00 C ATOM 295 NE ARG A 582 14.118 -5.307 9.488 1.00 0.00 N ATOM 296 CZ ARG A 582 14.097 -5.632 10.776 1.00 0.00 C ATOM 297 NH1 ARG A 582 14.831 -6.649 11.224 1.00 0.00 N ATOM 298 NH2 ARG A 582 13.329 -4.954 11.599 1.00 0.00 N ATOM 0 H ARG A 582 13.663 -2.620 6.666 1.00 0.00 H new ATOM 0 HA ARG A 582 15.535 -3.385 8.650 1.00 0.00 H new ATOM 0 HB2 ARG A 582 15.262 -3.990 5.690 1.00 0.00 H new ATOM 0 HB3 ARG A 582 16.542 -4.660 6.682 1.00 0.00 H new ATOM 0 HG2 ARG A 582 13.577 -5.160 7.007 1.00 0.00 H new ATOM 0 HG3 ARG A 582 14.758 -6.271 6.342 1.00 0.00 H new ATOM 0 HD2 ARG A 582 14.712 -7.057 8.488 1.00 0.00 H new ATOM 0 HD3 ARG A 582 15.974 -5.855 8.670 1.00 0.00 H new ATOM 0 HE ARG A 582 13.535 -4.524 9.193 1.00 0.00 H new ATOM 0 HH11 ARG A 582 15.412 -7.182 10.577 1.00 0.00 H new ATOM 0 HH12 ARG A 582 14.812 -6.895 12.214 1.00 0.00 H new ATOM 0 HH21 ARG A 582 12.757 -4.187 11.247 1.00 0.00 H new ATOM 0 HH22 ARG A 582 13.305 -5.195 12.590 1.00 0.00 H new ATOM 312 N LYS A 583 17.359 -1.740 8.134 1.00 0.00 N ATOM 313 CA LYS A 583 18.509 -0.974 7.797 1.00 0.00 C ATOM 314 C LYS A 583 19.716 -1.704 8.327 1.00 0.00 C ATOM 315 O LYS A 583 20.024 -1.655 9.523 1.00 0.00 O ATOM 316 CB LYS A 583 18.415 0.453 8.332 1.00 0.00 C ATOM 317 CG LYS A 583 19.377 1.415 7.672 1.00 0.00 C ATOM 318 CD LYS A 583 19.151 2.825 8.165 1.00 0.00 C ATOM 319 CE LYS A 583 19.868 3.829 7.292 1.00 0.00 C ATOM 320 NZ LYS A 583 19.588 5.219 7.705 1.00 0.00 N ATOM 0 H LYS A 583 17.222 -1.901 9.132 1.00 0.00 H new ATOM 0 HA LYS A 583 18.589 -0.872 6.715 1.00 0.00 H new ATOM 0 HB2 LYS A 583 17.397 0.818 8.192 1.00 0.00 H new ATOM 0 HB3 LYS A 583 18.605 0.442 9.405 1.00 0.00 H new ATOM 0 HG2 LYS A 583 20.403 1.112 7.882 1.00 0.00 H new ATOM 0 HG3 LYS A 583 19.249 1.379 6.590 1.00 0.00 H new ATOM 0 HD2 LYS A 583 18.083 3.043 8.174 1.00 0.00 H new ATOM 0 HD3 LYS A 583 19.503 2.915 9.193 1.00 0.00 H new ATOM 0 HE2 LYS A 583 20.942 3.647 7.336 1.00 0.00 H new ATOM 0 HE3 LYS A 583 19.564 3.690 6.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 20.099 5.876 7.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 18.566 5.402 7.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 19.902 5.359 8.687 1.00 0.00 H new ATOM 334 N LYS A 584 20.345 -2.437 7.464 1.00 0.00 N ATOM 335 CA LYS A 584 21.471 -3.242 7.822 1.00 0.00 C ATOM 336 C LYS A 584 22.564 -3.037 6.811 1.00 0.00 C ATOM 337 O LYS A 584 22.330 -2.441 5.765 1.00 0.00 O ATOM 338 CB LYS A 584 21.092 -4.741 7.966 1.00 0.00 C ATOM 339 CG LYS A 584 20.499 -5.386 6.724 1.00 0.00 C ATOM 340 CD LYS A 584 20.109 -6.827 6.949 1.00 0.00 C ATOM 341 CE LYS A 584 18.818 -6.924 7.732 1.00 0.00 C ATOM 342 NZ LYS A 584 18.540 -8.301 8.181 1.00 0.00 N ATOM 0 H LYS A 584 20.088 -2.495 6.478 1.00 0.00 H new ATOM 0 HA LYS A 584 21.830 -2.928 8.802 1.00 0.00 H new ATOM 0 HB2 LYS A 584 21.984 -5.298 8.253 1.00 0.00 H new ATOM 0 HB3 LYS A 584 20.377 -4.841 8.783 1.00 0.00 H new ATOM 0 HG2 LYS A 584 19.622 -4.821 6.409 1.00 0.00 H new ATOM 0 HG3 LYS A 584 21.222 -5.332 5.910 1.00 0.00 H new ATOM 0 HD2 LYS A 584 19.995 -7.331 5.989 1.00 0.00 H new ATOM 0 HD3 LYS A 584 20.904 -7.343 7.487 1.00 0.00 H new ATOM 0 HE2 LYS A 584 18.870 -6.265 8.599 1.00 0.00 H new ATOM 0 HE3 LYS A 584 17.993 -6.572 7.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 17.712 -8.300 8.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 18.346 -8.903 7.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 19.365 -8.672 8.694 1.00 0.00 H new ATOM 356 N ASP A 585 23.730 -3.501 7.137 1.00 0.00 N ATOM 357 CA ASP A 585 24.921 -3.342 6.313 1.00 0.00 C ATOM 358 C ASP A 585 24.747 -4.033 4.959 1.00 0.00 C ATOM 359 O ASP A 585 24.679 -3.379 3.916 1.00 0.00 O ATOM 360 CB ASP A 585 26.127 -3.924 7.051 1.00 0.00 C ATOM 361 CG ASP A 585 26.298 -3.357 8.445 1.00 0.00 C ATOM 362 OD1 ASP A 585 25.517 -3.746 9.364 1.00 0.00 O ATOM 363 OD2 ASP A 585 27.213 -2.540 8.665 1.00 0.00 O ATOM 0 H ASP A 585 23.900 -4.015 8.001 1.00 0.00 H new ATOM 0 HA ASP A 585 25.082 -2.280 6.129 1.00 0.00 H new ATOM 0 HB2 ASP A 585 26.018 -5.007 7.116 1.00 0.00 H new ATOM 0 HB3 ASP A 585 27.029 -3.728 6.472 1.00 0.00 H new ATOM 368 N GLN A 586 24.670 -5.340 4.975 1.00 0.00 N ATOM 369 CA GLN A 586 24.443 -6.111 3.778 1.00 0.00 C ATOM 370 C GLN A 586 23.203 -6.933 3.948 1.00 0.00 C ATOM 371 O GLN A 586 22.919 -7.424 5.043 1.00 0.00 O ATOM 372 CB GLN A 586 25.640 -7.004 3.396 1.00 0.00 C ATOM 373 CG GLN A 586 26.877 -6.242 2.941 1.00 0.00 C ATOM 374 CD GLN A 586 28.005 -6.182 3.972 1.00 0.00 C ATOM 375 OE1 GLN A 586 29.183 -6.116 3.602 1.00 0.00 O ATOM 376 NE2 GLN A 586 27.685 -6.250 5.242 1.00 0.00 N ATOM 0 H GLN A 586 24.763 -5.901 5.821 1.00 0.00 H new ATOM 0 HA GLN A 586 24.318 -5.408 2.954 1.00 0.00 H new ATOM 0 HB2 GLN A 586 25.905 -7.622 4.254 1.00 0.00 H new ATOM 0 HB3 GLN A 586 25.332 -7.681 2.599 1.00 0.00 H new ATOM 0 HG2 GLN A 586 27.259 -6.706 2.031 1.00 0.00 H new ATOM 0 HG3 GLN A 586 26.585 -5.224 2.682 1.00 0.00 H new ATOM 0 HE21 GLN A 586 26.705 -6.304 5.519 1.00 0.00 H new ATOM 0 HE22 GLN A 586 28.416 -6.249 5.953 1.00 0.00 H new ATOM 385 N TYR A 587 22.479 -7.085 2.884 1.00 0.00 N ATOM 386 CA TYR A 587 21.223 -7.773 2.901 1.00 0.00 C ATOM 387 C TYR A 587 21.381 -9.112 2.324 1.00 0.00 C ATOM 388 O TYR A 587 22.020 -9.280 1.293 1.00 0.00 O ATOM 389 CB TYR A 587 20.125 -6.972 2.190 1.00 0.00 C ATOM 390 CG TYR A 587 19.808 -5.691 2.918 1.00 0.00 C ATOM 391 CD1 TYR A 587 20.678 -4.621 2.852 1.00 0.00 C ATOM 392 CD2 TYR A 587 18.665 -5.556 3.702 1.00 0.00 C ATOM 393 CE1 TYR A 587 20.437 -3.472 3.528 1.00 0.00 C ATOM 394 CE2 TYR A 587 18.420 -4.401 4.373 1.00 0.00 C ATOM 395 CZ TYR A 587 19.315 -3.359 4.290 1.00 0.00 C ATOM 396 OH TYR A 587 19.072 -2.195 4.944 1.00 0.00 O ATOM 0 H TYR A 587 22.746 -6.730 1.966 1.00 0.00 H new ATOM 0 HA TYR A 587 20.902 -7.880 3.937 1.00 0.00 H new ATOM 0 HB2 TYR A 587 20.443 -6.743 1.173 1.00 0.00 H new ATOM 0 HB3 TYR A 587 19.223 -7.580 2.113 1.00 0.00 H new ATOM 0 HD1 TYR A 587 21.570 -4.702 2.248 1.00 0.00 H new ATOM 0 HD2 TYR A 587 17.967 -6.377 3.777 1.00 0.00 H new ATOM 0 HE1 TYR A 587 21.133 -2.649 3.462 1.00 0.00 H new ATOM 0 HE2 TYR A 587 17.526 -4.301 4.970 1.00 0.00 H new ATOM 0 HH TYR A 587 18.108 -2.096 5.089 1.00 0.00 H new ATOM 406 N LYS A 588 20.865 -10.059 3.000 1.00 0.00 N ATOM 407 CA LYS A 588 20.957 -11.402 2.571 1.00 0.00 C ATOM 408 C LYS A 588 19.929 -11.718 1.539 1.00 0.00 C ATOM 409 O LYS A 588 18.844 -11.149 1.553 1.00 0.00 O ATOM 410 CB LYS A 588 20.856 -12.326 3.740 1.00 0.00 C ATOM 411 CG LYS A 588 22.091 -12.280 4.622 1.00 0.00 C ATOM 412 CD LYS A 588 22.229 -13.533 5.451 1.00 0.00 C ATOM 413 CE LYS A 588 22.325 -14.766 4.551 1.00 0.00 C ATOM 414 NZ LYS A 588 23.454 -14.691 3.578 1.00 0.00 N ATOM 0 H LYS A 588 20.361 -9.927 3.877 1.00 0.00 H new ATOM 0 HA LYS A 588 21.932 -11.544 2.104 1.00 0.00 H new ATOM 0 HB2 LYS A 588 19.980 -12.064 4.333 1.00 0.00 H new ATOM 0 HB3 LYS A 588 20.706 -13.345 3.383 1.00 0.00 H new ATOM 0 HG2 LYS A 588 22.978 -12.155 4.001 1.00 0.00 H new ATOM 0 HG3 LYS A 588 22.037 -11.412 5.279 1.00 0.00 H new ATOM 0 HD2 LYS A 588 23.117 -13.464 6.079 1.00 0.00 H new ATOM 0 HD3 LYS A 588 21.373 -13.630 6.119 1.00 0.00 H new ATOM 0 HE2 LYS A 588 22.446 -15.654 5.172 1.00 0.00 H new ATOM 0 HE3 LYS A 588 21.389 -14.884 4.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 23.697 -15.649 3.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 23.171 -14.111 2.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 24.281 -14.261 4.039 1.00 0.00 H new ATOM 428 N VAL A 589 20.273 -12.596 0.629 1.00 0.00 N ATOM 429 CA VAL A 589 19.374 -12.978 -0.445 1.00 0.00 C ATOM 430 C VAL A 589 18.083 -13.570 0.130 1.00 0.00 C ATOM 431 O VAL A 589 18.091 -14.631 0.753 1.00 0.00 O ATOM 432 CB VAL A 589 20.041 -13.978 -1.424 1.00 0.00 C ATOM 433 CG1 VAL A 589 19.113 -14.300 -2.583 1.00 0.00 C ATOM 434 CG2 VAL A 589 21.356 -13.423 -1.944 1.00 0.00 C ATOM 0 H VAL A 589 21.178 -13.067 0.607 1.00 0.00 H new ATOM 0 HA VAL A 589 19.132 -12.079 -1.011 1.00 0.00 H new ATOM 0 HB VAL A 589 20.243 -14.899 -0.878 1.00 0.00 H new ATOM 0 HG11 VAL A 589 19.603 -15.003 -3.257 1.00 0.00 H new ATOM 0 HG12 VAL A 589 18.194 -14.744 -2.201 1.00 0.00 H new ATOM 0 HG13 VAL A 589 18.876 -13.384 -3.125 1.00 0.00 H new ATOM 0 HG21 VAL A 589 21.808 -14.140 -2.629 1.00 0.00 H new ATOM 0 HG22 VAL A 589 21.173 -12.485 -2.469 1.00 0.00 H new ATOM 0 HG23 VAL A 589 22.032 -13.245 -1.108 1.00 0.00 H new ATOM 438 N GLY A 590 16.998 -12.847 -0.049 1.00 0.00 N ATOM 439 CA GLY A 590 15.718 -13.259 0.475 1.00 0.00 C ATOM 440 C GLY A 590 15.241 -12.326 1.561 1.00 0.00 C ATOM 441 O GLY A 590 14.118 -12.453 2.054 1.00 0.00 O ATOM 0 H GLY A 590 16.980 -11.964 -0.558 1.00 0.00 H new ATOM 0 HA2 GLY A 590 14.985 -13.286 -0.331 1.00 0.00 H new ATOM 0 HA3 GLY A 590 15.794 -14.272 0.871 1.00 0.00 H new ATOM 445 N GLU A 591 16.092 -11.387 1.939 1.00 0.00 N ATOM 446 CA GLU A 591 15.766 -10.400 2.951 1.00 0.00 C ATOM 447 C GLU A 591 14.752 -9.445 2.368 1.00 0.00 C ATOM 448 O GLU A 591 14.890 -9.033 1.204 1.00 0.00 O ATOM 449 CB GLU A 591 17.036 -9.629 3.357 1.00 0.00 C ATOM 450 CG GLU A 591 16.946 -8.848 4.632 1.00 0.00 C ATOM 451 CD GLU A 591 16.544 -9.681 5.807 1.00 0.00 C ATOM 452 OE1 GLU A 591 15.348 -9.925 6.006 1.00 0.00 O ATOM 453 OE2 GLU A 591 17.426 -10.067 6.585 1.00 0.00 O ATOM 0 H GLU A 591 17.030 -11.289 1.551 1.00 0.00 H new ATOM 0 HA GLU A 591 15.358 -10.889 3.836 1.00 0.00 H new ATOM 0 HB2 GLU A 591 17.857 -10.340 3.446 1.00 0.00 H new ATOM 0 HB3 GLU A 591 17.295 -8.943 2.551 1.00 0.00 H new ATOM 0 HG2 GLU A 591 17.912 -8.386 4.836 1.00 0.00 H new ATOM 0 HG3 GLU A 591 16.226 -8.039 4.505 1.00 0.00 H new ATOM 460 N VAL A 592 13.732 -9.117 3.121 1.00 0.00 N ATOM 461 CA VAL A 592 12.756 -8.199 2.631 1.00 0.00 C ATOM 462 C VAL A 592 12.935 -6.885 3.321 1.00 0.00 C ATOM 463 O VAL A 592 13.151 -6.820 4.541 1.00 0.00 O ATOM 464 CB VAL A 592 11.282 -8.706 2.737 1.00 0.00 C ATOM 465 CG1 VAL A 592 11.161 -10.113 2.232 1.00 0.00 C ATOM 466 CG2 VAL A 592 10.681 -8.556 4.120 1.00 0.00 C ATOM 0 H VAL A 592 13.564 -9.471 4.063 1.00 0.00 H new ATOM 0 HA VAL A 592 12.927 -8.090 1.560 1.00 0.00 H new ATOM 0 HB VAL A 592 10.691 -8.054 2.093 1.00 0.00 H new ATOM 0 HG11 VAL A 592 10.125 -10.442 2.317 1.00 0.00 H new ATOM 0 HG12 VAL A 592 11.470 -10.153 1.187 1.00 0.00 H new ATOM 0 HG13 VAL A 592 11.800 -10.768 2.824 1.00 0.00 H new ATOM 0 HG21 VAL A 592 9.657 -8.929 4.114 1.00 0.00 H new ATOM 0 HG22 VAL A 592 11.271 -9.127 4.837 1.00 0.00 H new ATOM 0 HG23 VAL A 592 10.682 -7.504 4.405 1.00 0.00 H new ATOM 470 N LEU A 593 12.912 -5.859 2.568 1.00 0.00 N ATOM 471 CA LEU A 593 13.101 -4.564 3.100 1.00 0.00 C ATOM 472 C LEU A 593 11.842 -3.802 2.946 1.00 0.00 C ATOM 473 O LEU A 593 11.491 -3.408 1.841 1.00 0.00 O ATOM 474 CB LEU A 593 14.233 -3.806 2.410 1.00 0.00 C ATOM 475 CG LEU A 593 15.639 -4.316 2.518 1.00 0.00 C ATOM 476 CD1 LEU A 593 15.854 -5.616 1.737 1.00 0.00 C ATOM 477 CD2 LEU A 593 16.553 -3.222 2.036 1.00 0.00 C ATOM 0 H LEU A 593 12.761 -5.889 1.560 1.00 0.00 H new ATOM 0 HA LEU A 593 13.375 -4.671 4.150 1.00 0.00 H new ATOM 0 HB2 LEU A 593 13.988 -3.748 1.350 1.00 0.00 H new ATOM 0 HB3 LEU A 593 14.225 -2.786 2.795 1.00 0.00 H new ATOM 0 HG LEU A 593 15.857 -4.567 3.556 1.00 0.00 H new ATOM 0 HD11 LEU A 593 16.888 -5.941 1.849 1.00 0.00 H new ATOM 0 HD12 LEU A 593 15.187 -6.387 2.123 1.00 0.00 H new ATOM 0 HD13 LEU A 593 15.639 -5.446 0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 593 17.588 -3.558 2.100 1.00 0.00 H new ATOM 0 HD22 LEU A 593 16.314 -2.978 1.001 1.00 0.00 H new ATOM 0 HD23 LEU A 593 16.420 -2.336 2.657 1.00 0.00 H new ATOM 489 N LYS A 594 11.128 -3.655 4.020 1.00 0.00 N ATOM 490 CA LYS A 594 9.916 -2.900 3.994 1.00 0.00 C ATOM 491 C LYS A 594 10.274 -1.434 4.028 1.00 0.00 C ATOM 492 O LYS A 594 10.713 -0.918 5.045 1.00 0.00 O ATOM 493 CB LYS A 594 9.037 -3.246 5.183 1.00 0.00 C ATOM 494 CG LYS A 594 8.830 -4.723 5.397 1.00 0.00 C ATOM 495 CD LYS A 594 7.904 -4.967 6.546 1.00 0.00 C ATOM 496 CE LYS A 594 7.772 -6.443 6.820 1.00 0.00 C ATOM 497 NZ LYS A 594 6.770 -6.716 7.854 1.00 0.00 N ATOM 0 H LYS A 594 11.367 -4.051 4.929 1.00 0.00 H new ATOM 0 HA LYS A 594 9.358 -3.136 3.088 1.00 0.00 H new ATOM 0 HB2 LYS A 594 9.480 -2.820 6.083 1.00 0.00 H new ATOM 0 HB3 LYS A 594 8.065 -2.771 5.051 1.00 0.00 H new ATOM 0 HG2 LYS A 594 8.421 -5.173 4.492 1.00 0.00 H new ATOM 0 HG3 LYS A 594 9.789 -5.206 5.587 1.00 0.00 H new ATOM 0 HD2 LYS A 594 8.278 -4.459 7.435 1.00 0.00 H new ATOM 0 HD3 LYS A 594 6.924 -4.544 6.326 1.00 0.00 H new ATOM 0 HE2 LYS A 594 7.496 -6.960 5.901 1.00 0.00 H new ATOM 0 HE3 LYS A 594 8.736 -6.842 7.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 6.708 -7.742 8.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 7.046 -6.243 8.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 5.844 -6.357 7.544 1.00 0.00 H new ATOM 511 N PHE A 595 10.184 -0.811 2.914 1.00 0.00 N ATOM 512 CA PHE A 595 10.460 0.581 2.782 1.00 0.00 C ATOM 513 C PHE A 595 9.237 1.366 3.085 1.00 0.00 C ATOM 514 O PHE A 595 8.130 0.815 3.084 1.00 0.00 O ATOM 515 CB PHE A 595 10.805 0.906 1.357 1.00 0.00 C ATOM 516 CG PHE A 595 12.019 0.242 0.797 1.00 0.00 C ATOM 517 CD1 PHE A 595 13.256 0.397 1.391 1.00 0.00 C ATOM 518 CD2 PHE A 595 11.926 -0.504 -0.350 1.00 0.00 C ATOM 519 CE1 PHE A 595 14.377 -0.188 0.848 1.00 0.00 C ATOM 520 CE2 PHE A 595 13.030 -1.091 -0.893 1.00 0.00 C ATOM 521 CZ PHE A 595 14.264 -0.937 -0.298 1.00 0.00 C ATOM 0 H PHE A 595 9.909 -1.261 2.041 1.00 0.00 H new ATOM 0 HA PHE A 595 11.279 0.822 3.460 1.00 0.00 H new ATOM 0 HB2 PHE A 595 9.953 0.642 0.731 1.00 0.00 H new ATOM 0 HB3 PHE A 595 10.938 1.985 1.276 1.00 0.00 H new ATOM 0 HD1 PHE A 595 13.345 0.985 2.293 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.966 -0.628 -0.829 1.00 0.00 H new ATOM 0 HE1 PHE A 595 15.340 -0.059 1.320 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.937 -1.680 -1.794 1.00 0.00 H new ATOM 0 HZ PHE A 595 15.137 -1.403 -0.731 1.00 0.00 H new ATOM 531 N SER A 596 9.426 2.632 3.340 1.00 0.00 N ATOM 532 CA SER A 596 8.383 3.593 3.442 1.00 0.00 C ATOM 533 C SER A 596 9.019 4.928 3.350 1.00 0.00 C ATOM 534 O SER A 596 10.197 5.016 3.126 1.00 0.00 O ATOM 535 CB SER A 596 7.515 3.474 4.711 1.00 0.00 C ATOM 536 OG SER A 596 6.828 2.236 4.810 1.00 0.00 O ATOM 0 H SER A 596 10.354 3.030 3.487 1.00 0.00 H new ATOM 0 HA SER A 596 7.677 3.419 2.630 1.00 0.00 H new ATOM 0 HB2 SER A 596 8.149 3.601 5.589 1.00 0.00 H new ATOM 0 HB3 SER A 596 6.788 4.286 4.723 1.00 0.00 H new ATOM 0 HG SER A 596 6.969 1.717 3.990 1.00 0.00 H new ATOM 542 N CYS A 597 8.265 5.923 3.511 1.00 0.00 N ATOM 543 CA CYS A 597 8.743 7.247 3.382 1.00 0.00 C ATOM 544 C CYS A 597 8.715 7.963 4.710 1.00 0.00 C ATOM 545 O CYS A 597 8.192 7.438 5.706 1.00 0.00 O ATOM 546 CB CYS A 597 7.924 7.986 2.345 1.00 0.00 C ATOM 547 SG CYS A 597 8.117 7.325 0.663 1.00 0.00 S ATOM 0 H CYS A 597 7.274 5.854 3.742 1.00 0.00 H new ATOM 0 HA CYS A 597 9.781 7.217 3.051 1.00 0.00 H new ATOM 0 HB2 CYS A 597 6.872 7.942 2.626 1.00 0.00 H new ATOM 0 HB3 CYS A 597 8.211 9.038 2.349 1.00 0.00 H new ATOM 552 N LYS A 598 9.311 9.136 4.720 1.00 0.00 N ATOM 553 CA LYS A 598 9.374 10.001 5.869 1.00 0.00 C ATOM 554 C LYS A 598 7.993 10.359 6.420 1.00 0.00 C ATOM 555 O LYS A 598 7.001 10.212 5.721 1.00 0.00 O ATOM 556 CB LYS A 598 10.213 11.242 5.546 1.00 0.00 C ATOM 557 CG LYS A 598 11.687 10.907 5.394 1.00 0.00 C ATOM 558 CD LYS A 598 12.272 10.304 6.684 1.00 0.00 C ATOM 559 CE LYS A 598 13.651 9.660 6.489 1.00 0.00 C ATOM 560 NZ LYS A 598 14.700 10.611 6.073 1.00 0.00 N ATOM 0 H LYS A 598 9.779 9.522 3.900 1.00 0.00 H new ATOM 0 HA LYS A 598 9.868 9.453 6.671 1.00 0.00 H new ATOM 0 HB2 LYS A 598 9.848 11.697 4.626 1.00 0.00 H new ATOM 0 HB3 LYS A 598 10.089 11.980 6.338 1.00 0.00 H new ATOM 0 HG2 LYS A 598 11.817 10.203 4.572 1.00 0.00 H new ATOM 0 HG3 LYS A 598 12.240 11.809 5.131 1.00 0.00 H new ATOM 0 HD2 LYS A 598 12.349 11.087 7.439 1.00 0.00 H new ATOM 0 HD3 LYS A 598 11.581 9.555 7.071 1.00 0.00 H new ATOM 0 HE2 LYS A 598 13.954 9.184 7.422 1.00 0.00 H new ATOM 0 HE3 LYS A 598 13.571 8.872 5.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 15.602 10.106 5.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 14.433 11.048 5.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 14.805 11.350 6.797 1.00 0.00 H new ATOM 574 N PRO A 599 7.946 10.845 7.687 1.00 0.00 N ATOM 575 CA PRO A 599 6.705 11.127 8.446 1.00 0.00 C ATOM 576 C PRO A 599 5.537 11.744 7.655 1.00 0.00 C ATOM 577 O PRO A 599 4.376 11.385 7.872 1.00 0.00 O ATOM 578 CB PRO A 599 7.183 12.103 9.507 1.00 0.00 C ATOM 579 CG PRO A 599 8.565 11.664 9.809 1.00 0.00 C ATOM 580 CD PRO A 599 9.138 11.160 8.519 1.00 0.00 C ATOM 0 HA PRO A 599 6.274 10.192 8.805 1.00 0.00 H new ATOM 0 HB2 PRO A 599 7.162 13.130 9.142 1.00 0.00 H new ATOM 0 HB3 PRO A 599 6.551 12.067 10.394 1.00 0.00 H new ATOM 0 HG2 PRO A 599 9.158 12.490 10.201 1.00 0.00 H new ATOM 0 HG3 PRO A 599 8.567 10.881 10.568 1.00 0.00 H new ATOM 0 HD2 PRO A 599 9.768 11.911 8.043 1.00 0.00 H new ATOM 0 HD3 PRO A 599 9.758 10.277 8.677 1.00 0.00 H new ATOM 588 N GLY A 600 5.833 12.676 6.789 1.00 0.00 N ATOM 589 CA GLY A 600 4.797 13.343 6.047 1.00 0.00 C ATOM 590 C GLY A 600 4.584 12.800 4.648 1.00 0.00 C ATOM 591 O GLY A 600 3.782 13.346 3.880 1.00 0.00 O ATOM 0 H GLY A 600 6.781 12.990 6.580 1.00 0.00 H new ATOM 0 HA2 GLY A 600 3.862 13.265 6.601 1.00 0.00 H new ATOM 0 HA3 GLY A 600 5.040 14.403 5.980 1.00 0.00 H new ATOM 595 N PHE A 601 5.254 11.735 4.311 1.00 0.00 N ATOM 596 CA PHE A 601 5.215 11.228 2.969 1.00 0.00 C ATOM 597 C PHE A 601 4.476 9.936 2.828 1.00 0.00 C ATOM 598 O PHE A 601 4.413 9.119 3.747 1.00 0.00 O ATOM 599 CB PHE A 601 6.611 11.063 2.413 1.00 0.00 C ATOM 600 CG PHE A 601 7.256 12.325 2.011 1.00 0.00 C ATOM 601 CD1 PHE A 601 7.876 13.139 2.931 1.00 0.00 C ATOM 602 CD2 PHE A 601 7.239 12.692 0.695 1.00 0.00 C ATOM 603 CE1 PHE A 601 8.468 14.312 2.539 1.00 0.00 C ATOM 604 CE2 PHE A 601 7.826 13.861 0.280 1.00 0.00 C ATOM 605 CZ PHE A 601 8.445 14.678 1.205 1.00 0.00 C ATOM 0 H PHE A 601 5.838 11.198 4.952 1.00 0.00 H new ATOM 0 HA PHE A 601 4.664 11.976 2.398 1.00 0.00 H new ATOM 0 HB2 PHE A 601 7.233 10.573 3.163 1.00 0.00 H new ATOM 0 HB3 PHE A 601 6.570 10.399 1.550 1.00 0.00 H new ATOM 0 HD1 PHE A 601 7.897 12.851 3.972 1.00 0.00 H new ATOM 0 HD2 PHE A 601 6.756 12.053 -0.029 1.00 0.00 H new ATOM 0 HE1 PHE A 601 8.950 14.947 3.268 1.00 0.00 H new ATOM 0 HE2 PHE A 601 7.804 14.140 -0.763 1.00 0.00 H new ATOM 0 HZ PHE A 601 8.910 15.600 0.888 1.00 0.00 H new ATOM 615 N THR A 602 3.928 9.780 1.677 1.00 0.00 N ATOM 616 CA THR A 602 3.279 8.603 1.266 1.00 0.00 C ATOM 617 C THR A 602 4.239 7.780 0.420 1.00 0.00 C ATOM 618 O THR A 602 4.812 8.298 -0.553 1.00 0.00 O ATOM 619 CB THR A 602 2.039 8.961 0.421 1.00 0.00 C ATOM 620 OG1 THR A 602 1.053 9.637 1.216 1.00 0.00 O ATOM 621 CG2 THR A 602 1.434 7.751 -0.265 1.00 0.00 C ATOM 0 H THR A 602 3.924 10.511 0.966 1.00 0.00 H new ATOM 0 HA THR A 602 2.967 8.033 2.141 1.00 0.00 H new ATOM 0 HB THR A 602 2.380 9.637 -0.364 1.00 0.00 H new ATOM 0 HG1 THR A 602 0.160 9.318 0.970 1.00 0.00 H new ATOM 0 HG21 THR A 602 0.565 8.059 -0.846 1.00 0.00 H new ATOM 0 HG22 THR A 602 2.173 7.301 -0.928 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.129 7.022 0.486 1.00 0.00 H new ATOM 629 N ILE A 603 4.440 6.546 0.797 1.00 0.00 N ATOM 630 CA ILE A 603 5.233 5.660 -0.002 1.00 0.00 C ATOM 631 C ILE A 603 4.414 5.208 -1.206 1.00 0.00 C ATOM 632 O ILE A 603 3.253 4.786 -1.074 1.00 0.00 O ATOM 633 CB ILE A 603 5.787 4.430 0.787 1.00 0.00 C ATOM 634 CG1 ILE A 603 6.566 3.518 -0.180 1.00 0.00 C ATOM 635 CG2 ILE A 603 4.665 3.667 1.498 1.00 0.00 C ATOM 636 CD1 ILE A 603 7.150 2.270 0.432 1.00 0.00 C ATOM 0 H ILE A 603 4.065 6.135 1.652 1.00 0.00 H new ATOM 0 HA ILE A 603 6.112 6.215 -0.328 1.00 0.00 H new ATOM 0 HB ILE A 603 6.464 4.783 1.565 1.00 0.00 H new ATOM 0 HG12 ILE A 603 5.900 3.226 -0.992 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.376 4.097 -0.624 1.00 0.00 H new ATOM 0 HG21 ILE A 603 5.087 2.818 2.036 1.00 0.00 H new ATOM 0 HG22 ILE A 603 4.163 4.331 2.202 1.00 0.00 H new ATOM 0 HG23 ILE A 603 3.946 3.308 0.762 1.00 0.00 H new ATOM 0 HD11 ILE A 603 7.677 1.701 -0.334 1.00 0.00 H new ATOM 0 HD12 ILE A 603 7.847 2.545 1.223 1.00 0.00 H new ATOM 0 HD13 ILE A 603 6.349 1.661 0.850 1.00 0.00 H new ATOM 643 N VAL A 604 4.976 5.354 -2.364 1.00 0.00 N ATOM 644 CA VAL A 604 4.305 4.991 -3.571 1.00 0.00 C ATOM 645 C VAL A 604 5.077 3.918 -4.295 1.00 0.00 C ATOM 646 O VAL A 604 6.152 4.172 -4.850 1.00 0.00 O ATOM 647 CB VAL A 604 4.102 6.218 -4.487 1.00 0.00 C ATOM 648 CG1 VAL A 604 3.444 5.831 -5.801 1.00 0.00 C ATOM 649 CG2 VAL A 604 3.279 7.272 -3.777 1.00 0.00 C ATOM 0 H VAL A 604 5.915 5.729 -2.499 1.00 0.00 H new ATOM 0 HA VAL A 604 3.322 4.602 -3.307 1.00 0.00 H new ATOM 0 HB VAL A 604 5.085 6.629 -4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 604 3.317 6.719 -6.420 1.00 0.00 H new ATOM 0 HG12 VAL A 604 4.073 5.111 -6.325 1.00 0.00 H new ATOM 0 HG13 VAL A 604 2.470 5.385 -5.602 1.00 0.00 H new ATOM 0 HG21 VAL A 604 3.144 8.131 -4.434 1.00 0.00 H new ATOM 0 HG22 VAL A 604 2.305 6.858 -3.515 1.00 0.00 H new ATOM 0 HG23 VAL A 604 3.795 7.587 -2.870 1.00 0.00 H new ATOM 653 N GLY A 605 4.573 2.721 -4.224 1.00 0.00 N ATOM 654 CA GLY A 605 5.165 1.629 -4.929 1.00 0.00 C ATOM 655 C GLY A 605 5.287 0.411 -4.063 1.00 0.00 C ATOM 656 O GLY A 605 4.684 0.364 -2.986 1.00 0.00 O ATOM 0 H GLY A 605 3.746 2.478 -3.679 1.00 0.00 H new ATOM 0 HA2 GLY A 605 4.563 1.393 -5.806 1.00 0.00 H new ATOM 0 HA3 GLY A 605 6.152 1.920 -5.289 1.00 0.00 H new ATOM 660 N PRO A 606 6.028 -0.603 -4.525 1.00 0.00 N ATOM 661 CA PRO A 606 6.302 -1.827 -3.754 1.00 0.00 C ATOM 662 C PRO A 606 7.069 -1.491 -2.482 1.00 0.00 C ATOM 663 O PRO A 606 8.191 -0.997 -2.540 1.00 0.00 O ATOM 664 CB PRO A 606 7.202 -2.640 -4.703 1.00 0.00 C ATOM 665 CG PRO A 606 7.753 -1.625 -5.647 1.00 0.00 C ATOM 666 CD PRO A 606 6.659 -0.649 -5.853 1.00 0.00 C ATOM 0 HA PRO A 606 5.397 -2.353 -3.448 1.00 0.00 H new ATOM 0 HB2 PRO A 606 7.997 -3.150 -4.158 1.00 0.00 H new ATOM 0 HB3 PRO A 606 6.634 -3.407 -5.230 1.00 0.00 H new ATOM 0 HG2 PRO A 606 8.638 -1.142 -5.233 1.00 0.00 H new ATOM 0 HG3 PRO A 606 8.052 -2.085 -6.589 1.00 0.00 H new ATOM 0 HD2 PRO A 606 7.036 0.327 -6.158 1.00 0.00 H new ATOM 0 HD3 PRO A 606 5.961 -0.976 -6.624 1.00 0.00 H new ATOM 674 N ASN A 607 6.480 -1.742 -1.345 1.00 0.00 N ATOM 675 CA ASN A 607 7.110 -1.348 -0.116 1.00 0.00 C ATOM 676 C ASN A 607 8.148 -2.327 0.339 1.00 0.00 C ATOM 677 O ASN A 607 9.226 -1.937 0.715 1.00 0.00 O ATOM 678 CB ASN A 607 6.121 -1.013 1.003 1.00 0.00 C ATOM 679 CG ASN A 607 5.381 -2.174 1.598 1.00 0.00 C ATOM 680 OD1 ASN A 607 5.075 -3.175 0.939 1.00 0.00 O ATOM 681 ND2 ASN A 607 5.102 -2.057 2.854 1.00 0.00 N ATOM 0 H ASN A 607 5.579 -2.210 -1.244 1.00 0.00 H new ATOM 0 HA ASN A 607 7.625 -0.416 -0.351 1.00 0.00 H new ATOM 0 HB2 ASN A 607 6.664 -0.507 1.801 1.00 0.00 H new ATOM 0 HB3 ASN A 607 5.391 -0.303 0.615 1.00 0.00 H new ATOM 0 HD21 ASN A 607 4.611 -2.808 3.339 1.00 0.00 H new ATOM 0 HD22 ASN A 607 5.373 -1.214 3.360 1.00 0.00 H new ATOM 688 N SER A 608 7.870 -3.584 0.269 1.00 0.00 N ATOM 689 CA SER A 608 8.810 -4.528 0.751 1.00 0.00 C ATOM 690 C SER A 608 9.421 -5.356 -0.358 1.00 0.00 C ATOM 691 O SER A 608 8.900 -6.414 -0.720 1.00 0.00 O ATOM 692 CB SER A 608 8.233 -5.366 1.921 1.00 0.00 C ATOM 693 OG SER A 608 9.039 -6.484 2.245 1.00 0.00 O ATOM 0 H SER A 608 7.009 -3.976 -0.113 1.00 0.00 H new ATOM 0 HA SER A 608 9.646 -3.970 1.173 1.00 0.00 H new ATOM 0 HB2 SER A 608 8.130 -4.731 2.801 1.00 0.00 H new ATOM 0 HB3 SER A 608 7.233 -5.709 1.657 1.00 0.00 H new ATOM 0 HG SER A 608 8.632 -6.976 2.988 1.00 0.00 H new ATOM 699 N VAL A 609 10.517 -4.869 -0.905 1.00 0.00 N ATOM 700 CA VAL A 609 11.221 -5.585 -1.954 1.00 0.00 C ATOM 701 C VAL A 609 12.075 -6.668 -1.327 1.00 0.00 C ATOM 702 O VAL A 609 12.289 -6.684 -0.106 1.00 0.00 O ATOM 703 CB VAL A 609 12.130 -4.663 -2.825 1.00 0.00 C ATOM 704 CG1 VAL A 609 11.339 -3.508 -3.425 1.00 0.00 C ATOM 705 CG2 VAL A 609 13.336 -4.156 -2.044 1.00 0.00 C ATOM 0 H VAL A 609 10.941 -3.980 -0.641 1.00 0.00 H new ATOM 0 HA VAL A 609 10.464 -6.007 -2.615 1.00 0.00 H new ATOM 0 HB VAL A 609 12.507 -5.271 -3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 609 12.003 -2.886 -4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 609 10.542 -3.902 -4.055 1.00 0.00 H new ATOM 0 HG13 VAL A 609 10.906 -2.909 -2.624 1.00 0.00 H new ATOM 0 HG21 VAL A 609 13.943 -3.518 -2.686 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.996 -3.584 -1.181 1.00 0.00 H new ATOM 0 HG23 VAL A 609 13.933 -5.003 -1.706 1.00 0.00 H new ATOM 709 N GLN A 610 12.542 -7.571 -2.131 1.00 0.00 N ATOM 710 CA GLN A 610 13.408 -8.619 -1.662 1.00 0.00 C ATOM 711 C GLN A 610 14.778 -8.403 -2.181 1.00 0.00 C ATOM 712 O GLN A 610 14.985 -7.736 -3.194 1.00 0.00 O ATOM 713 CB GLN A 610 12.970 -10.036 -2.109 1.00 0.00 C ATOM 714 CG GLN A 610 12.109 -10.839 -1.143 1.00 0.00 C ATOM 715 CD GLN A 610 10.614 -10.488 -1.104 1.00 0.00 C ATOM 716 OE1 GLN A 610 9.786 -11.347 -0.811 1.00 0.00 O ATOM 717 NE2 GLN A 610 10.262 -9.275 -1.374 1.00 0.00 N ATOM 0 H GLN A 610 12.337 -7.607 -3.130 1.00 0.00 H new ATOM 0 HA GLN A 610 13.363 -8.574 -0.574 1.00 0.00 H new ATOM 0 HB2 GLN A 610 12.424 -9.940 -3.047 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.869 -10.615 -2.321 1.00 0.00 H new ATOM 0 HG2 GLN A 610 12.205 -11.895 -1.397 1.00 0.00 H new ATOM 0 HG3 GLN A 610 12.515 -10.714 -0.139 1.00 0.00 H new ATOM 0 HE21 GLN A 610 10.969 -8.580 -1.614 1.00 0.00 H new ATOM 0 HE22 GLN A 610 9.277 -9.012 -1.347 1.00 0.00 H new ATOM 726 N CYS A 611 15.699 -8.913 -1.479 1.00 0.00 N ATOM 727 CA CYS A 611 17.015 -9.005 -1.986 1.00 0.00 C ATOM 728 C CYS A 611 17.127 -10.300 -2.783 1.00 0.00 C ATOM 729 O CYS A 611 16.655 -11.357 -2.338 1.00 0.00 O ATOM 730 CB CYS A 611 18.054 -8.940 -0.872 1.00 0.00 C ATOM 731 SG CYS A 611 19.556 -9.877 -1.236 1.00 0.00 S ATOM 0 H CYS A 611 15.573 -9.281 -0.536 1.00 0.00 H new ATOM 0 HA CYS A 611 17.217 -8.154 -2.636 1.00 0.00 H new ATOM 0 HB2 CYS A 611 18.319 -7.898 -0.693 1.00 0.00 H new ATOM 0 HB3 CYS A 611 17.612 -9.319 0.049 1.00 0.00 H new ATOM 736 N TYR A 612 17.659 -10.205 -3.958 1.00 0.00 N ATOM 737 CA TYR A 612 17.883 -11.332 -4.818 1.00 0.00 C ATOM 738 C TYR A 612 19.376 -11.451 -5.047 1.00 0.00 C ATOM 739 O TYR A 612 20.105 -10.557 -4.700 1.00 0.00 O ATOM 740 CB TYR A 612 17.181 -11.120 -6.154 1.00 0.00 C ATOM 741 CG TYR A 612 15.667 -11.189 -6.085 1.00 0.00 C ATOM 742 CD1 TYR A 612 14.906 -10.065 -5.805 1.00 0.00 C ATOM 743 CD2 TYR A 612 15.006 -12.388 -6.298 1.00 0.00 C ATOM 744 CE1 TYR A 612 13.527 -10.134 -5.740 1.00 0.00 C ATOM 745 CE2 TYR A 612 13.631 -12.466 -6.233 1.00 0.00 C ATOM 746 CZ TYR A 612 12.895 -11.335 -5.953 1.00 0.00 C ATOM 747 OH TYR A 612 11.518 -11.414 -5.876 1.00 0.00 O ATOM 0 H TYR A 612 17.960 -9.318 -4.362 1.00 0.00 H new ATOM 0 HA TYR A 612 17.488 -12.238 -4.359 1.00 0.00 H new ATOM 0 HB2 TYR A 612 17.470 -10.147 -6.552 1.00 0.00 H new ATOM 0 HB3 TYR A 612 17.535 -11.872 -6.860 1.00 0.00 H new ATOM 0 HD1 TYR A 612 15.399 -9.119 -5.635 1.00 0.00 H new ATOM 0 HD2 TYR A 612 15.578 -13.277 -6.519 1.00 0.00 H new ATOM 0 HE1 TYR A 612 12.949 -9.248 -5.523 1.00 0.00 H new ATOM 0 HE2 TYR A 612 13.133 -13.409 -6.401 1.00 0.00 H new ATOM 0 HH TYR A 612 11.233 -12.335 -6.054 1.00 0.00 H new ATOM 757 N HIS A 613 19.836 -12.493 -5.708 1.00 0.00 N ATOM 758 CA HIS A 613 21.293 -12.674 -5.875 1.00 0.00 C ATOM 759 C HIS A 613 21.911 -11.685 -6.866 1.00 0.00 C ATOM 760 O HIS A 613 23.114 -11.667 -7.063 1.00 0.00 O ATOM 761 CB HIS A 613 21.701 -14.132 -6.202 1.00 0.00 C ATOM 762 CG HIS A 613 21.137 -14.730 -7.465 1.00 0.00 C ATOM 763 ND1 HIS A 613 20.674 -16.015 -7.526 1.00 0.00 N ATOM 764 CD2 HIS A 613 21.029 -14.245 -8.719 1.00 0.00 C ATOM 765 CE1 HIS A 613 20.313 -16.294 -8.750 1.00 0.00 C ATOM 766 NE2 HIS A 613 20.519 -15.239 -9.500 1.00 0.00 N ATOM 0 H HIS A 613 19.256 -13.217 -6.133 1.00 0.00 H new ATOM 0 HA HIS A 613 21.712 -12.447 -4.895 1.00 0.00 H new ATOM 0 HB2 HIS A 613 22.788 -14.175 -6.262 1.00 0.00 H new ATOM 0 HB3 HIS A 613 21.403 -14.764 -5.365 1.00 0.00 H new ATOM 0 HD2 HIS A 613 21.298 -13.251 -9.045 1.00 0.00 H new ATOM 0 HE1 HIS A 613 19.911 -17.238 -9.088 1.00 0.00 H new ATOM 0 HE2 HIS A 613 20.330 -15.173 -10.500 1.00 0.00 H new ATOM 775 N PHE A 614 21.074 -10.897 -7.498 1.00 0.00 N ATOM 776 CA PHE A 614 21.527 -9.872 -8.409 1.00 0.00 C ATOM 777 C PHE A 614 21.334 -8.491 -7.794 1.00 0.00 C ATOM 778 O PHE A 614 21.727 -7.462 -8.373 1.00 0.00 O ATOM 779 CB PHE A 614 20.828 -9.983 -9.770 1.00 0.00 C ATOM 780 CG PHE A 614 19.334 -9.995 -9.703 1.00 0.00 C ATOM 781 CD1 PHE A 614 18.620 -8.818 -9.613 1.00 0.00 C ATOM 782 CD2 PHE A 614 18.648 -11.187 -9.742 1.00 0.00 C ATOM 783 CE1 PHE A 614 17.252 -8.828 -9.561 1.00 0.00 C ATOM 784 CE2 PHE A 614 17.277 -11.208 -9.689 1.00 0.00 C ATOM 785 CZ PHE A 614 16.573 -10.027 -9.599 1.00 0.00 C ATOM 0 H PHE A 614 20.060 -10.948 -7.396 1.00 0.00 H new ATOM 0 HA PHE A 614 22.593 -10.020 -8.584 1.00 0.00 H new ATOM 0 HB2 PHE A 614 21.144 -9.148 -10.395 1.00 0.00 H new ATOM 0 HB3 PHE A 614 21.164 -10.895 -10.263 1.00 0.00 H new ATOM 0 HD1 PHE A 614 19.147 -7.876 -9.583 1.00 0.00 H new ATOM 0 HD2 PHE A 614 19.194 -12.116 -9.815 1.00 0.00 H new ATOM 0 HE1 PHE A 614 16.706 -7.899 -9.490 1.00 0.00 H new ATOM 0 HE2 PHE A 614 16.750 -12.150 -9.718 1.00 0.00 H new ATOM 0 HZ PHE A 614 15.494 -10.041 -9.558 1.00 0.00 H new ATOM 795 N GLY A 615 20.756 -8.468 -6.623 1.00 0.00 N ATOM 796 CA GLY A 615 20.494 -7.235 -5.959 1.00 0.00 C ATOM 797 C GLY A 615 19.085 -7.171 -5.492 1.00 0.00 C ATOM 798 O GLY A 615 18.355 -8.156 -5.586 1.00 0.00 O ATOM 0 H GLY A 615 20.459 -9.299 -6.112 1.00 0.00 H new ATOM 0 HA2 GLY A 615 21.168 -7.125 -5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 615 20.695 -6.404 -6.635 1.00 0.00 H new ATOM 802 N LEU A 616 18.682 -6.038 -5.029 1.00 0.00 N ATOM 803 CA LEU A 616 17.358 -5.865 -4.517 1.00 0.00 C ATOM 804 C LEU A 616 16.389 -5.624 -5.649 1.00 0.00 C ATOM 805 O LEU A 616 16.712 -4.930 -6.612 1.00 0.00 O ATOM 806 CB LEU A 616 17.288 -4.732 -3.504 1.00 0.00 C ATOM 807 CG LEU A 616 17.881 -5.003 -2.132 1.00 0.00 C ATOM 808 CD1 LEU A 616 19.364 -5.118 -2.081 1.00 0.00 C ATOM 809 CD2 LEU A 616 17.320 -4.087 -1.121 1.00 0.00 C ATOM 0 H LEU A 616 19.261 -5.199 -4.993 1.00 0.00 H new ATOM 0 HA LEU A 616 17.079 -6.783 -3.999 1.00 0.00 H new ATOM 0 HB2 LEU A 616 17.795 -3.865 -3.928 1.00 0.00 H new ATOM 0 HB3 LEU A 616 16.241 -4.457 -3.374 1.00 0.00 H new ATOM 0 HG LEU A 616 17.565 -6.014 -1.875 1.00 0.00 H new ATOM 0 HD11 LEU A 616 19.679 -5.311 -1.056 1.00 0.00 H new ATOM 0 HD12 LEU A 616 19.687 -5.939 -2.721 1.00 0.00 H new ATOM 0 HD13 LEU A 616 19.813 -4.188 -2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 616 17.762 -4.304 -0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 616 17.543 -3.057 -1.400 1.00 0.00 H new ATOM 0 HD23 LEU A 616 16.240 -4.223 -1.067 1.00 0.00 H new ATOM 821 N SER A 617 15.219 -6.181 -5.531 1.00 0.00 N ATOM 822 CA SER A 617 14.219 -6.107 -6.571 1.00 0.00 C ATOM 823 C SER A 617 12.832 -6.393 -5.961 1.00 0.00 C ATOM 824 O SER A 617 12.739 -7.081 -4.925 1.00 0.00 O ATOM 825 CB SER A 617 14.588 -7.108 -7.694 1.00 0.00 C ATOM 826 OG SER A 617 13.659 -7.135 -8.757 1.00 0.00 O ATOM 0 H SER A 617 14.924 -6.704 -4.707 1.00 0.00 H new ATOM 0 HA SER A 617 14.184 -5.111 -7.012 1.00 0.00 H new ATOM 0 HB2 SER A 617 15.571 -6.852 -8.089 1.00 0.00 H new ATOM 0 HB3 SER A 617 14.667 -8.108 -7.266 1.00 0.00 H new ATOM 0 HG SER A 617 13.951 -7.784 -9.431 1.00 0.00 H new ATOM 832 N PRO A 618 11.735 -5.868 -6.548 1.00 0.00 N ATOM 833 CA PRO A 618 11.767 -5.043 -7.778 1.00 0.00 C ATOM 834 C PRO A 618 12.243 -3.602 -7.532 1.00 0.00 C ATOM 835 O PRO A 618 12.839 -3.301 -6.487 1.00 0.00 O ATOM 836 CB PRO A 618 10.305 -5.048 -8.223 1.00 0.00 C ATOM 837 CG PRO A 618 9.533 -5.177 -6.959 1.00 0.00 C ATOM 838 CD PRO A 618 10.355 -6.051 -6.057 1.00 0.00 C ATOM 0 HA PRO A 618 12.469 -5.439 -8.512 1.00 0.00 H new ATOM 0 HB2 PRO A 618 10.048 -4.131 -8.753 1.00 0.00 H new ATOM 0 HB3 PRO A 618 10.099 -5.877 -8.901 1.00 0.00 H new ATOM 0 HG2 PRO A 618 9.362 -4.201 -6.506 1.00 0.00 H new ATOM 0 HG3 PRO A 618 8.554 -5.619 -7.144 1.00 0.00 H new ATOM 0 HD2 PRO A 618 10.259 -5.751 -5.014 1.00 0.00 H new ATOM 0 HD3 PRO A 618 10.044 -7.094 -6.119 1.00 0.00 H new ATOM 846 N ASP A 619 12.050 -2.751 -8.536 1.00 0.00 N ATOM 847 CA ASP A 619 12.352 -1.305 -8.436 1.00 0.00 C ATOM 848 C ASP A 619 11.738 -0.699 -7.204 1.00 0.00 C ATOM 849 O ASP A 619 10.621 -1.049 -6.809 1.00 0.00 O ATOM 850 CB ASP A 619 11.894 -0.505 -9.659 1.00 0.00 C ATOM 851 CG ASP A 619 12.762 -0.685 -10.871 1.00 0.00 C ATOM 852 OD1 ASP A 619 12.521 -1.614 -11.668 1.00 0.00 O ATOM 853 OD2 ASP A 619 13.696 0.108 -11.061 1.00 0.00 O ATOM 0 H ASP A 619 11.681 -3.032 -9.444 1.00 0.00 H new ATOM 0 HA ASP A 619 13.439 -1.244 -8.380 1.00 0.00 H new ATOM 0 HB2 ASP A 619 10.874 -0.797 -9.909 1.00 0.00 H new ATOM 0 HB3 ASP A 619 11.868 0.553 -9.398 1.00 0.00 H new ATOM 858 N LEU A 620 12.449 0.217 -6.645 1.00 0.00 N ATOM 859 CA LEU A 620 12.116 0.821 -5.383 1.00 0.00 C ATOM 860 C LEU A 620 11.029 1.885 -5.495 1.00 0.00 C ATOM 861 O LEU A 620 10.883 2.554 -6.535 1.00 0.00 O ATOM 862 CB LEU A 620 13.386 1.361 -4.698 1.00 0.00 C ATOM 863 CG LEU A 620 14.353 0.307 -4.101 1.00 0.00 C ATOM 864 CD1 LEU A 620 14.970 -0.604 -5.156 1.00 0.00 C ATOM 865 CD2 LEU A 620 15.432 0.991 -3.311 1.00 0.00 C ATOM 0 H LEU A 620 13.306 0.584 -7.058 1.00 0.00 H new ATOM 0 HA LEU A 620 11.689 0.040 -4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 620 13.938 1.957 -5.425 1.00 0.00 H new ATOM 0 HB3 LEU A 620 13.081 2.036 -3.898 1.00 0.00 H new ATOM 0 HG LEU A 620 13.760 -0.332 -3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 620 15.637 -1.319 -4.674 1.00 0.00 H new ATOM 0 HD12 LEU A 620 14.180 -1.141 -5.680 1.00 0.00 H new ATOM 0 HD13 LEU A 620 15.535 -0.004 -5.869 1.00 0.00 H new ATOM 0 HD21 LEU A 620 16.107 0.244 -2.895 1.00 0.00 H new ATOM 0 HD22 LEU A 620 15.991 1.662 -3.963 1.00 0.00 H new ATOM 0 HD23 LEU A 620 14.982 1.565 -2.501 1.00 0.00 H new ATOM 877 N PRO A 621 10.232 2.017 -4.430 1.00 0.00 N ATOM 878 CA PRO A 621 9.129 2.968 -4.347 1.00 0.00 C ATOM 879 C PRO A 621 9.599 4.429 -4.321 1.00 0.00 C ATOM 880 O PRO A 621 10.795 4.721 -4.153 1.00 0.00 O ATOM 881 CB PRO A 621 8.479 2.632 -3.002 1.00 0.00 C ATOM 882 CG PRO A 621 9.533 1.960 -2.222 1.00 0.00 C ATOM 883 CD PRO A 621 10.346 1.215 -3.204 1.00 0.00 C ATOM 0 HA PRO A 621 8.471 2.885 -5.212 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.129 3.533 -2.498 1.00 0.00 H new ATOM 0 HB3 PRO A 621 7.613 1.984 -3.134 1.00 0.00 H new ATOM 0 HG2 PRO A 621 10.141 2.685 -1.680 1.00 0.00 H new ATOM 0 HG3 PRO A 621 9.102 1.287 -1.480 1.00 0.00 H new ATOM 0 HD2 PRO A 621 11.383 1.125 -2.879 1.00 0.00 H new ATOM 0 HD3 PRO A 621 9.969 0.203 -3.351 1.00 0.00 H new ATOM 891 N ILE A 622 8.668 5.331 -4.481 1.00 0.00 N ATOM 892 CA ILE A 622 8.935 6.762 -4.413 1.00 0.00 C ATOM 893 C ILE A 622 8.174 7.352 -3.229 1.00 0.00 C ATOM 894 O ILE A 622 7.451 6.629 -2.535 1.00 0.00 O ATOM 895 CB ILE A 622 8.489 7.516 -5.696 1.00 0.00 C ATOM 896 CG1 ILE A 622 6.977 7.401 -5.875 1.00 0.00 C ATOM 897 CG2 ILE A 622 9.213 6.975 -6.917 1.00 0.00 C ATOM 898 CD1 ILE A 622 6.400 8.314 -6.934 1.00 0.00 C ATOM 0 H ILE A 622 7.691 5.102 -4.664 1.00 0.00 H new ATOM 0 HA ILE A 622 10.013 6.884 -4.305 1.00 0.00 H new ATOM 0 HB ILE A 622 8.749 8.569 -5.587 1.00 0.00 H new ATOM 0 HG12 ILE A 622 6.731 6.370 -6.129 1.00 0.00 H new ATOM 0 HG13 ILE A 622 6.493 7.619 -4.923 1.00 0.00 H new ATOM 0 HG21 ILE A 622 8.886 7.517 -7.804 1.00 0.00 H new ATOM 0 HG22 ILE A 622 10.288 7.104 -6.789 1.00 0.00 H new ATOM 0 HG23 ILE A 622 8.986 5.915 -7.035 1.00 0.00 H new ATOM 0 HD11 ILE A 622 5.322 8.166 -6.994 1.00 0.00 H new ATOM 0 HD12 ILE A 622 6.610 9.351 -6.674 1.00 0.00 H new ATOM 0 HD13 ILE A 622 6.852 8.083 -7.899 1.00 0.00 H new ATOM 905 N CYS A 623 8.301 8.644 -3.028 1.00 0.00 N ATOM 906 CA CYS A 623 7.634 9.323 -1.944 1.00 0.00 C ATOM 907 C CYS A 623 6.786 10.475 -2.444 1.00 0.00 C ATOM 908 O CYS A 623 7.276 11.370 -3.133 1.00 0.00 O ATOM 909 CB CYS A 623 8.658 9.820 -0.949 1.00 0.00 C ATOM 910 SG CYS A 623 9.573 8.480 -0.153 1.00 0.00 S ATOM 0 H CYS A 623 8.871 9.254 -3.614 1.00 0.00 H new ATOM 0 HA CYS A 623 6.967 8.612 -1.457 1.00 0.00 H new ATOM 0 HB2 CYS A 623 9.360 10.481 -1.457 1.00 0.00 H new ATOM 0 HB3 CYS A 623 8.156 10.414 -0.185 1.00 0.00 H new ATOM 915 N LYS A 624 5.524 10.435 -2.124 1.00 0.00 N ATOM 916 CA LYS A 624 4.591 11.481 -2.462 1.00 0.00 C ATOM 917 C LYS A 624 4.079 12.108 -1.211 1.00 0.00 C ATOM 918 O LYS A 624 3.547 11.434 -0.368 1.00 0.00 O ATOM 919 CB LYS A 624 3.424 10.920 -3.251 1.00 0.00 C ATOM 920 CG LYS A 624 3.777 10.584 -4.684 1.00 0.00 C ATOM 921 CD LYS A 624 3.714 11.810 -5.564 1.00 0.00 C ATOM 922 CE LYS A 624 2.261 12.223 -5.812 1.00 0.00 C ATOM 923 NZ LYS A 624 1.537 11.243 -6.662 1.00 0.00 N ATOM 0 H LYS A 624 5.103 9.661 -1.611 1.00 0.00 H new ATOM 0 HA LYS A 624 5.105 12.224 -3.072 1.00 0.00 H new ATOM 0 HB2 LYS A 624 3.057 10.022 -2.754 1.00 0.00 H new ATOM 0 HB3 LYS A 624 2.609 11.644 -3.245 1.00 0.00 H new ATOM 0 HG2 LYS A 624 4.779 10.156 -4.724 1.00 0.00 H new ATOM 0 HG3 LYS A 624 3.091 9.826 -5.062 1.00 0.00 H new ATOM 0 HD2 LYS A 624 4.255 12.630 -5.093 1.00 0.00 H new ATOM 0 HD3 LYS A 624 4.207 11.607 -6.515 1.00 0.00 H new ATOM 0 HE2 LYS A 624 1.746 12.324 -4.857 1.00 0.00 H new ATOM 0 HE3 LYS A 624 2.240 13.202 -6.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 0.633 11.653 -6.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 2.116 11.012 -7.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 1.355 10.377 -6.115 1.00 0.00 H new ATOM 937 N GLU A 625 4.261 13.368 -1.069 1.00 0.00 N ATOM 938 CA GLU A 625 3.740 14.056 0.074 1.00 0.00 C ATOM 939 C GLU A 625 2.350 14.490 -0.304 1.00 0.00 C ATOM 940 O GLU A 625 1.393 14.373 0.464 1.00 0.00 O ATOM 941 CB GLU A 625 4.635 15.245 0.410 1.00 0.00 C ATOM 942 CG GLU A 625 4.409 15.846 1.790 1.00 0.00 C ATOM 943 CD GLU A 625 3.172 16.700 1.902 1.00 0.00 C ATOM 944 OE1 GLU A 625 3.201 17.852 1.436 1.00 0.00 O ATOM 945 OE2 GLU A 625 2.169 16.258 2.489 1.00 0.00 O ATOM 0 H GLU A 625 4.769 13.956 -1.730 1.00 0.00 H new ATOM 0 HA GLU A 625 3.712 13.426 0.963 1.00 0.00 H new ATOM 0 HB2 GLU A 625 5.676 14.931 0.332 1.00 0.00 H new ATOM 0 HB3 GLU A 625 4.479 16.022 -0.339 1.00 0.00 H new ATOM 0 HG2 GLU A 625 4.345 15.038 2.519 1.00 0.00 H new ATOM 0 HG3 GLU A 625 5.277 16.448 2.057 1.00 0.00 H new ATOM 952 N GLN A 626 2.226 14.859 -1.548 1.00 0.00 N ATOM 953 CA GLN A 626 0.989 15.335 -2.077 1.00 0.00 C ATOM 954 C GLN A 626 0.278 14.155 -2.675 1.00 0.00 C ATOM 955 O GLN A 626 0.364 13.898 -3.875 1.00 0.00 O ATOM 956 CB GLN A 626 1.216 16.393 -3.153 1.00 0.00 C ATOM 957 CG GLN A 626 2.161 17.507 -2.756 1.00 0.00 C ATOM 958 CD GLN A 626 2.345 18.501 -3.871 1.00 0.00 C ATOM 959 OE1 GLN A 626 3.217 18.336 -4.726 1.00 0.00 O ATOM 960 NE2 GLN A 626 1.560 19.540 -3.867 1.00 0.00 N ATOM 0 H GLN A 626 2.989 14.836 -2.224 1.00 0.00 H new ATOM 0 HA GLN A 626 0.402 15.796 -1.283 1.00 0.00 H new ATOM 0 HB2 GLN A 626 1.606 15.905 -4.046 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.254 16.830 -3.423 1.00 0.00 H new ATOM 0 HG2 GLN A 626 1.773 18.017 -1.874 1.00 0.00 H new ATOM 0 HG3 GLN A 626 3.127 17.084 -2.481 1.00 0.00 H new ATOM 0 HE21 GLN A 626 0.850 19.640 -3.141 1.00 0.00 H new ATOM 0 HE22 GLN A 626 1.655 20.254 -4.589 1.00 0.00 H new ATOM 969 N VAL A 627 -0.318 13.379 -1.833 1.00 0.00 N ATOM 970 CA VAL A 627 -1.016 12.215 -2.274 1.00 0.00 C ATOM 971 C VAL A 627 -2.464 12.592 -2.616 1.00 0.00 C ATOM 972 O VAL A 627 -2.997 13.598 -2.093 1.00 0.00 O ATOM 973 CB VAL A 627 -0.946 11.066 -1.217 1.00 0.00 C ATOM 974 CG1 VAL A 627 -1.680 11.395 0.051 1.00 0.00 C ATOM 975 CG2 VAL A 627 -1.403 9.769 -1.808 1.00 0.00 C ATOM 0 H VAL A 627 -0.336 13.531 -0.825 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.533 11.831 -3.173 1.00 0.00 H new ATOM 0 HB VAL A 627 0.101 10.956 -0.934 1.00 0.00 H new ATOM 0 HG11 VAL A 627 -1.596 10.560 0.747 1.00 0.00 H new ATOM 0 HG12 VAL A 627 -1.246 12.288 0.501 1.00 0.00 H new ATOM 0 HG13 VAL A 627 -2.731 11.576 -0.174 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -1.345 8.985 -1.053 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -2.433 9.868 -2.150 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -0.764 9.508 -2.652 1.00 0.00 H new ATOM 979 N GLN A 628 -3.083 11.823 -3.479 1.00 0.00 N ATOM 980 CA GLN A 628 -4.427 12.086 -3.904 1.00 0.00 C ATOM 981 C GLN A 628 -5.379 11.485 -2.909 1.00 0.00 C ATOM 982 O GLN A 628 -4.979 10.694 -2.040 1.00 0.00 O ATOM 983 CB GLN A 628 -4.677 11.509 -5.296 1.00 0.00 C ATOM 984 CG GLN A 628 -3.773 12.082 -6.368 1.00 0.00 C ATOM 985 CD GLN A 628 -4.026 11.476 -7.729 1.00 0.00 C ATOM 986 OE1 GLN A 628 -5.153 11.079 -8.066 1.00 0.00 O ATOM 987 NE2 GLN A 628 -2.997 11.380 -8.514 1.00 0.00 N ATOM 0 H GLN A 628 -2.663 10.996 -3.904 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.584 13.163 -3.957 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -4.542 10.428 -5.260 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -5.715 11.692 -5.574 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -3.919 13.161 -6.422 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -2.733 11.915 -6.088 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -2.086 11.717 -8.204 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -3.100 10.968 -9.441 1.00 0.00 H new ATOM 996 N SER A 629 -6.609 11.846 -3.011 1.00 0.00 N ATOM 997 CA SER A 629 -7.589 11.367 -2.103 1.00 0.00 C ATOM 998 C SER A 629 -8.512 10.373 -2.778 1.00 0.00 C ATOM 999 O SER A 629 -9.339 9.728 -2.103 1.00 0.00 O ATOM 1000 CB SER A 629 -8.376 12.538 -1.550 1.00 0.00 C ATOM 1001 OG SER A 629 -7.503 13.495 -0.977 1.00 0.00 O ATOM 0 H SER A 629 -6.964 12.481 -3.726 1.00 0.00 H new ATOM 0 HA SER A 629 -7.090 10.850 -1.283 1.00 0.00 H new ATOM 0 HB2 SER A 629 -8.960 13.000 -2.346 1.00 0.00 H new ATOM 0 HB3 SER A 629 -9.083 12.186 -0.799 1.00 0.00 H new ATOM 0 HG SER A 629 -8.026 14.246 -0.626 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.377 10.263 -4.110 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.198 9.391 -4.955 1.00 0.00 C ATOM 1009 C CYS A 630 -10.641 9.896 -5.066 1.00 0.00 C ATOM 1010 O CYS A 630 -11.138 10.146 -6.160 1.00 0.00 O ATOM 1011 CB CYS A 630 -9.140 7.921 -4.501 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.541 7.077 -4.805 1.00 0.00 S ATOM 0 H CYS A 630 -7.680 10.789 -4.636 1.00 0.00 H new ATOM 0 HA CYS A 630 -8.768 9.429 -5.956 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -9.359 7.877 -3.434 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -9.928 7.368 -5.011 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.274 10.079 -3.945 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.625 10.523 -3.904 1.00 0.00 C ATOM 1019 C GLY A 631 -13.492 9.396 -3.457 1.00 0.00 C ATOM 1020 O GLY A 631 -13.059 8.613 -2.614 1.00 0.00 O ATOM 0 H GLY A 631 -10.858 9.921 -3.027 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -12.723 11.367 -3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -12.937 10.871 -4.889 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.704 9.264 -3.984 1.00 0.00 N ATOM 1025 CA PRO A 632 -15.575 8.159 -3.626 1.00 0.00 C ATOM 1026 C PRO A 632 -15.015 6.814 -4.131 1.00 0.00 C ATOM 1027 O PRO A 632 -14.581 6.701 -5.285 1.00 0.00 O ATOM 1028 CB PRO A 632 -16.903 8.495 -4.310 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.543 9.424 -5.419 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.324 10.175 -4.963 1.00 0.00 C ATOM 0 HA PRO A 632 -15.676 8.045 -2.547 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -17.389 7.597 -4.690 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -17.598 8.963 -3.613 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.339 8.873 -6.337 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.363 10.109 -5.634 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -14.651 10.390 -5.793 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.588 11.131 -4.511 1.00 0.00 H new ATOM 1038 N PRO A 633 -14.996 5.802 -3.264 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.473 4.466 -3.587 1.00 0.00 C ATOM 1040 C PRO A 633 -15.353 3.711 -4.586 1.00 0.00 C ATOM 1041 O PRO A 633 -16.504 4.097 -4.832 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.520 3.752 -2.234 1.00 0.00 C ATOM 1043 CG PRO A 633 -15.592 4.444 -1.488 1.00 0.00 C ATOM 1044 CD PRO A 633 -15.486 5.872 -1.882 1.00 0.00 C ATOM 0 HA PRO A 633 -13.487 4.519 -4.049 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.740 2.691 -2.352 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.565 3.823 -1.714 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -16.572 4.038 -1.740 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -15.464 4.322 -0.412 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -16.449 6.379 -1.821 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -14.797 6.418 -1.237 1.00 0.00 H new ATOM 1052 N PRO A 634 -14.823 2.634 -5.179 1.00 0.00 N ATOM 1053 CA PRO A 634 -15.582 1.778 -6.090 1.00 0.00 C ATOM 1054 C PRO A 634 -16.686 1.007 -5.344 1.00 0.00 C ATOM 1055 O PRO A 634 -16.844 1.137 -4.107 1.00 0.00 O ATOM 1056 CB PRO A 634 -14.521 0.796 -6.618 1.00 0.00 C ATOM 1057 CG PRO A 634 -13.452 0.790 -5.590 1.00 0.00 C ATOM 1058 CD PRO A 634 -13.425 2.169 -5.021 1.00 0.00 C ATOM 0 HA PRO A 634 -16.085 2.345 -6.873 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -14.941 -0.201 -6.756 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -14.135 1.116 -7.586 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -13.659 0.052 -4.815 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -12.489 0.530 -6.029 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.119 2.166 -3.975 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -12.725 2.811 -5.556 1.00 0.00 H new ATOM 1066 N GLU A 635 -17.457 0.245 -6.068 1.00 0.00 N ATOM 1067 CA GLU A 635 -18.475 -0.571 -5.454 1.00 0.00 C ATOM 1068 C GLU A 635 -17.905 -1.964 -5.239 1.00 0.00 C ATOM 1069 O GLU A 635 -16.870 -2.310 -5.811 1.00 0.00 O ATOM 1070 CB GLU A 635 -19.739 -0.646 -6.332 1.00 0.00 C ATOM 1071 CG GLU A 635 -19.551 -1.403 -7.641 1.00 0.00 C ATOM 1072 CD GLU A 635 -20.777 -1.391 -8.512 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -21.729 -2.149 -8.251 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -20.799 -0.634 -9.500 1.00 0.00 O ATOM 0 H GLU A 635 -17.403 0.170 -7.084 1.00 0.00 H new ATOM 0 HA GLU A 635 -18.765 -0.126 -4.502 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -20.535 -1.123 -5.761 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -20.071 0.367 -6.557 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -18.718 -0.965 -8.191 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -19.279 -2.435 -7.421 1.00 0.00 H new ATOM 1081 N LEU A 636 -18.561 -2.746 -4.440 1.00 0.00 N ATOM 1082 CA LEU A 636 -18.151 -4.106 -4.212 1.00 0.00 C ATOM 1083 C LEU A 636 -18.908 -4.939 -5.251 1.00 0.00 C ATOM 1084 O LEU A 636 -19.914 -4.460 -5.772 1.00 0.00 O ATOM 1085 CB LEU A 636 -18.552 -4.510 -2.776 1.00 0.00 C ATOM 1086 CG LEU A 636 -18.040 -5.846 -2.240 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.549 -5.954 -2.439 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -18.326 -5.917 -0.771 1.00 0.00 C ATOM 0 H LEU A 636 -19.396 -2.465 -3.925 1.00 0.00 H new ATOM 0 HA LEU A 636 -17.075 -4.251 -4.308 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -18.211 -3.726 -2.100 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -19.641 -4.524 -2.724 1.00 0.00 H new ATOM 0 HG LEU A 636 -18.536 -6.656 -2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -16.199 -6.911 -2.052 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.318 -5.886 -3.502 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -16.051 -5.143 -1.907 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -17.965 -6.867 -0.376 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -17.821 -5.096 -0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -19.401 -5.840 -0.605 1.00 0.00 H new ATOM 1100 N LEU A 637 -18.409 -6.117 -5.607 1.00 0.00 N ATOM 1101 CA LEU A 637 -19.090 -6.973 -6.590 1.00 0.00 C ATOM 1102 C LEU A 637 -20.545 -7.231 -6.228 1.00 0.00 C ATOM 1103 O LEU A 637 -21.458 -6.796 -6.928 1.00 0.00 O ATOM 1104 CB LEU A 637 -18.349 -8.322 -6.889 1.00 0.00 C ATOM 1105 CG LEU A 637 -18.133 -9.342 -5.744 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -17.582 -10.643 -6.300 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -17.192 -8.817 -4.682 1.00 0.00 C ATOM 0 H LEU A 637 -17.542 -6.505 -5.237 1.00 0.00 H new ATOM 0 HA LEU A 637 -19.063 -6.395 -7.514 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -18.901 -8.830 -7.679 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -17.368 -8.073 -7.295 1.00 0.00 H new ATOM 0 HG LEU A 637 -19.104 -9.513 -5.280 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -17.434 -11.353 -5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -18.287 -11.058 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -16.629 -10.453 -6.794 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -17.071 -9.567 -3.900 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -16.222 -8.600 -5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -17.604 -7.905 -4.250 1.00 0.00 H new ATOM 1119 N ASN A 638 -20.763 -7.897 -5.132 1.00 0.00 N ATOM 1120 CA ASN A 638 -22.113 -8.244 -4.743 1.00 0.00 C ATOM 1121 C ASN A 638 -22.546 -7.420 -3.554 1.00 0.00 C ATOM 1122 O ASN A 638 -23.738 -7.213 -3.324 1.00 0.00 O ATOM 1123 CB ASN A 638 -22.176 -9.724 -4.403 1.00 0.00 C ATOM 1124 CG ASN A 638 -23.359 -10.412 -5.035 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -24.433 -10.523 -4.438 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -23.175 -10.871 -6.241 1.00 0.00 N ATOM 0 H ASN A 638 -20.035 -8.212 -4.491 1.00 0.00 H new ATOM 0 HA ASN A 638 -22.788 -8.034 -5.572 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -21.258 -10.209 -4.735 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -22.226 -9.843 -3.321 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -23.936 -11.344 -6.728 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -22.270 -10.757 -6.697 1.00 0.00 H new ATOM 1133 N GLY A 639 -21.568 -6.953 -2.808 1.00 0.00 N ATOM 1134 CA GLY A 639 -21.820 -6.191 -1.614 1.00 0.00 C ATOM 1135 C GLY A 639 -21.796 -4.708 -1.883 1.00 0.00 C ATOM 1136 O GLY A 639 -22.000 -4.272 -3.008 1.00 0.00 O ATOM 0 H GLY A 639 -20.579 -7.093 -3.016 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -22.790 -6.470 -1.202 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -21.071 -6.436 -0.861 1.00 0.00 H new ATOM 1140 N ASN A 640 -21.464 -3.940 -0.879 1.00 0.00 N ATOM 1141 CA ASN A 640 -21.412 -2.505 -1.022 1.00 0.00 C ATOM 1142 C ASN A 640 -20.446 -1.947 0.002 1.00 0.00 C ATOM 1143 O ASN A 640 -19.679 -2.691 0.598 1.00 0.00 O ATOM 1144 CB ASN A 640 -22.783 -1.905 -0.777 1.00 0.00 C ATOM 1145 CG ASN A 640 -23.136 -0.763 -1.739 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -24.298 -0.537 -2.028 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -22.142 -0.056 -2.256 1.00 0.00 N ATOM 0 H ASN A 640 -21.224 -4.284 0.051 1.00 0.00 H new ATOM 0 HA ASN A 640 -21.086 -2.257 -2.032 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -23.535 -2.689 -0.866 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -22.830 -1.534 0.247 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -22.341 0.698 -2.913 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -21.178 -0.266 -1.997 1.00 0.00 H new ATOM 1154 N VAL A 641 -20.503 -0.659 0.219 1.00 0.00 N ATOM 1155 CA VAL A 641 -19.656 0.011 1.164 1.00 0.00 C ATOM 1156 C VAL A 641 -20.507 0.340 2.403 1.00 0.00 C ATOM 1157 O VAL A 641 -21.660 0.739 2.265 1.00 0.00 O ATOM 1158 CB VAL A 641 -19.040 1.299 0.523 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -20.117 2.235 0.036 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -18.077 2.002 1.470 1.00 0.00 C ATOM 0 H VAL A 641 -21.151 -0.038 -0.265 1.00 0.00 H new ATOM 0 HA VAL A 641 -18.820 -0.624 1.457 1.00 0.00 H new ATOM 0 HB VAL A 641 -18.459 0.982 -0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -19.658 3.120 -0.404 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -20.725 1.731 -0.715 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -20.747 2.532 0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -17.673 2.890 0.985 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -18.606 2.293 2.377 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -17.261 1.326 1.727 1.00 0.00 H new ATOM 1164 N LYS A 642 -19.978 0.115 3.583 1.00 0.00 N ATOM 1165 CA LYS A 642 -20.747 0.366 4.805 1.00 0.00 C ATOM 1166 C LYS A 642 -20.464 1.737 5.357 1.00 0.00 C ATOM 1167 O LYS A 642 -21.253 2.287 6.123 1.00 0.00 O ATOM 1168 CB LYS A 642 -20.482 -0.696 5.874 1.00 0.00 C ATOM 1169 CG LYS A 642 -19.015 -0.932 6.159 1.00 0.00 C ATOM 1170 CD LYS A 642 -18.816 -1.873 7.329 1.00 0.00 C ATOM 1171 CE LYS A 642 -19.152 -1.206 8.657 1.00 0.00 C ATOM 1172 NZ LYS A 642 -18.091 -0.300 9.132 1.00 0.00 N ATOM 0 H LYS A 642 -19.033 -0.236 3.735 1.00 0.00 H new ATOM 0 HA LYS A 642 -21.800 0.312 4.530 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -20.977 -0.398 6.798 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -20.936 -1.635 5.558 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -18.534 -1.346 5.273 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -18.528 0.020 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -19.443 -2.755 7.197 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -17.782 -2.217 7.347 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -20.080 -0.645 8.551 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -19.329 -1.975 9.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -18.230 -0.103 10.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -17.163 -0.748 8.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -18.131 0.591 8.597 1.00 0.00 H new ATOM 1186 N GLU A 643 -19.350 2.278 4.975 1.00 0.00 N ATOM 1187 CA GLU A 643 -18.964 3.579 5.421 1.00 0.00 C ATOM 1188 C GLU A 643 -19.669 4.626 4.572 1.00 0.00 C ATOM 1189 O GLU A 643 -20.066 4.331 3.428 1.00 0.00 O ATOM 1190 CB GLU A 643 -17.459 3.744 5.288 1.00 0.00 C ATOM 1191 CG GLU A 643 -16.663 2.774 6.119 1.00 0.00 C ATOM 1192 CD GLU A 643 -16.909 2.902 7.596 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -16.319 3.794 8.237 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -17.670 2.098 8.151 1.00 0.00 O ATOM 0 H GLU A 643 -18.683 1.831 4.346 1.00 0.00 H new ATOM 0 HA GLU A 643 -19.244 3.703 6.467 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -17.181 3.623 4.241 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -17.188 4.760 5.574 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -16.904 1.758 5.806 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -15.602 2.925 5.922 1.00 0.00 H new ATOM 1201 N LYS A 644 -19.859 5.808 5.114 1.00 0.00 N ATOM 1202 CA LYS A 644 -20.445 6.894 4.356 1.00 0.00 C ATOM 1203 C LYS A 644 -19.460 7.361 3.311 1.00 0.00 C ATOM 1204 O LYS A 644 -18.400 7.902 3.651 1.00 0.00 O ATOM 1205 CB LYS A 644 -20.820 8.074 5.256 1.00 0.00 C ATOM 1206 CG LYS A 644 -21.350 9.279 4.478 1.00 0.00 C ATOM 1207 CD LYS A 644 -21.640 10.466 5.390 1.00 0.00 C ATOM 1208 CE LYS A 644 -20.368 11.001 6.026 1.00 0.00 C ATOM 1209 NZ LYS A 644 -20.634 12.121 6.951 1.00 0.00 N ATOM 0 H LYS A 644 -19.617 6.043 6.077 1.00 0.00 H new ATOM 0 HA LYS A 644 -21.356 6.524 3.886 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -21.576 7.751 5.972 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -19.945 8.377 5.831 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -20.621 9.572 3.723 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -22.261 8.997 3.949 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -22.123 11.258 4.817 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -22.340 10.165 6.170 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -19.868 10.197 6.566 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -19.685 11.332 5.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -19.738 12.453 7.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -21.087 12.900 6.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -21.265 11.800 7.713 1.00 0.00 H new ATOM 1223 N THR A 645 -19.800 7.152 2.069 1.00 0.00 N ATOM 1224 CA THR A 645 -18.968 7.518 0.978 1.00 0.00 C ATOM 1225 C THR A 645 -18.901 9.033 0.798 1.00 0.00 C ATOM 1226 O THR A 645 -19.835 9.673 0.287 1.00 0.00 O ATOM 1227 CB THR A 645 -19.435 6.810 -0.294 1.00 0.00 C ATOM 1228 OG1 THR A 645 -20.872 6.739 -0.287 1.00 0.00 O ATOM 1229 CG2 THR A 645 -18.853 5.412 -0.371 1.00 0.00 C ATOM 0 H THR A 645 -20.679 6.715 1.792 1.00 0.00 H new ATOM 0 HA THR A 645 -17.951 7.192 1.196 1.00 0.00 H new ATOM 0 HB THR A 645 -19.093 7.372 -1.163 1.00 0.00 H new ATOM 0 HG1 THR A 645 -21.181 6.288 -1.100 1.00 0.00 H new ATOM 0 HG21 THR A 645 -19.197 4.924 -1.283 1.00 0.00 H new ATOM 0 HG22 THR A 645 -17.765 5.471 -0.379 1.00 0.00 H new ATOM 0 HG23 THR A 645 -19.178 4.834 0.494 1.00 0.00 H new ATOM 1237 N LYS A 646 -17.834 9.597 1.290 1.00 0.00 N ATOM 1238 CA LYS A 646 -17.577 11.004 1.179 1.00 0.00 C ATOM 1239 C LYS A 646 -16.952 11.320 -0.180 1.00 0.00 C ATOM 1240 O LYS A 646 -16.590 10.406 -0.939 1.00 0.00 O ATOM 1241 CB LYS A 646 -16.742 11.515 2.387 1.00 0.00 C ATOM 1242 CG LYS A 646 -15.497 10.716 2.695 1.00 0.00 C ATOM 1243 CD LYS A 646 -14.844 11.181 3.990 1.00 0.00 C ATOM 1244 CE LYS A 646 -13.673 10.289 4.353 1.00 0.00 C ATOM 1245 NZ LYS A 646 -13.000 10.697 5.608 1.00 0.00 N ATOM 0 H LYS A 646 -17.107 9.083 1.787 1.00 0.00 H new ATOM 0 HA LYS A 646 -18.519 11.551 1.222 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -16.453 12.549 2.197 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -17.379 11.520 3.272 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -15.751 9.659 2.773 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -14.788 10.813 1.873 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -14.503 12.210 3.881 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -15.578 11.172 4.796 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -14.024 9.262 4.453 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -12.949 10.301 3.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -12.230 10.031 5.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -12.609 11.654 5.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -13.688 10.693 6.388 1.00 0.00 H new ATOM 1259 N GLU A 647 -16.858 12.581 -0.496 1.00 0.00 N ATOM 1260 CA GLU A 647 -16.371 13.022 -1.787 1.00 0.00 C ATOM 1261 C GLU A 647 -14.863 13.035 -1.826 1.00 0.00 C ATOM 1262 O GLU A 647 -14.258 12.897 -2.880 1.00 0.00 O ATOM 1263 CB GLU A 647 -16.929 14.411 -2.137 1.00 0.00 C ATOM 1264 CG GLU A 647 -18.430 14.458 -2.449 1.00 0.00 C ATOM 1265 CD GLU A 647 -19.316 13.982 -1.323 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -19.527 14.729 -0.359 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -19.807 12.842 -1.388 1.00 0.00 O ATOM 0 H GLU A 647 -17.117 13.341 0.133 1.00 0.00 H new ATOM 0 HA GLU A 647 -16.723 12.310 -2.534 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -16.727 15.085 -1.305 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -16.384 14.796 -2.999 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -18.704 15.482 -2.703 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -18.625 13.848 -3.331 1.00 0.00 H new ATOM 1274 N GLU A 648 -14.260 13.193 -0.687 1.00 0.00 N ATOM 1275 CA GLU A 648 -12.834 13.215 -0.593 1.00 0.00 C ATOM 1276 C GLU A 648 -12.389 12.237 0.467 1.00 0.00 C ATOM 1277 O GLU A 648 -12.715 12.391 1.642 1.00 0.00 O ATOM 1278 CB GLU A 648 -12.363 14.629 -0.273 1.00 0.00 C ATOM 1279 CG GLU A 648 -10.859 14.800 -0.198 1.00 0.00 C ATOM 1280 CD GLU A 648 -10.471 16.218 0.099 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -10.465 17.057 -0.835 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -10.182 16.542 1.270 1.00 0.00 O ATOM 0 H GLU A 648 -14.744 13.310 0.203 1.00 0.00 H new ATOM 0 HA GLU A 648 -12.392 12.918 -1.544 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -12.753 15.307 -1.032 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -12.796 14.934 0.680 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -10.457 14.144 0.575 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -10.411 14.491 -1.143 1.00 0.00 H new ATOM 1289 N TYR A 649 -11.709 11.199 0.052 1.00 0.00 N ATOM 1290 CA TYR A 649 -11.211 10.233 0.983 1.00 0.00 C ATOM 1291 C TYR A 649 -9.796 10.529 1.450 1.00 0.00 C ATOM 1292 O TYR A 649 -9.614 11.302 2.386 1.00 0.00 O ATOM 1293 CB TYR A 649 -11.417 8.799 0.505 1.00 0.00 C ATOM 1294 CG TYR A 649 -12.710 8.224 1.016 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -13.916 8.369 0.346 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -12.711 7.559 2.204 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -15.080 7.841 0.877 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -13.846 7.042 2.743 1.00 0.00 C ATOM 1299 CZ TYR A 649 -15.031 7.182 2.078 1.00 0.00 C ATOM 1300 OH TYR A 649 -16.166 6.662 2.606 1.00 0.00 O ATOM 0 H TYR A 649 -11.490 11.006 -0.925 1.00 0.00 H new ATOM 0 HA TYR A 649 -11.823 10.329 1.880 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -11.413 8.774 -0.585 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -10.585 8.180 0.841 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -13.947 8.897 -0.596 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -11.779 7.438 2.736 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -16.017 7.947 0.351 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -13.812 6.524 3.690 1.00 0.00 H new ATOM 0 HH TYR A 649 -16.725 7.386 2.958 1.00 0.00 H new ATOM 1310 N GLY A 650 -8.813 9.970 0.799 1.00 0.00 N ATOM 1311 CA GLY A 650 -7.448 10.225 1.190 1.00 0.00 C ATOM 1312 C GLY A 650 -6.622 8.980 1.109 1.00 0.00 C ATOM 1313 O GLY A 650 -7.179 7.880 1.003 1.00 0.00 O ATOM 0 H GLY A 650 -8.926 9.341 0.004 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -7.019 10.992 0.545 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -7.425 10.615 2.208 1.00 0.00 H new ATOM 1317 N HIS A 651 -5.305 9.133 1.141 1.00 0.00 N ATOM 1318 CA HIS A 651 -4.403 8.007 1.069 1.00 0.00 C ATOM 1319 C HIS A 651 -4.637 6.946 2.129 1.00 0.00 C ATOM 1320 O HIS A 651 -4.871 5.793 1.811 1.00 0.00 O ATOM 1321 CB HIS A 651 -2.931 8.447 1.061 1.00 0.00 C ATOM 1322 CG HIS A 651 -1.964 7.310 1.167 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -1.885 6.348 0.213 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -1.078 6.968 2.129 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.988 5.461 0.546 1.00 0.00 C ATOM 1326 NE2 HIS A 651 -0.477 5.805 1.711 1.00 0.00 N ATOM 0 H HIS A 651 -4.841 10.038 1.217 1.00 0.00 H new ATOM 0 HA HIS A 651 -4.634 7.535 0.114 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -2.731 8.999 0.142 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -2.762 9.135 1.889 1.00 0.00 H new ATOM 0 HD1 HIS A 651 -2.445 6.322 -0.639 1.00 0.00 H new ATOM 0 HD2 HIS A 651 -0.881 7.504 3.046 1.00 0.00 H new ATOM 0 HE1 HIS A 651 -0.711 4.593 -0.034 1.00 0.00 H new ATOM 1335 N SER A 652 -4.554 7.327 3.350 1.00 0.00 N ATOM 1336 CA SER A 652 -4.616 6.386 4.427 1.00 0.00 C ATOM 1337 C SER A 652 -6.056 6.180 4.900 1.00 0.00 C ATOM 1338 O SER A 652 -6.307 5.590 5.961 1.00 0.00 O ATOM 1339 CB SER A 652 -3.711 6.879 5.546 1.00 0.00 C ATOM 1340 OG SER A 652 -2.404 7.181 5.024 1.00 0.00 O ATOM 0 H SER A 652 -4.441 8.298 3.641 1.00 0.00 H new ATOM 0 HA SER A 652 -4.267 5.410 4.090 1.00 0.00 H new ATOM 0 HB2 SER A 652 -4.141 7.767 6.008 1.00 0.00 H new ATOM 0 HB3 SER A 652 -3.634 6.120 6.324 1.00 0.00 H new ATOM 0 HG SER A 652 -1.827 7.499 5.750 1.00 0.00 H new ATOM 1346 N GLU A 653 -6.999 6.612 4.094 1.00 0.00 N ATOM 1347 CA GLU A 653 -8.376 6.477 4.433 1.00 0.00 C ATOM 1348 C GLU A 653 -8.928 5.252 3.764 1.00 0.00 C ATOM 1349 O GLU A 653 -8.909 5.130 2.534 1.00 0.00 O ATOM 1350 CB GLU A 653 -9.172 7.716 4.048 1.00 0.00 C ATOM 1351 CG GLU A 653 -10.571 7.738 4.631 1.00 0.00 C ATOM 1352 CD GLU A 653 -10.612 7.879 6.125 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -10.098 7.006 6.841 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -11.225 8.849 6.616 1.00 0.00 O ATOM 0 H GLU A 653 -6.824 7.061 3.195 1.00 0.00 H new ATOM 0 HA GLU A 653 -8.464 6.370 5.514 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -8.633 8.603 4.382 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -9.238 7.773 2.962 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -11.126 8.563 4.184 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -11.084 6.819 4.350 1.00 0.00 H new ATOM 1361 N VAL A 654 -9.354 4.333 4.575 1.00 0.00 N ATOM 1362 CA VAL A 654 -9.932 3.109 4.101 1.00 0.00 C ATOM 1363 C VAL A 654 -11.423 3.196 4.017 1.00 0.00 C ATOM 1364 O VAL A 654 -12.070 3.941 4.760 1.00 0.00 O ATOM 1365 CB VAL A 654 -9.555 1.879 4.948 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -8.137 1.439 4.706 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -9.795 2.136 6.408 1.00 0.00 C ATOM 0 H VAL A 654 -9.311 4.410 5.591 1.00 0.00 H new ATOM 0 HA VAL A 654 -9.510 2.972 3.105 1.00 0.00 H new ATOM 0 HB VAL A 654 -10.204 1.062 4.633 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -7.915 0.569 5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -8.011 1.179 3.655 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -7.456 2.250 4.963 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -9.521 1.252 6.983 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -9.190 2.982 6.733 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -10.849 2.361 6.569 1.00 0.00 H new ATOM 1371 N VAL A 655 -11.954 2.445 3.116 1.00 0.00 N ATOM 1372 CA VAL A 655 -13.363 2.351 2.911 1.00 0.00 C ATOM 1373 C VAL A 655 -13.861 0.950 3.250 1.00 0.00 C ATOM 1374 O VAL A 655 -13.599 0.001 2.527 1.00 0.00 O ATOM 1375 CB VAL A 655 -13.743 2.754 1.455 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -13.446 4.194 1.247 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -12.963 1.961 0.425 1.00 0.00 C ATOM 0 H VAL A 655 -11.408 1.862 2.482 1.00 0.00 H new ATOM 0 HA VAL A 655 -13.856 3.053 3.583 1.00 0.00 H new ATOM 0 HB VAL A 655 -14.805 2.546 1.327 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -13.712 4.477 0.228 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -14.025 4.790 1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -12.383 4.373 1.408 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -13.259 2.274 -0.576 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -11.896 2.139 0.560 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -13.172 0.898 0.549 1.00 0.00 H new ATOM 1381 N GLU A 656 -14.463 0.811 4.407 1.00 0.00 N ATOM 1382 CA GLU A 656 -15.054 -0.452 4.807 1.00 0.00 C ATOM 1383 C GLU A 656 -16.235 -0.832 3.940 1.00 0.00 C ATOM 1384 O GLU A 656 -17.212 -0.083 3.798 1.00 0.00 O ATOM 1385 CB GLU A 656 -15.466 -0.452 6.271 1.00 0.00 C ATOM 1386 CG GLU A 656 -14.394 -0.937 7.186 1.00 0.00 C ATOM 1387 CD GLU A 656 -14.688 -0.708 8.636 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -15.636 -1.325 9.175 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -13.949 0.065 9.281 1.00 0.00 O ATOM 0 H GLU A 656 -14.559 1.559 5.094 1.00 0.00 H new ATOM 0 HA GLU A 656 -14.275 -1.202 4.669 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -15.751 0.559 6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -16.349 -1.079 6.393 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -14.242 -2.003 7.020 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -13.459 -0.438 6.931 1.00 0.00 H new ATOM 1396 N TYR A 657 -16.109 -1.952 3.353 1.00 0.00 N ATOM 1397 CA TYR A 657 -17.102 -2.576 2.561 1.00 0.00 C ATOM 1398 C TYR A 657 -17.796 -3.637 3.372 1.00 0.00 C ATOM 1399 O TYR A 657 -17.324 -4.008 4.455 1.00 0.00 O ATOM 1400 CB TYR A 657 -16.444 -3.241 1.358 1.00 0.00 C ATOM 1401 CG TYR A 657 -15.977 -2.302 0.285 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -16.853 -1.853 -0.685 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -14.666 -1.866 0.239 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -16.433 -0.994 -1.670 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -14.240 -1.009 -0.742 1.00 0.00 C ATOM 1406 CZ TYR A 657 -15.123 -0.577 -1.692 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.699 0.278 -2.662 1.00 0.00 O ATOM 0 H TYR A 657 -15.252 -2.501 3.413 1.00 0.00 H new ATOM 0 HA TYR A 657 -17.821 -1.827 2.230 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -15.590 -3.823 1.706 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -17.152 -3.945 0.920 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -17.881 -2.182 -0.668 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -13.966 -2.206 0.988 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -17.127 -0.648 -2.422 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -13.213 -0.677 -0.764 1.00 0.00 H new ATOM 0 HH TYR A 657 -15.456 0.525 -3.234 1.00 0.00 H new ATOM 1417 N TYR A 658 -18.883 -4.134 2.849 1.00 0.00 N ATOM 1418 CA TYR A 658 -19.612 -5.212 3.459 1.00 0.00 C ATOM 1419 C TYR A 658 -20.319 -5.941 2.346 1.00 0.00 C ATOM 1420 O TYR A 658 -20.756 -5.311 1.379 1.00 0.00 O ATOM 1421 CB TYR A 658 -20.621 -4.704 4.522 1.00 0.00 C ATOM 1422 CG TYR A 658 -21.882 -4.036 3.991 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -21.847 -2.819 3.329 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -23.114 -4.625 4.193 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -22.998 -2.218 2.884 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -24.268 -4.036 3.745 1.00 0.00 C ATOM 1427 CZ TYR A 658 -24.210 -2.832 3.092 1.00 0.00 C ATOM 1428 OH TYR A 658 -25.378 -2.241 2.654 1.00 0.00 O ATOM 0 H TYR A 658 -19.292 -3.798 1.977 1.00 0.00 H new ATOM 0 HA TYR A 658 -18.929 -5.874 3.992 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -20.917 -5.549 5.144 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -20.106 -3.996 5.171 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -20.897 -2.335 3.160 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -23.170 -5.569 4.715 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -22.952 -1.268 2.373 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -25.220 -4.519 3.906 1.00 0.00 H new ATOM 0 HH TYR A 658 -26.140 -2.813 2.884 1.00 0.00 H new ATOM 1438 N CYS A 659 -20.390 -7.226 2.416 1.00 0.00 N ATOM 1439 CA CYS A 659 -21.046 -7.947 1.375 1.00 0.00 C ATOM 1440 C CYS A 659 -22.380 -8.438 1.895 1.00 0.00 C ATOM 1441 O CYS A 659 -22.825 -8.022 2.974 1.00 0.00 O ATOM 1442 CB CYS A 659 -20.162 -9.093 0.838 1.00 0.00 C ATOM 1443 SG CYS A 659 -20.641 -9.732 -0.812 1.00 0.00 S ATOM 0 H CYS A 659 -20.008 -7.795 3.172 1.00 0.00 H new ATOM 0 HA CYS A 659 -21.223 -7.289 0.524 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -19.130 -8.744 0.791 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -20.188 -9.917 1.552 1.00 0.00 H new ATOM 1448 N ASN A 660 -23.035 -9.262 1.140 1.00 0.00 N ATOM 1449 CA ASN A 660 -24.317 -9.780 1.534 1.00 0.00 C ATOM 1450 C ASN A 660 -24.106 -10.880 2.561 1.00 0.00 C ATOM 1451 O ASN A 660 -23.043 -11.509 2.570 1.00 0.00 O ATOM 1452 CB ASN A 660 -25.090 -10.323 0.323 1.00 0.00 C ATOM 1453 CG ASN A 660 -25.299 -9.302 -0.755 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -26.249 -8.536 -0.723 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -24.472 -9.335 -1.747 1.00 0.00 N ATOM 0 H ASN A 660 -22.702 -9.597 0.236 1.00 0.00 H new ATOM 0 HA ASN A 660 -24.909 -8.975 1.968 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -24.550 -11.174 -0.092 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -26.060 -10.693 0.656 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -24.601 -8.707 -2.540 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -23.690 -9.989 -1.737 1.00 0.00 H new ATOM 1462 N PRO A 661 -25.119 -11.171 3.413 1.00 0.00 N ATOM 1463 CA PRO A 661 -25.031 -12.209 4.487 1.00 0.00 C ATOM 1464 C PRO A 661 -24.878 -13.641 3.942 1.00 0.00 C ATOM 1465 O PRO A 661 -24.889 -14.618 4.681 1.00 0.00 O ATOM 1466 CB PRO A 661 -26.382 -12.074 5.210 1.00 0.00 C ATOM 1467 CG PRO A 661 -27.288 -11.443 4.214 1.00 0.00 C ATOM 1468 CD PRO A 661 -26.435 -10.490 3.445 1.00 0.00 C ATOM 0 HA PRO A 661 -24.155 -12.054 5.116 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -26.759 -13.046 5.527 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -26.291 -11.460 6.106 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -27.731 -12.192 3.557 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -28.111 -10.924 4.706 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -26.825 -10.319 2.442 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -26.374 -9.518 3.934 1.00 0.00 H new ATOM 1476 N ARG A 662 -24.722 -13.735 2.657 1.00 0.00 N ATOM 1477 CA ARG A 662 -24.638 -14.986 1.956 1.00 0.00 C ATOM 1478 C ARG A 662 -23.202 -15.232 1.544 1.00 0.00 C ATOM 1479 O ARG A 662 -22.889 -16.229 0.909 1.00 0.00 O ATOM 1480 CB ARG A 662 -25.478 -14.884 0.687 1.00 0.00 C ATOM 1481 CG ARG A 662 -26.876 -14.338 0.894 1.00 0.00 C ATOM 1482 CD ARG A 662 -27.674 -15.207 1.820 1.00 0.00 C ATOM 1483 NE ARG A 662 -29.092 -14.824 1.838 1.00 0.00 N ATOM 1484 CZ ARG A 662 -30.011 -15.284 2.695 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -29.658 -15.992 3.747 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -31.281 -14.981 2.525 1.00 0.00 N ATOM 0 H ARG A 662 -24.647 -12.921 2.046 1.00 0.00 H new ATOM 0 HA ARG A 662 -24.991 -15.793 2.598 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -24.956 -14.247 -0.027 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -25.552 -15.874 0.237 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -26.817 -13.329 1.301 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -27.385 -14.265 -0.067 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -27.582 -16.248 1.511 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -27.265 -15.136 2.828 1.00 0.00 H new ATOM 0 HE ARG A 662 -29.402 -14.150 1.138 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -28.673 -16.196 3.917 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -30.369 -16.336 4.392 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -31.565 -14.395 1.740 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -31.981 -15.332 3.179 1.00 0.00 H new ATOM 1500 N PHE A 663 -22.329 -14.306 1.876 1.00 0.00 N ATOM 1501 CA PHE A 663 -20.974 -14.382 1.404 1.00 0.00 C ATOM 1502 C PHE A 663 -19.976 -14.260 2.516 1.00 0.00 C ATOM 1503 O PHE A 663 -20.266 -13.717 3.591 1.00 0.00 O ATOM 1504 CB PHE A 663 -20.671 -13.283 0.385 1.00 0.00 C ATOM 1505 CG PHE A 663 -21.493 -13.290 -0.867 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -22.832 -12.930 -0.859 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -20.916 -13.644 -2.058 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -23.558 -12.929 -2.014 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -21.632 -13.642 -3.218 1.00 0.00 C ATOM 1510 CZ PHE A 663 -22.959 -13.282 -3.203 1.00 0.00 C ATOM 0 H PHE A 663 -22.536 -13.500 2.466 1.00 0.00 H new ATOM 0 HA PHE A 663 -20.883 -15.364 0.939 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -20.802 -12.318 0.874 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -19.620 -13.358 0.104 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -23.305 -12.648 0.070 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -19.875 -13.930 -2.078 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -24.602 -12.652 -1.996 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -21.158 -13.923 -4.147 1.00 0.00 H new ATOM 0 HZ PHE A 663 -23.529 -13.276 -4.120 1.00 0.00 H new ATOM 1520 N LEU A 664 -18.813 -14.751 2.229 1.00 0.00 N ATOM 1521 CA LEU A 664 -17.662 -14.668 3.064 1.00 0.00 C ATOM 1522 C LEU A 664 -16.793 -13.582 2.524 1.00 0.00 C ATOM 1523 O LEU A 664 -16.565 -13.509 1.313 1.00 0.00 O ATOM 1524 CB LEU A 664 -16.888 -15.978 3.022 1.00 0.00 C ATOM 1525 CG LEU A 664 -17.605 -17.179 3.588 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -16.818 -18.441 3.298 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -17.781 -17.012 5.078 1.00 0.00 C ATOM 0 H LEU A 664 -18.633 -15.248 1.357 1.00 0.00 H new ATOM 0 HA LEU A 664 -17.960 -14.467 4.093 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -16.624 -16.190 1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -15.954 -15.845 3.568 1.00 0.00 H new ATOM 0 HG LEU A 664 -18.585 -17.261 3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -17.345 -19.301 3.711 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -16.712 -18.564 2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -15.831 -18.367 3.754 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -18.299 -17.881 5.483 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -16.804 -16.919 5.552 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -18.367 -16.115 5.277 1.00 0.00 H new ATOM 1539 N MET A 665 -16.330 -12.748 3.370 1.00 0.00 N ATOM 1540 CA MET A 665 -15.485 -11.677 2.955 1.00 0.00 C ATOM 1541 C MET A 665 -14.087 -12.064 3.350 1.00 0.00 C ATOM 1542 O MET A 665 -13.769 -12.131 4.536 1.00 0.00 O ATOM 1543 CB MET A 665 -15.950 -10.408 3.627 1.00 0.00 C ATOM 1544 CG MET A 665 -15.723 -9.173 2.814 1.00 0.00 C ATOM 1545 SD MET A 665 -16.723 -7.816 3.414 1.00 0.00 S ATOM 1546 CE MET A 665 -16.557 -6.702 2.049 1.00 0.00 C ATOM 0 H MET A 665 -16.520 -12.779 4.372 1.00 0.00 H new ATOM 0 HA MET A 665 -15.516 -11.497 1.880 1.00 0.00 H new ATOM 0 HB2 MET A 665 -17.014 -10.495 3.849 1.00 0.00 H new ATOM 0 HB3 MET A 665 -15.433 -10.303 4.581 1.00 0.00 H new ATOM 0 HG2 MET A 665 -14.669 -8.897 2.852 1.00 0.00 H new ATOM 0 HG3 MET A 665 -15.963 -9.372 1.770 1.00 0.00 H new ATOM 0 HE1 MET A 665 -17.483 -6.141 1.922 1.00 0.00 H new ATOM 0 HE2 MET A 665 -15.737 -6.010 2.242 1.00 0.00 H new ATOM 0 HE3 MET A 665 -16.349 -7.268 1.141 1.00 0.00 H new ATOM 1556 N LYS A 666 -13.273 -12.367 2.372 1.00 0.00 N ATOM 1557 CA LYS A 666 -12.001 -12.983 2.652 1.00 0.00 C ATOM 1558 C LYS A 666 -10.857 -11.997 2.802 1.00 0.00 C ATOM 1559 O LYS A 666 -10.084 -12.070 3.776 1.00 0.00 O ATOM 1560 CB LYS A 666 -11.690 -14.038 1.616 1.00 0.00 C ATOM 1561 CG LYS A 666 -10.529 -14.905 2.019 1.00 0.00 C ATOM 1562 CD LYS A 666 -10.361 -16.083 1.105 1.00 0.00 C ATOM 1563 CE LYS A 666 -10.005 -15.639 -0.278 1.00 0.00 C ATOM 1564 NZ LYS A 666 -9.799 -16.788 -1.178 1.00 0.00 N ATOM 0 H LYS A 666 -13.465 -12.200 1.384 1.00 0.00 H new ATOM 0 HA LYS A 666 -12.097 -13.457 3.629 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -12.570 -14.662 1.460 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -11.468 -13.556 0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -9.615 -14.311 2.016 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -10.677 -15.257 3.040 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -9.582 -16.740 1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -11.284 -16.663 1.079 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -10.798 -15.004 -0.673 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -9.099 -15.034 -0.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -9.554 -16.445 -2.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -9.026 -17.380 -0.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -10.672 -17.351 -1.228 1.00 0.00 H new ATOM 1578 N GLY A 667 -10.737 -11.102 1.868 1.00 0.00 N ATOM 1579 CA GLY A 667 -9.669 -10.130 1.905 1.00 0.00 C ATOM 1580 C GLY A 667 -10.029 -8.909 2.727 1.00 0.00 C ATOM 1581 O GLY A 667 -11.069 -8.904 3.413 1.00 0.00 O ATOM 0 H GLY A 667 -11.363 -11.019 1.067 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -8.774 -10.593 2.320 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -9.426 -9.822 0.888 1.00 0.00 H new ATOM 1585 N PRO A 668 -9.199 -7.859 2.689 1.00 0.00 N ATOM 1586 CA PRO A 668 -9.435 -6.622 3.446 1.00 0.00 C ATOM 1587 C PRO A 668 -10.675 -5.893 2.936 1.00 0.00 C ATOM 1588 O PRO A 668 -10.722 -5.477 1.782 1.00 0.00 O ATOM 1589 CB PRO A 668 -8.181 -5.786 3.153 1.00 0.00 C ATOM 1590 CG PRO A 668 -7.672 -6.313 1.855 1.00 0.00 C ATOM 1591 CD PRO A 668 -7.958 -7.780 1.886 1.00 0.00 C ATOM 0 HA PRO A 668 -9.603 -6.806 4.507 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -8.420 -4.725 3.084 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -7.438 -5.895 3.944 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -8.170 -5.833 1.013 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -6.604 -6.123 1.745 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -8.099 -8.185 0.884 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -7.144 -8.341 2.345 1.00 0.00 H new ATOM 1599 N ASN A 669 -11.670 -5.710 3.788 1.00 0.00 N ATOM 1600 CA ASN A 669 -12.921 -5.099 3.361 1.00 0.00 C ATOM 1601 C ASN A 669 -12.814 -3.609 3.326 1.00 0.00 C ATOM 1602 O ASN A 669 -13.728 -2.943 2.995 1.00 0.00 O ATOM 1603 CB ASN A 669 -14.096 -5.490 4.264 1.00 0.00 C ATOM 1604 CG ASN A 669 -13.932 -5.084 5.716 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -12.829 -5.099 6.271 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -14.998 -4.670 6.315 1.00 0.00 N ATOM 0 H ASN A 669 -11.638 -5.973 4.773 1.00 0.00 H new ATOM 0 HA ASN A 669 -13.113 -5.476 2.356 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -15.006 -5.035 3.873 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -14.233 -6.570 4.215 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -14.946 -4.341 7.279 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -15.892 -4.672 5.824 1.00 0.00 H new ATOM 1613 N LYS A 670 -11.692 -3.121 3.655 1.00 0.00 N ATOM 1614 CA LYS A 670 -11.444 -1.724 3.751 1.00 0.00 C ATOM 1615 C LYS A 670 -10.161 -1.400 3.096 1.00 0.00 C ATOM 1616 O LYS A 670 -9.077 -1.793 3.552 1.00 0.00 O ATOM 1617 CB LYS A 670 -11.519 -1.313 5.203 1.00 0.00 C ATOM 1618 CG LYS A 670 -11.064 -2.407 6.124 1.00 0.00 C ATOM 1619 CD LYS A 670 -11.323 -2.091 7.562 1.00 0.00 C ATOM 1620 CE LYS A 670 -10.677 -0.791 7.964 1.00 0.00 C ATOM 1621 NZ LYS A 670 -11.187 -0.296 9.266 1.00 0.00 N ATOM 0 H LYS A 670 -10.879 -3.696 3.877 1.00 0.00 H new ATOM 0 HA LYS A 670 -12.202 -1.147 3.222 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -10.903 -0.427 5.361 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -12.544 -1.036 5.448 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -11.574 -3.334 5.862 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -9.997 -2.579 5.980 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -12.398 -2.034 7.736 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -10.941 -2.898 8.188 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -9.597 -0.927 8.026 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -10.861 -0.042 7.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -10.754 0.625 9.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -12.220 -0.190 9.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -10.944 -0.975 10.015 1.00 0.00 H new ATOM 1635 N ILE A 671 -10.280 -0.730 1.998 1.00 0.00 N ATOM 1636 CA ILE A 671 -9.158 -0.439 1.176 1.00 0.00 C ATOM 1637 C ILE A 671 -8.853 1.037 1.238 1.00 0.00 C ATOM 1638 O ILE A 671 -9.746 1.839 1.461 1.00 0.00 O ATOM 1639 CB ILE A 671 -9.386 -0.860 -0.306 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -10.556 -0.061 -0.918 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -9.659 -2.353 -0.386 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -10.788 -0.272 -2.396 1.00 0.00 C ATOM 0 H ILE A 671 -11.166 -0.367 1.645 1.00 0.00 H new ATOM 0 HA ILE A 671 -8.316 -1.017 1.557 1.00 0.00 H new ATOM 0 HB ILE A 671 -8.485 -0.639 -0.878 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -11.470 -0.323 -0.384 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -10.378 1.000 -0.744 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -9.817 -2.639 -1.426 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -8.806 -2.901 0.015 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -10.550 -2.592 0.195 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -11.632 0.336 -2.722 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -9.895 0.019 -2.950 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -11.004 -1.324 -2.584 1.00 0.00 H new ATOM 1649 N GLN A 672 -7.619 1.375 1.054 1.00 0.00 N ATOM 1650 CA GLN A 672 -7.178 2.744 1.103 1.00 0.00 C ATOM 1651 C GLN A 672 -6.695 3.223 -0.260 1.00 0.00 C ATOM 1652 O GLN A 672 -6.312 2.409 -1.123 1.00 0.00 O ATOM 1653 CB GLN A 672 -6.093 2.962 2.170 1.00 0.00 C ATOM 1654 CG GLN A 672 -4.816 2.131 2.023 1.00 0.00 C ATOM 1655 CD GLN A 672 -4.973 0.668 2.436 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -4.802 0.333 3.600 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -5.226 -0.211 1.495 1.00 0.00 N ATOM 0 H GLN A 672 -6.874 0.705 0.863 1.00 0.00 H new ATOM 0 HA GLN A 672 -8.044 3.342 1.387 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -5.817 4.016 2.166 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -6.527 2.750 3.147 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -4.487 2.171 0.985 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -4.029 2.585 2.625 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -5.364 0.098 0.533 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -5.284 -1.203 1.726 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.723 4.516 -0.450 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.303 5.144 -1.693 1.00 0.00 C ATOM 1668 C CYS A 673 -4.775 5.294 -1.734 1.00 0.00 C ATOM 1669 O CYS A 673 -4.200 6.192 -1.143 1.00 0.00 O ATOM 1670 CB CYS A 673 -7.017 6.506 -1.854 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.394 7.579 -3.206 1.00 0.00 S ATOM 0 H CYS A 673 -7.041 5.178 0.258 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.587 4.510 -2.533 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -8.078 6.321 -2.022 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -6.933 7.052 -0.914 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.110 4.407 -2.414 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.673 4.450 -2.465 1.00 0.00 C ATOM 1678 C VAL A 674 -2.171 5.281 -3.640 1.00 0.00 C ATOM 1679 O VAL A 674 -2.372 4.928 -4.815 1.00 0.00 O ATOM 1680 CB VAL A 674 -2.012 3.051 -2.408 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -2.346 2.386 -1.096 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.447 2.170 -3.556 1.00 0.00 C ATOM 0 H VAL A 674 -4.536 3.645 -2.941 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.356 4.957 -1.553 1.00 0.00 H new ATOM 0 HB VAL A 674 -0.934 3.190 -2.492 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -1.880 1.401 -1.058 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -1.973 2.996 -0.273 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -3.427 2.279 -1.007 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -1.958 1.199 -3.475 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.528 2.036 -3.522 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -2.169 2.639 -4.500 1.00 0.00 H new ATOM 1686 N ASP A 675 -1.568 6.425 -3.299 1.00 0.00 N ATOM 1687 CA ASP A 675 -1.023 7.405 -4.257 1.00 0.00 C ATOM 1688 C ASP A 675 -2.111 8.156 -5.009 1.00 0.00 C ATOM 1689 O ASP A 675 -2.209 9.379 -4.903 1.00 0.00 O ATOM 1690 CB ASP A 675 0.027 6.790 -5.171 1.00 0.00 C ATOM 1691 CG ASP A 675 0.417 7.665 -6.348 1.00 0.00 C ATOM 1692 OD1 ASP A 675 1.101 8.685 -6.153 1.00 0.00 O ATOM 1693 OD2 ASP A 675 0.093 7.303 -7.504 1.00 0.00 O ATOM 0 H ASP A 675 -1.440 6.706 -2.327 1.00 0.00 H new ATOM 0 HA ASP A 675 -0.503 8.162 -3.670 1.00 0.00 H new ATOM 0 HB2 ASP A 675 0.919 6.570 -4.585 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -0.348 5.839 -5.548 1.00 0.00 H new ATOM 1698 N GLY A 676 -2.924 7.433 -5.712 1.00 0.00 N ATOM 1699 CA GLY A 676 -4.044 8.005 -6.398 1.00 0.00 C ATOM 1700 C GLY A 676 -4.919 6.933 -6.989 1.00 0.00 C ATOM 1701 O GLY A 676 -5.664 7.183 -7.928 1.00 0.00 O ATOM 0 H GLY A 676 -2.831 6.424 -5.828 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -4.626 8.614 -5.707 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -3.691 8.668 -7.188 1.00 0.00 H new ATOM 1705 N GLU A 677 -4.830 5.733 -6.433 1.00 0.00 N ATOM 1706 CA GLU A 677 -5.601 4.596 -6.888 1.00 0.00 C ATOM 1707 C GLU A 677 -5.981 3.830 -5.676 1.00 0.00 C ATOM 1708 O GLU A 677 -5.269 3.871 -4.691 1.00 0.00 O ATOM 1709 CB GLU A 677 -4.754 3.684 -7.765 1.00 0.00 C ATOM 1710 CG GLU A 677 -4.248 4.314 -9.028 1.00 0.00 C ATOM 1711 CD GLU A 677 -3.262 3.445 -9.730 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -2.066 3.538 -9.421 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -3.656 2.666 -10.632 1.00 0.00 O ATOM 0 H GLU A 677 -4.214 5.525 -5.647 1.00 0.00 H new ATOM 0 HA GLU A 677 -6.462 4.937 -7.462 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -3.901 3.335 -7.183 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -5.343 2.805 -8.026 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -5.088 4.519 -9.692 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -3.785 5.273 -8.794 1.00 0.00 H new ATOM 1720 N TRP A 678 -7.059 3.141 -5.715 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.432 2.345 -4.589 1.00 0.00 C ATOM 1722 C TRP A 678 -6.680 1.032 -4.594 1.00 0.00 C ATOM 1723 O TRP A 678 -5.965 0.704 -5.549 1.00 0.00 O ATOM 1724 CB TRP A 678 -8.916 2.105 -4.568 1.00 0.00 C ATOM 1725 CG TRP A 678 -9.714 3.343 -4.303 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.244 4.200 -5.217 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -10.057 3.857 -3.020 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -10.895 5.225 -4.575 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.791 5.036 -3.217 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.804 3.429 -1.725 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -11.279 5.792 -2.150 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -10.282 4.164 -0.676 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -11.009 5.335 -0.890 1.00 0.00 C ATOM 0 H TRP A 678 -7.702 3.106 -6.506 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.166 2.892 -3.685 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.222 1.682 -5.525 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.146 1.363 -3.804 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.165 4.091 -6.289 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.377 6.000 -5.031 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -9.237 2.527 -1.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.845 6.698 -2.312 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -10.094 3.833 0.335 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -11.368 5.895 -0.039 1.00 0.00 H new ATOM 1744 N THR A 679 -6.832 0.294 -3.552 1.00 0.00 N ATOM 1745 CA THR A 679 -6.169 -0.957 -3.416 1.00 0.00 C ATOM 1746 C THR A 679 -7.079 -2.109 -3.836 1.00 0.00 C ATOM 1747 O THR A 679 -8.212 -1.869 -4.281 1.00 0.00 O ATOM 1748 CB THR A 679 -5.633 -1.103 -1.993 1.00 0.00 C ATOM 1749 OG1 THR A 679 -6.419 -0.276 -1.105 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.195 -0.651 -1.941 1.00 0.00 C ATOM 0 H THR A 679 -7.426 0.543 -2.761 1.00 0.00 H new ATOM 0 HA THR A 679 -5.314 -0.993 -4.091 1.00 0.00 H new ATOM 0 HB THR A 679 -5.697 -2.147 -1.688 1.00 0.00 H new ATOM 0 HG1 THR A 679 -6.156 0.662 -1.213 1.00 0.00 H new ATOM 0 HG21 THR A 679 -3.817 -0.757 -0.924 1.00 0.00 H new ATOM 0 HG22 THR A 679 -3.597 -1.263 -2.616 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.131 0.394 -2.245 1.00 0.00 H new ATOM 1758 N THR A 680 -6.586 -3.321 -3.756 1.00 0.00 N ATOM 1759 CA THR A 680 -7.332 -4.473 -4.188 1.00 0.00 C ATOM 1760 C THR A 680 -8.510 -4.739 -3.255 1.00 0.00 C ATOM 1761 O THR A 680 -8.337 -4.850 -2.031 1.00 0.00 O ATOM 1762 CB THR A 680 -6.414 -5.705 -4.257 1.00 0.00 C ATOM 1763 OG1 THR A 680 -5.244 -5.383 -5.051 1.00 0.00 O ATOM 1764 CG2 THR A 680 -7.133 -6.888 -4.887 1.00 0.00 C ATOM 0 H THR A 680 -5.658 -3.534 -3.390 1.00 0.00 H new ATOM 0 HA THR A 680 -7.727 -4.272 -5.184 1.00 0.00 H new ATOM 0 HB THR A 680 -6.123 -5.977 -3.242 1.00 0.00 H new ATOM 0 HG1 THR A 680 -4.655 -6.165 -5.097 1.00 0.00 H new ATOM 0 HG21 THR A 680 -6.461 -7.745 -4.923 1.00 0.00 H new ATOM 0 HG22 THR A 680 -8.010 -7.140 -4.291 1.00 0.00 H new ATOM 0 HG23 THR A 680 -7.444 -6.628 -5.899 1.00 0.00 H new ATOM 1772 N LEU A 681 -9.684 -4.828 -3.843 1.00 0.00 N ATOM 1773 CA LEU A 681 -10.912 -5.070 -3.119 1.00 0.00 C ATOM 1774 C LEU A 681 -10.935 -6.394 -2.337 1.00 0.00 C ATOM 1775 O LEU A 681 -10.209 -7.352 -2.662 1.00 0.00 O ATOM 1776 CB LEU A 681 -12.151 -4.929 -4.014 1.00 0.00 C ATOM 1777 CG LEU A 681 -12.801 -3.550 -4.053 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -11.981 -2.547 -4.822 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -14.209 -3.640 -4.560 1.00 0.00 C ATOM 0 H LEU A 681 -9.813 -4.733 -4.850 1.00 0.00 H new ATOM 0 HA LEU A 681 -10.947 -4.283 -2.366 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -11.872 -5.205 -5.031 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -12.898 -5.650 -3.681 1.00 0.00 H new ATOM 0 HG LEU A 681 -12.840 -3.179 -3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -12.489 -1.583 -4.819 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -11.002 -2.443 -4.355 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -11.858 -2.889 -5.850 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -14.653 -2.645 -4.579 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -14.207 -4.056 -5.567 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -14.792 -4.285 -3.902 1.00 0.00 H new ATOM 1791 N PRO A 682 -11.787 -6.439 -1.283 1.00 0.00 N ATOM 1792 CA PRO A 682 -11.904 -7.575 -0.356 1.00 0.00 C ATOM 1793 C PRO A 682 -12.241 -8.893 -0.988 1.00 0.00 C ATOM 1794 O PRO A 682 -11.682 -9.909 -0.589 1.00 0.00 O ATOM 1795 CB PRO A 682 -13.042 -7.174 0.590 1.00 0.00 C ATOM 1796 CG PRO A 682 -13.717 -6.008 -0.042 1.00 0.00 C ATOM 1797 CD PRO A 682 -12.695 -5.335 -0.892 1.00 0.00 C ATOM 0 HA PRO A 682 -10.937 -7.744 0.118 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -13.740 -7.999 0.730 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -12.655 -6.913 1.575 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -14.568 -6.331 -0.642 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -14.102 -5.325 0.716 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -13.147 -4.860 -1.763 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -12.166 -4.556 -0.343 1.00 0.00 H new ATOM 1805 N VAL A 683 -13.127 -8.855 -1.967 1.00 0.00 N ATOM 1806 CA VAL A 683 -13.728 -10.019 -2.607 1.00 0.00 C ATOM 1807 C VAL A 683 -14.596 -10.838 -1.630 1.00 0.00 C ATOM 1808 O VAL A 683 -14.163 -11.254 -0.534 1.00 0.00 O ATOM 1809 CB VAL A 683 -12.753 -10.932 -3.465 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -11.871 -10.122 -4.401 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -11.949 -11.972 -2.669 1.00 0.00 C ATOM 0 H VAL A 683 -13.464 -7.975 -2.357 1.00 0.00 H new ATOM 0 HA VAL A 683 -14.384 -9.583 -3.360 1.00 0.00 H new ATOM 0 HB VAL A 683 -13.430 -11.528 -4.077 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -11.224 -10.795 -4.964 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -12.496 -9.557 -5.092 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -11.259 -9.433 -3.819 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -11.316 -12.541 -3.350 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -11.326 -11.464 -1.933 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -12.634 -12.649 -2.159 1.00 0.00 H new ATOM 1815 N CYS A 684 -15.830 -11.004 -1.992 1.00 0.00 N ATOM 1816 CA CYS A 684 -16.732 -11.778 -1.205 1.00 0.00 C ATOM 1817 C CYS A 684 -17.246 -12.925 -2.010 1.00 0.00 C ATOM 1818 O CYS A 684 -17.692 -12.760 -3.146 1.00 0.00 O ATOM 1819 CB CYS A 684 -17.856 -10.933 -0.595 1.00 0.00 C ATOM 1820 SG CYS A 684 -18.865 -9.949 -1.771 1.00 0.00 S ATOM 0 H CYS A 684 -16.237 -10.607 -2.839 1.00 0.00 H new ATOM 0 HA CYS A 684 -16.185 -12.179 -0.352 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -18.523 -11.597 -0.045 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -17.415 -10.250 0.131 1.00 0.00 H new ATOM 1825 N ILE A 685 -17.147 -14.074 -1.438 1.00 0.00 N ATOM 1826 CA ILE A 685 -17.481 -15.293 -2.097 1.00 0.00 C ATOM 1827 C ILE A 685 -18.594 -15.981 -1.382 1.00 0.00 C ATOM 1828 O ILE A 685 -18.710 -15.855 -0.179 1.00 0.00 O ATOM 1829 CB ILE A 685 -16.269 -16.253 -2.268 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -15.526 -16.530 -0.918 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -15.318 -15.703 -3.318 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -14.569 -15.442 -0.451 1.00 0.00 C ATOM 0 H ILE A 685 -16.825 -14.198 -0.478 1.00 0.00 H new ATOM 0 HA ILE A 685 -17.804 -15.023 -3.103 1.00 0.00 H new ATOM 0 HB ILE A 685 -16.654 -17.215 -2.605 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -16.273 -16.688 -0.140 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -14.967 -17.461 -1.017 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -14.472 -16.380 -3.433 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -15.841 -15.611 -4.270 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -14.959 -14.723 -3.005 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -14.112 -15.740 0.492 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -13.792 -15.295 -1.201 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -15.118 -14.511 -0.310 1.00 0.00 H new ATOM 1839 N VAL A 686 -19.418 -16.683 -2.131 1.00 0.00 N ATOM 1840 CA VAL A 686 -20.604 -17.341 -1.599 1.00 0.00 C ATOM 1841 C VAL A 686 -20.238 -18.307 -0.467 1.00 0.00 C ATOM 1842 O VAL A 686 -19.320 -19.129 -0.606 1.00 0.00 O ATOM 1843 CB VAL A 686 -21.390 -18.087 -2.712 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -22.661 -18.725 -2.168 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -21.727 -17.144 -3.852 1.00 0.00 C ATOM 0 H VAL A 686 -19.287 -16.817 -3.134 1.00 0.00 H new ATOM 0 HA VAL A 686 -21.250 -16.562 -1.194 1.00 0.00 H new ATOM 0 HB VAL A 686 -20.748 -18.883 -3.088 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -23.185 -19.238 -2.975 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -22.403 -19.442 -1.389 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -23.306 -17.952 -1.750 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -22.277 -17.685 -4.621 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -22.339 -16.324 -3.477 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -20.807 -16.744 -4.278 1.00 0.00 H new ATOM 1849 N GLU A 687 -20.917 -18.159 0.637 1.00 0.00 N ATOM 1850 CA GLU A 687 -20.701 -18.960 1.807 1.00 0.00 C ATOM 1851 C GLU A 687 -21.481 -20.260 1.651 1.00 0.00 C ATOM 1852 O GLU A 687 -22.715 -20.245 1.815 1.00 0.00 O ATOM 1853 CB GLU A 687 -21.169 -18.193 3.048 1.00 0.00 C ATOM 1854 CG GLU A 687 -20.918 -18.902 4.363 1.00 0.00 C ATOM 1855 CD GLU A 687 -21.543 -18.184 5.525 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -22.763 -18.348 5.745 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -20.841 -17.450 6.247 1.00 0.00 O ATOM 1858 OXT GLU A 687 -20.876 -21.293 1.327 1.00 0.00 O ATOM 0 H GLU A 687 -21.653 -17.461 0.749 1.00 0.00 H new ATOM 0 HA GLU A 687 -19.641 -19.186 1.925 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -20.667 -17.226 3.071 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -22.237 -17.996 2.955 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -21.315 -19.916 4.309 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -19.844 -18.989 4.527 1.00 0.00 H new