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= -2.95! K(o=-5.4!,f=-2.1) USER MOD Set 1.2: A 679 THR OG1 : rot 160:sc= -2.43! USER MOD Set 2.1: A 651 HIS : no HD1:sc= -2.32! C(o=-2.4!,f=-0.66!) USER MOD Set 2.2: A 652 SER OG : rot 180:sc= -0.094 USER MOD Single : A 573 LYS NZ :NH3+ -169:sc=-0.00552 (180deg=-0.123) USER MOD Single : A 577 HIS : no HD1:sc= -0.226 K(o=-0.23,f=-0.89) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 LYS NZ :NH3+ -152:sc= 1.2 (180deg=0.991) USER MOD Single : A 586 GLN : amide:sc= -1.18 K(o=-1.2,f=-0.042) USER MOD Single : A 587 TYR OH : rot 130:sc= 0.0494 USER MOD Single : A 588 LYS NZ :NH3+ 145:sc= 1.04 (180deg=-0.129) USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 SER OG : rot -7:sc= -0.0353 USER MOD Single : A 598 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0186) USER MOD Single : A 602 THR OG1 : rot 180:sc= 0 USER MOD Single : A 607 ASN : amide:sc= -0.424 K(o=-0.42,f=-1.7) USER MOD Single : A 608 SER OG : rot 40:sc= 0.339 USER MOD Single : A 610 GLN : amide:sc= -6.42! K(o=-6.4!,f=-0.79) USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 617 SER OG : rot 169:sc= 1.27 USER MOD Single : A 624 LYS NZ :NH3+ 179:sc= 1.25 (180deg=1.21) USER MOD Single : A 626 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 628 GLN : amide:sc= -1.87! K(o=-1.9!,f=-0.15) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -0.809 K(o=-0.81,f=0.0014) USER MOD Single : A 640 ASN : amide:sc= -0.815 K(o=-0.82,f=-0.14) USER MOD Single : A 642 LYS NZ :NH3+ -179:sc= 2.39 (180deg=2.36) USER MOD Single : A 644 LYS NZ :NH3+ 180:sc= 0.939 (180deg=0.939) USER MOD Single : A 645 THR OG1 : rot 33:sc= 0.164 USER MOD Single : A 646 LYS NZ :NH3+ -168:sc= 0.212 (180deg=0.0987) USER MOD Single : A 649 TYR OH : rot -71:sc= 0.241 USER MOD Single : A 657 TYR OH : rot 30:sc= -0.28 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= 1.1 K(o=1.1,f=-0.032) USER MOD Single : A 665 MET CE :methyl -132:sc= -1.5 (180deg=-8!) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -1.32 K(o=-1.3,f=-0.54) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0.00344 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 24.917 -10.807 -2.105 1.00 0.00 N ATOM 85 CA GLU A 568 23.820 -10.448 -1.214 1.00 0.00 C ATOM 86 C GLU A 568 23.378 -9.032 -1.519 1.00 0.00 C ATOM 87 O GLU A 568 23.859 -8.409 -2.470 1.00 0.00 O ATOM 88 CB GLU A 568 24.180 -10.565 0.290 1.00 0.00 C ATOM 89 CG GLU A 568 24.406 -11.977 0.777 1.00 0.00 C ATOM 90 CD GLU A 568 24.426 -12.106 2.280 1.00 0.00 C ATOM 91 OE1 GLU A 568 25.408 -11.705 2.927 1.00 0.00 O ATOM 92 OE2 GLU A 568 23.458 -12.669 2.848 1.00 0.00 O ATOM 0 HA GLU A 568 23.016 -11.160 -1.397 1.00 0.00 H new ATOM 0 HB2 GLU A 568 25.080 -9.981 0.481 1.00 0.00 H new ATOM 0 HB3 GLU A 568 23.379 -10.116 0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 568 23.622 -12.619 0.377 1.00 0.00 H new ATOM 0 HG3 GLU A 568 25.352 -12.342 0.378 1.00 0.00 H new ATOM 99 N CYS A 569 22.463 -8.538 -0.755 1.00 0.00 N ATOM 100 CA CYS A 569 22.003 -7.188 -0.900 1.00 0.00 C ATOM 101 C CYS A 569 22.663 -6.323 0.163 1.00 0.00 C ATOM 102 O CYS A 569 23.000 -6.816 1.230 1.00 0.00 O ATOM 103 CB CYS A 569 20.481 -7.158 -0.806 1.00 0.00 C ATOM 104 SG CYS A 569 19.636 -7.989 -2.190 1.00 0.00 S ATOM 0 H CYS A 569 22.007 -9.059 -0.006 1.00 0.00 H new ATOM 0 HA CYS A 569 22.278 -6.788 -1.876 1.00 0.00 H new ATOM 0 HB2 CYS A 569 20.176 -7.629 0.128 1.00 0.00 H new ATOM 0 HB3 CYS A 569 20.150 -6.120 -0.762 1.00 0.00 H new ATOM 109 N GLU A 570 22.881 -5.059 -0.133 1.00 0.00 N ATOM 110 CA GLU A 570 23.556 -4.164 0.804 1.00 0.00 C ATOM 111 C GLU A 570 22.887 -2.795 0.880 1.00 0.00 C ATOM 112 O GLU A 570 23.460 -1.849 1.416 1.00 0.00 O ATOM 113 CB GLU A 570 25.003 -4.008 0.424 1.00 0.00 C ATOM 114 CG GLU A 570 25.120 -3.594 -0.964 1.00 0.00 C ATOM 115 CD GLU A 570 26.521 -3.248 -1.365 1.00 0.00 C ATOM 116 OE1 GLU A 570 27.291 -4.152 -1.765 1.00 0.00 O ATOM 117 OE2 GLU A 570 26.890 -2.056 -1.289 1.00 0.00 O ATOM 0 H GLU A 570 22.604 -4.622 -1.012 1.00 0.00 H new ATOM 0 HA GLU A 570 23.484 -4.619 1.792 1.00 0.00 H new ATOM 0 HB2 GLU A 570 25.478 -3.271 1.071 1.00 0.00 H new ATOM 0 HB3 GLU A 570 25.529 -4.951 0.575 1.00 0.00 H new ATOM 0 HG2 GLU A 570 24.753 -4.395 -1.606 1.00 0.00 H new ATOM 0 HG3 GLU A 570 24.478 -2.730 -1.133 1.00 0.00 H new ATOM 124 N LEU A 571 21.670 -2.718 0.338 1.00 0.00 N ATOM 125 CA LEU A 571 20.862 -1.491 0.277 1.00 0.00 C ATOM 126 C LEU A 571 21.474 -0.514 -0.731 1.00 0.00 C ATOM 127 O LEU A 571 22.507 0.131 -0.464 1.00 0.00 O ATOM 128 CB LEU A 571 20.682 -0.847 1.676 1.00 0.00 C ATOM 129 CG LEU A 571 19.437 0.049 1.897 1.00 0.00 C ATOM 130 CD1 LEU A 571 19.546 1.406 1.234 1.00 0.00 C ATOM 131 CD2 LEU A 571 18.178 -0.653 1.425 1.00 0.00 C ATOM 0 H LEU A 571 21.205 -3.523 -0.081 1.00 0.00 H new ATOM 0 HA LEU A 571 19.861 -1.754 -0.066 1.00 0.00 H new ATOM 0 HB2 LEU A 571 20.655 -1.649 2.414 1.00 0.00 H new ATOM 0 HB3 LEU A 571 21.568 -0.249 1.887 1.00 0.00 H new ATOM 0 HG LEU A 571 19.382 0.224 2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 571 18.640 1.980 1.429 1.00 0.00 H new ATOM 0 HD12 LEU A 571 20.408 1.939 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 571 19.669 1.277 0.159 1.00 0.00 H new ATOM 0 HD21 LEU A 571 17.317 -0.006 1.590 1.00 0.00 H new ATOM 0 HD22 LEU A 571 18.264 -0.879 0.362 1.00 0.00 H new ATOM 0 HD23 LEU A 571 18.047 -1.580 1.983 1.00 0.00 H new ATOM 143 N PRO A 572 20.881 -0.449 -1.932 1.00 0.00 N ATOM 144 CA PRO A 572 21.330 0.440 -3.010 1.00 0.00 C ATOM 145 C PRO A 572 21.008 1.904 -2.704 1.00 0.00 C ATOM 146 O PRO A 572 20.548 2.247 -1.610 1.00 0.00 O ATOM 147 CB PRO A 572 20.489 -0.030 -4.211 1.00 0.00 C ATOM 148 CG PRO A 572 19.265 -0.580 -3.601 1.00 0.00 C ATOM 149 CD PRO A 572 19.711 -1.238 -2.339 1.00 0.00 C ATOM 0 HA PRO A 572 22.408 0.393 -3.167 1.00 0.00 H new ATOM 0 HB2 PRO A 572 20.262 0.795 -4.886 1.00 0.00 H new ATOM 0 HB3 PRO A 572 21.016 -0.784 -4.796 1.00 0.00 H new ATOM 0 HG2 PRO A 572 18.539 0.208 -3.398 1.00 0.00 H new ATOM 0 HG3 PRO A 572 18.781 -1.295 -4.267 1.00 0.00 H new ATOM 0 HD2 PRO A 572 18.930 -1.218 -1.579 1.00 0.00 H new ATOM 0 HD3 PRO A 572 19.970 -2.284 -2.502 1.00 0.00 H new ATOM 157 N LYS A 573 21.225 2.753 -3.661 1.00 0.00 N ATOM 158 CA LYS A 573 20.910 4.142 -3.508 1.00 0.00 C ATOM 159 C LYS A 573 19.427 4.340 -3.688 1.00 0.00 C ATOM 160 O LYS A 573 18.918 4.368 -4.812 1.00 0.00 O ATOM 161 CB LYS A 573 21.713 5.039 -4.477 1.00 0.00 C ATOM 162 CG LYS A 573 23.170 5.313 -4.076 1.00 0.00 C ATOM 163 CD LYS A 573 24.025 4.057 -3.967 1.00 0.00 C ATOM 164 CE LYS A 573 25.445 4.395 -3.534 1.00 0.00 C ATOM 165 NZ LYS A 573 26.165 5.203 -4.545 1.00 0.00 N ATOM 0 H LYS A 573 21.624 2.505 -4.567 1.00 0.00 H new ATOM 0 HA LYS A 573 21.198 4.446 -2.502 1.00 0.00 H new ATOM 0 HB2 LYS A 573 21.708 4.574 -5.463 1.00 0.00 H new ATOM 0 HB3 LYS A 573 21.196 5.994 -4.573 1.00 0.00 H new ATOM 0 HG2 LYS A 573 23.619 5.984 -4.809 1.00 0.00 H new ATOM 0 HG3 LYS A 573 23.182 5.833 -3.118 1.00 0.00 H new ATOM 0 HD2 LYS A 573 23.577 3.370 -3.249 1.00 0.00 H new ATOM 0 HD3 LYS A 573 24.047 3.544 -4.929 1.00 0.00 H new ATOM 0 HE2 LYS A 573 25.414 4.941 -2.591 1.00 0.00 H new ATOM 0 HE3 LYS A 573 25.996 3.472 -3.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 27.174 5.251 -4.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 26.059 4.762 -5.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 25.768 6.164 -4.568 1.00 0.00 H new ATOM 179 N ILE A 574 18.729 4.368 -2.579 1.00 0.00 N ATOM 180 CA ILE A 574 17.299 4.612 -2.555 1.00 0.00 C ATOM 181 C ILE A 574 17.002 6.077 -2.830 1.00 0.00 C ATOM 182 O ILE A 574 17.914 6.874 -3.113 1.00 0.00 O ATOM 183 CB ILE A 574 16.668 4.253 -1.186 1.00 0.00 C ATOM 184 CG1 ILE A 574 17.430 4.932 -0.051 1.00 0.00 C ATOM 185 CG2 ILE A 574 16.654 2.755 -0.980 1.00 0.00 C ATOM 186 CD1 ILE A 574 16.687 4.975 1.246 1.00 0.00 C ATOM 0 H ILE A 574 19.138 4.221 -1.656 1.00 0.00 H new ATOM 0 HA ILE A 574 16.867 3.976 -3.328 1.00 0.00 H new ATOM 0 HB ILE A 574 15.639 4.613 -1.182 1.00 0.00 H new ATOM 0 HG12 ILE A 574 18.374 4.409 0.101 1.00 0.00 H new ATOM 0 HG13 ILE A 574 17.674 5.951 -0.351 1.00 0.00 H new ATOM 0 HG21 ILE A 574 16.207 2.525 -0.013 1.00 0.00 H new ATOM 0 HG22 ILE A 574 16.070 2.284 -1.771 1.00 0.00 H new ATOM 0 HG23 ILE A 574 17.675 2.374 -1.007 1.00 0.00 H new ATOM 0 HD11 ILE A 574 17.298 5.473 1.999 1.00 0.00 H new ATOM 0 HD12 ILE A 574 15.755 5.524 1.113 1.00 0.00 H new ATOM 0 HD13 ILE A 574 16.466 3.959 1.573 1.00 0.00 H new ATOM 193 N ASP A 575 15.743 6.433 -2.734 1.00 0.00 N ATOM 194 CA ASP A 575 15.342 7.804 -2.920 1.00 0.00 C ATOM 195 C ASP A 575 15.807 8.612 -1.742 1.00 0.00 C ATOM 196 O ASP A 575 15.901 8.100 -0.613 1.00 0.00 O ATOM 197 CB ASP A 575 13.829 7.953 -3.028 1.00 0.00 C ATOM 198 CG ASP A 575 13.421 9.326 -3.542 1.00 0.00 C ATOM 199 OD1 ASP A 575 13.360 9.518 -4.789 1.00 0.00 O ATOM 200 OD2 ASP A 575 13.186 10.239 -2.730 1.00 0.00 O ATOM 0 H ASP A 575 14.979 5.790 -2.528 1.00 0.00 H new ATOM 0 HA ASP A 575 15.789 8.153 -3.851 1.00 0.00 H new ATOM 0 HB2 ASP A 575 13.437 7.186 -3.696 1.00 0.00 H new ATOM 0 HB3 ASP A 575 13.378 7.785 -2.050 1.00 0.00 H new ATOM 205 N VAL A 576 16.096 9.835 -1.997 1.00 0.00 N ATOM 206 CA VAL A 576 16.512 10.782 -0.998 1.00 0.00 C ATOM 207 C VAL A 576 15.453 10.941 0.110 1.00 0.00 C ATOM 208 O VAL A 576 15.782 11.129 1.279 1.00 0.00 O ATOM 209 CB VAL A 576 16.846 12.157 -1.654 1.00 0.00 C ATOM 210 CG1 VAL A 576 15.676 12.657 -2.493 1.00 0.00 C ATOM 211 CG2 VAL A 576 17.221 13.195 -0.609 1.00 0.00 C ATOM 0 H VAL A 576 16.052 10.230 -2.936 1.00 0.00 H new ATOM 0 HA VAL A 576 17.416 10.395 -0.528 1.00 0.00 H new ATOM 0 HB VAL A 576 17.706 12.006 -2.306 1.00 0.00 H new ATOM 0 HG11 VAL A 576 15.933 13.617 -2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 576 15.459 11.936 -3.281 1.00 0.00 H new ATOM 0 HG13 VAL A 576 14.798 12.776 -1.858 1.00 0.00 H new ATOM 0 HG21 VAL A 576 17.448 14.141 -1.101 1.00 0.00 H new ATOM 0 HG22 VAL A 576 16.388 13.335 0.080 1.00 0.00 H new ATOM 0 HG23 VAL A 576 18.097 12.855 -0.056 1.00 0.00 H new ATOM 215 N HIS A 577 14.196 10.818 -0.243 1.00 0.00 N ATOM 216 CA HIS A 577 13.148 10.995 0.715 1.00 0.00 C ATOM 217 C HIS A 577 12.646 9.692 1.239 1.00 0.00 C ATOM 218 O HIS A 577 11.636 9.658 1.918 1.00 0.00 O ATOM 219 CB HIS A 577 12.025 11.841 0.128 1.00 0.00 C ATOM 220 CG HIS A 577 12.436 13.273 -0.019 1.00 0.00 C ATOM 221 ND1 HIS A 577 12.577 13.902 -1.222 1.00 0.00 N ATOM 222 CD2 HIS A 577 12.767 14.188 0.915 1.00 0.00 C ATOM 223 CE1 HIS A 577 12.982 15.139 -1.028 1.00 0.00 C ATOM 224 NE2 HIS A 577 13.105 15.336 0.263 1.00 0.00 N ATOM 0 H HIS A 577 13.881 10.596 -1.187 1.00 0.00 H new ATOM 0 HA HIS A 577 13.562 11.532 1.569 1.00 0.00 H new ATOM 0 HB2 HIS A 577 11.738 11.442 -0.845 1.00 0.00 H new ATOM 0 HB3 HIS A 577 11.147 11.778 0.770 1.00 0.00 H new ATOM 0 HD2 HIS A 577 12.765 14.038 1.985 1.00 0.00 H new ATOM 0 HE1 HIS A 577 13.179 15.868 -1.800 1.00 0.00 H new ATOM 0 HE2 HIS A 577 13.404 16.205 0.706 1.00 0.00 H new ATOM 233 N LEU A 578 13.375 8.641 0.975 1.00 0.00 N ATOM 234 CA LEU A 578 12.989 7.325 1.394 1.00 0.00 C ATOM 235 C LEU A 578 13.870 6.897 2.560 1.00 0.00 C ATOM 236 O LEU A 578 15.020 7.343 2.671 1.00 0.00 O ATOM 237 CB LEU A 578 13.202 6.348 0.259 1.00 0.00 C ATOM 238 CG LEU A 578 12.317 5.112 0.289 1.00 0.00 C ATOM 239 CD1 LEU A 578 11.149 5.230 -0.665 1.00 0.00 C ATOM 240 CD2 LEU A 578 13.106 3.891 0.021 1.00 0.00 C ATOM 0 H LEU A 578 14.256 8.676 0.462 1.00 0.00 H new ATOM 0 HA LEU A 578 11.939 7.335 1.688 1.00 0.00 H new ATOM 0 HB2 LEU A 578 13.036 6.870 -0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 578 14.244 6.028 0.268 1.00 0.00 H new ATOM 0 HG LEU A 578 11.902 5.034 1.294 1.00 0.00 H new ATOM 0 HD11 LEU A 578 10.543 4.326 -0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 578 10.540 6.092 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 578 11.521 5.358 -1.682 1.00 0.00 H new ATOM 0 HD21 LEU A 578 12.450 3.021 0.048 1.00 0.00 H new ATOM 0 HD22 LEU A 578 13.569 3.966 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 578 13.881 3.785 0.780 1.00 0.00 H new ATOM 252 N VAL A 579 13.332 6.065 3.420 1.00 0.00 N ATOM 253 CA VAL A 579 14.042 5.481 4.541 1.00 0.00 C ATOM 254 C VAL A 579 13.595 4.020 4.717 1.00 0.00 C ATOM 255 O VAL A 579 12.404 3.729 4.871 1.00 0.00 O ATOM 256 CB VAL A 579 13.862 6.285 5.891 1.00 0.00 C ATOM 257 CG1 VAL A 579 14.554 7.640 5.830 1.00 0.00 C ATOM 258 CG2 VAL A 579 12.392 6.479 6.240 1.00 0.00 C ATOM 0 H VAL A 579 12.359 5.765 3.360 1.00 0.00 H new ATOM 0 HA VAL A 579 15.106 5.527 4.309 1.00 0.00 H new ATOM 0 HB VAL A 579 14.329 5.686 6.673 1.00 0.00 H new ATOM 0 HG11 VAL A 579 14.410 8.165 6.774 1.00 0.00 H new ATOM 0 HG12 VAL A 579 15.620 7.497 5.654 1.00 0.00 H new ATOM 0 HG13 VAL A 579 14.128 8.230 5.018 1.00 0.00 H new ATOM 0 HG21 VAL A 579 12.310 7.035 7.174 1.00 0.00 H new ATOM 0 HG22 VAL A 579 11.899 7.034 5.442 1.00 0.00 H new ATOM 0 HG23 VAL A 579 11.914 5.506 6.354 1.00 0.00 H new ATOM 262 N PRO A 580 14.526 3.081 4.610 1.00 0.00 N ATOM 263 CA PRO A 580 14.227 1.666 4.776 1.00 0.00 C ATOM 264 C PRO A 580 13.927 1.302 6.233 1.00 0.00 C ATOM 265 O PRO A 580 14.632 1.732 7.146 1.00 0.00 O ATOM 266 CB PRO A 580 15.499 0.965 4.295 1.00 0.00 C ATOM 267 CG PRO A 580 16.584 1.977 4.407 1.00 0.00 C ATOM 268 CD PRO A 580 15.938 3.325 4.285 1.00 0.00 C ATOM 0 HA PRO A 580 13.335 1.373 4.222 1.00 0.00 H new ATOM 0 HB2 PRO A 580 15.717 0.088 4.905 1.00 0.00 H new ATOM 0 HB3 PRO A 580 15.391 0.619 3.267 1.00 0.00 H new ATOM 0 HG2 PRO A 580 17.103 1.883 5.361 1.00 0.00 H new ATOM 0 HG3 PRO A 580 17.328 1.833 3.624 1.00 0.00 H new ATOM 0 HD2 PRO A 580 16.386 4.044 4.971 1.00 0.00 H new ATOM 0 HD3 PRO A 580 16.051 3.731 3.280 1.00 0.00 H new ATOM 276 N ASP A 581 12.884 0.516 6.433 1.00 0.00 N ATOM 277 CA ASP A 581 12.457 0.054 7.763 1.00 0.00 C ATOM 278 C ASP A 581 13.517 -0.828 8.369 1.00 0.00 C ATOM 279 O ASP A 581 13.898 -0.648 9.531 1.00 0.00 O ATOM 280 CB ASP A 581 11.135 -0.720 7.660 1.00 0.00 C ATOM 281 CG ASP A 581 10.676 -1.330 8.966 1.00 0.00 C ATOM 282 OD1 ASP A 581 9.947 -0.656 9.715 1.00 0.00 O ATOM 283 OD2 ASP A 581 11.005 -2.508 9.239 1.00 0.00 O ATOM 0 H ASP A 581 12.296 0.171 5.674 1.00 0.00 H new ATOM 0 HA ASP A 581 12.308 0.925 8.401 1.00 0.00 H new ATOM 0 HB2 ASP A 581 10.360 -0.048 7.293 1.00 0.00 H new ATOM 0 HB3 ASP A 581 11.246 -1.512 6.920 1.00 0.00 H new ATOM 288 N ARG A 582 14.013 -1.778 7.569 1.00 0.00 N ATOM 289 CA ARG A 582 15.075 -2.660 8.011 1.00 0.00 C ATOM 290 C ARG A 582 16.327 -1.851 8.260 1.00 0.00 C ATOM 291 O ARG A 582 16.747 -1.680 9.398 1.00 0.00 O ATOM 292 CB ARG A 582 15.382 -3.734 6.957 1.00 0.00 C ATOM 293 CG ARG A 582 14.259 -4.700 6.665 1.00 0.00 C ATOM 294 CD ARG A 582 13.923 -5.541 7.867 1.00 0.00 C ATOM 295 NE ARG A 582 12.854 -6.488 7.577 1.00 0.00 N ATOM 296 CZ ARG A 582 11.828 -6.767 8.383 1.00 0.00 C ATOM 297 NH1 ARG A 582 11.647 -6.071 9.498 1.00 0.00 N ATOM 298 NH2 ARG A 582 10.971 -7.723 8.049 1.00 0.00 N ATOM 0 H ARG A 582 13.691 -1.948 6.616 1.00 0.00 H new ATOM 0 HA ARG A 582 14.747 -3.152 8.927 1.00 0.00 H new ATOM 0 HB2 ARG A 582 15.661 -3.237 6.028 1.00 0.00 H new ATOM 0 HB3 ARG A 582 16.251 -4.304 7.287 1.00 0.00 H new ATOM 0 HG2 ARG A 582 13.375 -4.146 6.350 1.00 0.00 H new ATOM 0 HG3 ARG A 582 14.542 -5.348 5.835 1.00 0.00 H new ATOM 0 HD2 ARG A 582 14.811 -6.082 8.193 1.00 0.00 H new ATOM 0 HD3 ARG A 582 13.623 -4.895 8.692 1.00 0.00 H new ATOM 0 HE ARG A 582 12.893 -6.978 6.683 1.00 0.00 H new ATOM 0 HH11 ARG A 582 12.293 -5.320 9.741 1.00 0.00 H new ATOM 0 HH12 ARG A 582 10.862 -6.287 10.112 1.00 0.00 H new ATOM 0 HH21 ARG A 582 11.098 -8.241 7.179 1.00 0.00 H new ATOM 0 HH22 ARG A 582 10.185 -7.940 8.662 1.00 0.00 H new ATOM 312 N LYS A 583 16.885 -1.342 7.174 1.00 0.00 N ATOM 313 CA LYS A 583 18.107 -0.566 7.170 1.00 0.00 C ATOM 314 C LYS A 583 19.216 -1.308 7.895 1.00 0.00 C ATOM 315 O LYS A 583 19.574 -1.012 9.044 1.00 0.00 O ATOM 316 CB LYS A 583 17.911 0.878 7.662 1.00 0.00 C ATOM 317 CG LYS A 583 19.141 1.754 7.477 1.00 0.00 C ATOM 318 CD LYS A 583 18.874 3.217 7.802 1.00 0.00 C ATOM 319 CE LYS A 583 18.496 3.439 9.258 1.00 0.00 C ATOM 320 NZ LYS A 583 18.382 4.882 9.566 1.00 0.00 N ATOM 0 H LYS A 583 16.485 -1.463 6.244 1.00 0.00 H new ATOM 0 HA LYS A 583 18.420 -0.455 6.132 1.00 0.00 H new ATOM 0 HB2 LYS A 583 17.073 1.325 7.128 1.00 0.00 H new ATOM 0 HB3 LYS A 583 17.643 0.860 8.718 1.00 0.00 H new ATOM 0 HG2 LYS A 583 19.944 1.385 8.115 1.00 0.00 H new ATOM 0 HG3 LYS A 583 19.489 1.672 6.447 1.00 0.00 H new ATOM 0 HD2 LYS A 583 19.762 3.804 7.569 1.00 0.00 H new ATOM 0 HD3 LYS A 583 18.072 3.586 7.163 1.00 0.00 H new ATOM 0 HE2 LYS A 583 17.549 2.943 9.471 1.00 0.00 H new ATOM 0 HE3 LYS A 583 19.246 2.984 9.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 18.123 5.004 10.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 19.294 5.349 9.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 17.649 5.309 8.964 1.00 0.00 H new ATOM 334 N LYS A 584 19.654 -2.338 7.254 1.00 0.00 N ATOM 335 CA LYS A 584 20.713 -3.163 7.738 1.00 0.00 C ATOM 336 C LYS A 584 21.815 -3.105 6.702 1.00 0.00 C ATOM 337 O LYS A 584 21.541 -2.765 5.547 1.00 0.00 O ATOM 338 CB LYS A 584 20.208 -4.610 8.013 1.00 0.00 C ATOM 339 CG LYS A 584 19.604 -5.319 6.810 1.00 0.00 C ATOM 340 CD LYS A 584 19.113 -6.733 7.134 1.00 0.00 C ATOM 341 CE LYS A 584 17.759 -6.721 7.816 1.00 0.00 C ATOM 342 NZ LYS A 584 17.404 -8.040 8.391 1.00 0.00 N ATOM 0 H LYS A 584 19.277 -2.639 6.355 1.00 0.00 H new ATOM 0 HA LYS A 584 21.096 -2.809 8.695 1.00 0.00 H new ATOM 0 HB2 LYS A 584 21.042 -5.205 8.386 1.00 0.00 H new ATOM 0 HB3 LYS A 584 19.462 -4.574 8.807 1.00 0.00 H new ATOM 0 HG2 LYS A 584 18.771 -4.729 6.428 1.00 0.00 H new ATOM 0 HG3 LYS A 584 20.348 -5.372 6.015 1.00 0.00 H new ATOM 0 HD2 LYS A 584 19.051 -7.315 6.214 1.00 0.00 H new ATOM 0 HD3 LYS A 584 19.839 -7.230 7.777 1.00 0.00 H new ATOM 0 HE2 LYS A 584 17.760 -5.971 8.607 1.00 0.00 H new ATOM 0 HE3 LYS A 584 16.996 -6.424 7.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 16.369 -8.143 8.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 17.815 -8.796 7.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 17.778 -8.109 9.359 1.00 0.00 H new ATOM 356 N ASP A 585 23.031 -3.384 7.085 1.00 0.00 N ATOM 357 CA ASP A 585 24.160 -3.206 6.167 1.00 0.00 C ATOM 358 C ASP A 585 24.181 -4.274 5.083 1.00 0.00 C ATOM 359 O ASP A 585 24.518 -4.005 3.932 1.00 0.00 O ATOM 360 CB ASP A 585 25.486 -3.158 6.910 1.00 0.00 C ATOM 361 CG ASP A 585 26.583 -2.554 6.058 1.00 0.00 C ATOM 362 OD1 ASP A 585 26.506 -1.336 5.746 1.00 0.00 O ATOM 363 OD2 ASP A 585 27.520 -3.268 5.653 1.00 0.00 O ATOM 0 H ASP A 585 23.280 -3.732 8.011 1.00 0.00 H new ATOM 0 HA ASP A 585 24.019 -2.243 5.677 1.00 0.00 H new ATOM 0 HB2 ASP A 585 25.371 -2.574 7.823 1.00 0.00 H new ATOM 0 HB3 ASP A 585 25.772 -4.166 7.210 1.00 0.00 H new ATOM 368 N GLN A 586 23.824 -5.472 5.447 1.00 0.00 N ATOM 369 CA GLN A 586 23.725 -6.560 4.494 1.00 0.00 C ATOM 370 C GLN A 586 22.374 -7.210 4.602 1.00 0.00 C ATOM 371 O GLN A 586 21.832 -7.360 5.694 1.00 0.00 O ATOM 372 CB GLN A 586 24.835 -7.618 4.660 1.00 0.00 C ATOM 373 CG GLN A 586 26.250 -7.115 4.402 1.00 0.00 C ATOM 374 CD GLN A 586 27.086 -6.919 5.668 1.00 0.00 C ATOM 375 OE1 GLN A 586 28.316 -7.065 5.637 1.00 0.00 O ATOM 376 NE2 GLN A 586 26.459 -6.589 6.764 1.00 0.00 N ATOM 0 H GLN A 586 23.593 -5.730 6.406 1.00 0.00 H new ATOM 0 HA GLN A 586 23.856 -6.125 3.503 1.00 0.00 H new ATOM 0 HB2 GLN A 586 24.787 -8.017 5.673 1.00 0.00 H new ATOM 0 HB3 GLN A 586 24.631 -8.446 3.981 1.00 0.00 H new ATOM 0 HG2 GLN A 586 26.761 -7.822 3.748 1.00 0.00 H new ATOM 0 HG3 GLN A 586 26.195 -6.167 3.866 1.00 0.00 H new ATOM 0 HE21 GLN A 586 25.445 -6.476 6.757 1.00 0.00 H new ATOM 0 HE22 GLN A 586 26.983 -6.444 7.627 1.00 0.00 H new ATOM 385 N TYR A 587 21.845 -7.603 3.489 1.00 0.00 N ATOM 386 CA TYR A 587 20.560 -8.216 3.408 1.00 0.00 C ATOM 387 C TYR A 587 20.700 -9.553 2.766 1.00 0.00 C ATOM 388 O TYR A 587 21.274 -9.672 1.681 1.00 0.00 O ATOM 389 CB TYR A 587 19.583 -7.384 2.579 1.00 0.00 C ATOM 390 CG TYR A 587 19.119 -6.084 3.164 1.00 0.00 C ATOM 391 CD1 TYR A 587 19.901 -4.952 3.088 1.00 0.00 C ATOM 392 CD2 TYR A 587 17.860 -5.972 3.730 1.00 0.00 C ATOM 393 CE1 TYR A 587 19.452 -3.752 3.577 1.00 0.00 C ATOM 394 CE2 TYR A 587 17.399 -4.773 4.207 1.00 0.00 C ATOM 395 CZ TYR A 587 18.203 -3.663 4.133 1.00 0.00 C ATOM 396 OH TYR A 587 17.752 -2.454 4.608 1.00 0.00 O ATOM 0 H TYR A 587 22.308 -7.503 2.586 1.00 0.00 H new ATOM 0 HA TYR A 587 20.167 -8.301 4.421 1.00 0.00 H new ATOM 0 HB2 TYR A 587 20.051 -7.173 1.617 1.00 0.00 H new ATOM 0 HB3 TYR A 587 18.704 -7.997 2.378 1.00 0.00 H new ATOM 0 HD1 TYR A 587 20.881 -5.011 2.637 1.00 0.00 H new ATOM 0 HD2 TYR A 587 17.230 -6.846 3.797 1.00 0.00 H new ATOM 0 HE1 TYR A 587 20.083 -2.877 3.524 1.00 0.00 H new ATOM 0 HE2 TYR A 587 16.411 -4.702 4.638 1.00 0.00 H new ATOM 0 HH TYR A 587 16.860 -2.272 4.244 1.00 0.00 H new ATOM 406 N LYS A 588 20.196 -10.537 3.431 1.00 0.00 N ATOM 407 CA LYS A 588 20.185 -11.890 2.937 1.00 0.00 C ATOM 408 C LYS A 588 19.208 -11.946 1.774 1.00 0.00 C ATOM 409 O LYS A 588 18.226 -11.197 1.751 1.00 0.00 O ATOM 410 CB LYS A 588 19.641 -12.815 4.025 1.00 0.00 C ATOM 411 CG LYS A 588 20.210 -12.585 5.401 1.00 0.00 C ATOM 412 CD LYS A 588 19.432 -13.363 6.441 1.00 0.00 C ATOM 413 CE LYS A 588 19.765 -12.895 7.848 1.00 0.00 C ATOM 414 NZ LYS A 588 19.479 -11.445 8.020 1.00 0.00 N ATOM 0 H LYS A 588 19.770 -10.431 4.352 1.00 0.00 H new ATOM 0 HA LYS A 588 21.190 -12.191 2.643 1.00 0.00 H new ATOM 0 HB2 LYS A 588 18.558 -12.698 4.072 1.00 0.00 H new ATOM 0 HB3 LYS A 588 19.838 -13.847 3.735 1.00 0.00 H new ATOM 0 HG2 LYS A 588 21.257 -12.888 5.422 1.00 0.00 H new ATOM 0 HG3 LYS A 588 20.181 -11.522 5.639 1.00 0.00 H new ATOM 0 HD2 LYS A 588 18.363 -13.246 6.261 1.00 0.00 H new ATOM 0 HD3 LYS A 588 19.657 -14.425 6.347 1.00 0.00 H new ATOM 0 HE2 LYS A 588 19.186 -13.470 8.571 1.00 0.00 H new ATOM 0 HE3 LYS A 588 20.817 -13.087 8.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 19.138 -11.271 8.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 20.348 -10.898 7.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 18.750 -11.152 7.338 1.00 0.00 H new ATOM 428 N VAL A 589 19.440 -12.786 0.832 1.00 0.00 N ATOM 429 CA VAL A 589 18.470 -12.951 -0.221 1.00 0.00 C ATOM 430 C VAL A 589 17.249 -13.675 0.331 1.00 0.00 C ATOM 431 O VAL A 589 17.347 -14.777 0.888 1.00 0.00 O ATOM 432 CB VAL A 589 19.057 -13.569 -1.537 1.00 0.00 C ATOM 433 CG1 VAL A 589 20.145 -14.532 -1.223 1.00 0.00 C ATOM 434 CG2 VAL A 589 17.983 -14.251 -2.383 1.00 0.00 C ATOM 0 H VAL A 589 20.275 -13.367 0.756 1.00 0.00 H new ATOM 0 HA VAL A 589 18.149 -11.964 -0.553 1.00 0.00 H new ATOM 0 HB VAL A 589 19.464 -12.744 -2.122 1.00 0.00 H new ATOM 0 HG11 VAL A 589 20.539 -14.950 -2.149 1.00 0.00 H new ATOM 0 HG12 VAL A 589 20.943 -14.017 -0.688 1.00 0.00 H new ATOM 0 HG13 VAL A 589 19.751 -15.336 -0.601 1.00 0.00 H new ATOM 0 HG21 VAL A 589 18.437 -14.664 -3.284 1.00 0.00 H new ATOM 0 HG22 VAL A 589 17.523 -15.054 -1.808 1.00 0.00 H new ATOM 0 HG23 VAL A 589 17.222 -13.522 -2.662 1.00 0.00 H new ATOM 438 N GLY A 590 16.131 -13.008 0.240 1.00 0.00 N ATOM 439 CA GLY A 590 14.913 -13.468 0.833 1.00 0.00 C ATOM 440 C GLY A 590 14.442 -12.503 1.903 1.00 0.00 C ATOM 441 O GLY A 590 13.321 -12.621 2.395 1.00 0.00 O ATOM 0 H GLY A 590 16.043 -12.120 -0.254 1.00 0.00 H new ATOM 0 HA2 GLY A 590 14.145 -13.572 0.066 1.00 0.00 H new ATOM 0 HA3 GLY A 590 15.065 -14.456 1.268 1.00 0.00 H new ATOM 445 N GLU A 591 15.315 -11.551 2.274 1.00 0.00 N ATOM 446 CA GLU A 591 14.945 -10.494 3.226 1.00 0.00 C ATOM 447 C GLU A 591 13.932 -9.592 2.596 1.00 0.00 C ATOM 448 O GLU A 591 14.020 -9.303 1.399 1.00 0.00 O ATOM 449 CB GLU A 591 16.153 -9.638 3.616 1.00 0.00 C ATOM 450 CG GLU A 591 17.183 -10.345 4.445 1.00 0.00 C ATOM 451 CD GLU A 591 16.771 -10.600 5.854 1.00 0.00 C ATOM 452 OE1 GLU A 591 15.797 -11.313 6.085 1.00 0.00 O ATOM 453 OE2 GLU A 591 17.442 -10.092 6.767 1.00 0.00 O ATOM 0 H GLU A 591 16.274 -11.493 1.931 1.00 0.00 H new ATOM 0 HA GLU A 591 14.547 -10.979 4.117 1.00 0.00 H new ATOM 0 HB2 GLU A 591 16.629 -9.270 2.707 1.00 0.00 H new ATOM 0 HB3 GLU A 591 15.800 -8.766 4.166 1.00 0.00 H new ATOM 0 HG2 GLU A 591 17.422 -11.297 3.971 1.00 0.00 H new ATOM 0 HG3 GLU A 591 18.098 -9.753 4.449 1.00 0.00 H new ATOM 460 N VAL A 592 12.991 -9.149 3.364 1.00 0.00 N ATOM 461 CA VAL A 592 12.002 -8.243 2.877 1.00 0.00 C ATOM 462 C VAL A 592 12.172 -6.955 3.622 1.00 0.00 C ATOM 463 O VAL A 592 12.014 -6.898 4.852 1.00 0.00 O ATOM 464 CB VAL A 592 10.554 -8.760 3.065 1.00 0.00 C ATOM 465 CG1 VAL A 592 9.562 -7.875 2.336 1.00 0.00 C ATOM 466 CG2 VAL A 592 10.426 -10.209 2.643 1.00 0.00 C ATOM 0 H VAL A 592 12.886 -9.404 4.346 1.00 0.00 H new ATOM 0 HA VAL A 592 12.145 -8.121 1.803 1.00 0.00 H new ATOM 0 HB VAL A 592 10.317 -8.713 4.128 1.00 0.00 H new ATOM 0 HG11 VAL A 592 8.553 -8.260 2.484 1.00 0.00 H new ATOM 0 HG12 VAL A 592 9.624 -6.860 2.728 1.00 0.00 H new ATOM 0 HG13 VAL A 592 9.795 -7.868 1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 592 9.398 -10.541 2.788 1.00 0.00 H new ATOM 0 HG22 VAL A 592 10.694 -10.307 1.591 1.00 0.00 H new ATOM 0 HG23 VAL A 592 11.094 -10.824 3.246 1.00 0.00 H new ATOM 470 N LEU A 593 12.536 -5.951 2.916 1.00 0.00 N ATOM 471 CA LEU A 593 12.751 -4.681 3.496 1.00 0.00 C ATOM 472 C LEU A 593 11.659 -3.758 3.175 1.00 0.00 C ATOM 473 O LEU A 593 11.448 -3.385 2.023 1.00 0.00 O ATOM 474 CB LEU A 593 14.136 -4.054 3.216 1.00 0.00 C ATOM 475 CG LEU A 593 14.702 -4.263 1.862 1.00 0.00 C ATOM 476 CD1 LEU A 593 15.807 -3.276 1.600 1.00 0.00 C ATOM 477 CD2 LEU A 593 15.224 -5.675 1.678 1.00 0.00 C ATOM 0 H LEU A 593 12.695 -5.988 1.909 1.00 0.00 H new ATOM 0 HA LEU A 593 12.753 -4.862 4.571 1.00 0.00 H new ATOM 0 HB2 LEU A 593 14.065 -2.981 3.393 1.00 0.00 H new ATOM 0 HB3 LEU A 593 14.843 -4.451 3.945 1.00 0.00 H new ATOM 0 HG LEU A 593 13.895 -4.108 1.146 1.00 0.00 H new ATOM 0 HD11 LEU A 593 16.213 -3.441 0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 593 15.413 -2.262 1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 593 16.596 -3.409 2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 593 15.630 -5.785 0.672 1.00 0.00 H new ATOM 0 HD22 LEU A 593 16.008 -5.871 2.409 1.00 0.00 H new ATOM 0 HD23 LEU A 593 14.410 -6.385 1.820 1.00 0.00 H new ATOM 489 N LYS A 594 10.907 -3.470 4.185 1.00 0.00 N ATOM 490 CA LYS A 594 9.886 -2.504 4.104 1.00 0.00 C ATOM 491 C LYS A 594 10.522 -1.150 4.045 1.00 0.00 C ATOM 492 O LYS A 594 11.580 -0.933 4.637 1.00 0.00 O ATOM 493 CB LYS A 594 8.992 -2.605 5.310 1.00 0.00 C ATOM 494 CG LYS A 594 8.177 -3.869 5.324 1.00 0.00 C ATOM 495 CD LYS A 594 7.367 -3.982 6.580 1.00 0.00 C ATOM 496 CE LYS A 594 6.380 -2.832 6.743 1.00 0.00 C ATOM 497 NZ LYS A 594 5.550 -2.993 7.954 1.00 0.00 N ATOM 0 H LYS A 594 10.994 -3.912 5.100 1.00 0.00 H new ATOM 0 HA LYS A 594 9.281 -2.668 3.212 1.00 0.00 H new ATOM 0 HB2 LYS A 594 9.601 -2.560 6.213 1.00 0.00 H new ATOM 0 HB3 LYS A 594 8.322 -1.745 5.334 1.00 0.00 H new ATOM 0 HG2 LYS A 594 7.514 -3.886 4.459 1.00 0.00 H new ATOM 0 HG3 LYS A 594 8.838 -4.731 5.236 1.00 0.00 H new ATOM 0 HD2 LYS A 594 6.822 -4.926 6.574 1.00 0.00 H new ATOM 0 HD3 LYS A 594 8.037 -4.006 7.440 1.00 0.00 H new ATOM 0 HE2 LYS A 594 6.925 -1.890 6.798 1.00 0.00 H new ATOM 0 HE3 LYS A 594 5.736 -2.777 5.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 4.891 -2.192 8.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 5.011 -3.880 7.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 6.163 -3.020 8.794 1.00 0.00 H new ATOM 511 N PHE A 595 9.977 -0.298 3.285 1.00 0.00 N ATOM 512 CA PHE A 595 10.448 1.045 3.223 1.00 0.00 C ATOM 513 C PHE A 595 9.398 1.983 3.757 1.00 0.00 C ATOM 514 O PHE A 595 8.293 1.563 4.121 1.00 0.00 O ATOM 515 CB PHE A 595 10.802 1.429 1.795 1.00 0.00 C ATOM 516 CG PHE A 595 11.862 0.582 1.175 1.00 0.00 C ATOM 517 CD1 PHE A 595 13.155 0.598 1.662 1.00 0.00 C ATOM 518 CD2 PHE A 595 11.565 -0.236 0.115 1.00 0.00 C ATOM 519 CE1 PHE A 595 14.130 -0.186 1.096 1.00 0.00 C ATOM 520 CE2 PHE A 595 12.529 -1.019 -0.457 1.00 0.00 C ATOM 521 CZ PHE A 595 13.815 -0.998 0.030 1.00 0.00 C ATOM 0 H PHE A 595 9.183 -0.498 2.676 1.00 0.00 H new ATOM 0 HA PHE A 595 11.347 1.121 3.835 1.00 0.00 H new ATOM 0 HB2 PHE A 595 9.902 1.371 1.182 1.00 0.00 H new ATOM 0 HB3 PHE A 595 11.130 2.468 1.782 1.00 0.00 H new ATOM 0 HD1 PHE A 595 13.402 1.235 2.498 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.557 -0.262 -0.273 1.00 0.00 H new ATOM 0 HE1 PHE A 595 15.137 -0.166 1.485 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.280 -1.655 -1.293 1.00 0.00 H new ATOM 0 HZ PHE A 595 14.576 -1.617 -0.423 1.00 0.00 H new ATOM 531 N SER A 596 9.744 3.227 3.791 1.00 0.00 N ATOM 532 CA SER A 596 8.915 4.284 4.203 1.00 0.00 C ATOM 533 C SER A 596 9.582 5.529 3.676 1.00 0.00 C ATOM 534 O SER A 596 10.729 5.455 3.247 1.00 0.00 O ATOM 535 CB SER A 596 8.792 4.285 5.744 1.00 0.00 C ATOM 536 OG SER A 596 10.068 4.131 6.374 1.00 0.00 O ATOM 0 H SER A 596 10.674 3.540 3.512 1.00 0.00 H new ATOM 0 HA SER A 596 7.896 4.205 3.824 1.00 0.00 H new ATOM 0 HB2 SER A 596 8.334 5.218 6.072 1.00 0.00 H new ATOM 0 HB3 SER A 596 8.131 3.477 6.057 1.00 0.00 H new ATOM 0 HG SER A 596 10.747 3.937 5.695 1.00 0.00 H new ATOM 542 N CYS A 597 8.904 6.598 3.641 1.00 0.00 N ATOM 543 CA CYS A 597 9.489 7.841 3.197 1.00 0.00 C ATOM 544 C CYS A 597 9.598 8.805 4.363 1.00 0.00 C ATOM 545 O CYS A 597 9.271 8.451 5.517 1.00 0.00 O ATOM 546 CB CYS A 597 8.640 8.474 2.081 1.00 0.00 C ATOM 547 SG CYS A 597 8.654 7.570 0.504 1.00 0.00 S ATOM 0 H CYS A 597 7.924 6.664 3.915 1.00 0.00 H new ATOM 0 HA CYS A 597 10.483 7.632 2.803 1.00 0.00 H new ATOM 0 HB2 CYS A 597 7.610 8.553 2.429 1.00 0.00 H new ATOM 0 HB3 CYS A 597 8.996 9.489 1.905 1.00 0.00 H new ATOM 552 N LYS A 598 10.096 9.995 4.082 1.00 0.00 N ATOM 553 CA LYS A 598 10.140 11.074 5.028 1.00 0.00 C ATOM 554 C LYS A 598 8.741 11.403 5.549 1.00 0.00 C ATOM 555 O LYS A 598 7.742 11.060 4.896 1.00 0.00 O ATOM 556 CB LYS A 598 10.789 12.313 4.407 1.00 0.00 C ATOM 557 CG LYS A 598 12.297 12.254 4.345 1.00 0.00 C ATOM 558 CD LYS A 598 12.904 12.012 5.726 1.00 0.00 C ATOM 559 CE LYS A 598 14.425 12.046 5.701 1.00 0.00 C ATOM 560 NZ LYS A 598 14.961 13.408 5.478 1.00 0.00 N ATOM 0 H LYS A 598 10.486 10.234 3.171 1.00 0.00 H new ATOM 0 HA LYS A 598 10.749 10.755 5.874 1.00 0.00 H new ATOM 0 HB2 LYS A 598 10.400 12.447 3.398 1.00 0.00 H new ATOM 0 HB3 LYS A 598 10.494 13.191 4.981 1.00 0.00 H new ATOM 0 HG2 LYS A 598 12.604 11.458 3.667 1.00 0.00 H new ATOM 0 HG3 LYS A 598 12.682 13.188 3.935 1.00 0.00 H new ATOM 0 HD2 LYS A 598 12.537 12.769 6.420 1.00 0.00 H new ATOM 0 HD3 LYS A 598 12.570 11.045 6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 598 14.809 11.659 6.645 1.00 0.00 H new ATOM 0 HE3 LYS A 598 14.787 11.384 4.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 15.997 13.393 5.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 14.704 13.730 4.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 14.560 14.059 6.183 1.00 0.00 H new ATOM 574 N PRO A 599 8.662 12.067 6.715 1.00 0.00 N ATOM 575 CA PRO A 599 7.399 12.389 7.400 1.00 0.00 C ATOM 576 C PRO A 599 6.324 12.974 6.483 1.00 0.00 C ATOM 577 O PRO A 599 5.170 12.527 6.504 1.00 0.00 O ATOM 578 CB PRO A 599 7.816 13.426 8.439 1.00 0.00 C ATOM 579 CG PRO A 599 9.233 13.105 8.742 1.00 0.00 C ATOM 580 CD PRO A 599 9.824 12.566 7.474 1.00 0.00 C ATOM 0 HA PRO A 599 6.942 11.488 7.810 1.00 0.00 H new ATOM 0 HB2 PRO A 599 7.714 14.439 8.051 1.00 0.00 H new ATOM 0 HB3 PRO A 599 7.196 13.363 9.333 1.00 0.00 H new ATOM 0 HG2 PRO A 599 9.770 13.993 9.074 1.00 0.00 H new ATOM 0 HG3 PRO A 599 9.302 12.372 9.545 1.00 0.00 H new ATOM 0 HD2 PRO A 599 10.357 13.341 6.922 1.00 0.00 H new ATOM 0 HD3 PRO A 599 10.540 11.769 7.676 1.00 0.00 H new ATOM 588 N GLY A 600 6.722 13.909 5.645 1.00 0.00 N ATOM 589 CA GLY A 600 5.787 14.594 4.797 1.00 0.00 C ATOM 590 C GLY A 600 5.597 13.920 3.470 1.00 0.00 C ATOM 591 O GLY A 600 4.782 14.349 2.663 1.00 0.00 O ATOM 0 H GLY A 600 7.691 14.208 5.538 1.00 0.00 H new ATOM 0 HA2 GLY A 600 4.825 14.661 5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 600 6.133 15.615 4.634 1.00 0.00 H new ATOM 595 N PHE A 601 6.315 12.859 3.235 1.00 0.00 N ATOM 596 CA PHE A 601 6.203 12.175 1.994 1.00 0.00 C ATOM 597 C PHE A 601 5.290 11.001 2.081 1.00 0.00 C ATOM 598 O PHE A 601 4.715 10.707 3.129 1.00 0.00 O ATOM 599 CB PHE A 601 7.562 11.789 1.411 1.00 0.00 C ATOM 600 CG PHE A 601 8.214 12.909 0.682 1.00 0.00 C ATOM 601 CD1 PHE A 601 8.826 13.937 1.357 1.00 0.00 C ATOM 602 CD2 PHE A 601 8.190 12.934 -0.694 1.00 0.00 C ATOM 603 CE1 PHE A 601 9.401 14.979 0.672 1.00 0.00 C ATOM 604 CE2 PHE A 601 8.763 13.963 -1.390 1.00 0.00 C ATOM 605 CZ PHE A 601 9.371 14.993 -0.709 1.00 0.00 C ATOM 0 H PHE A 601 6.983 12.454 3.892 1.00 0.00 H new ATOM 0 HA PHE A 601 5.753 12.883 1.298 1.00 0.00 H new ATOM 0 HB2 PHE A 601 8.216 11.456 2.216 1.00 0.00 H new ATOM 0 HB3 PHE A 601 7.435 10.945 0.733 1.00 0.00 H new ATOM 0 HD1 PHE A 601 8.855 13.926 2.437 1.00 0.00 H new ATOM 0 HD2 PHE A 601 7.712 12.129 -1.232 1.00 0.00 H new ATOM 0 HE1 PHE A 601 9.875 15.785 1.211 1.00 0.00 H new ATOM 0 HE2 PHE A 601 8.738 13.967 -2.470 1.00 0.00 H new ATOM 0 HZ PHE A 601 9.823 15.809 -1.253 1.00 0.00 H new ATOM 615 N THR A 602 5.154 10.355 0.985 1.00 0.00 N ATOM 616 CA THR A 602 4.321 9.229 0.851 1.00 0.00 C ATOM 617 C THR A 602 5.076 8.209 0.066 1.00 0.00 C ATOM 618 O THR A 602 5.629 8.547 -0.980 1.00 0.00 O ATOM 619 CB THR A 602 3.063 9.607 0.073 1.00 0.00 C ATOM 620 OG1 THR A 602 2.360 10.649 0.754 1.00 0.00 O ATOM 621 CG2 THR A 602 2.170 8.401 -0.131 1.00 0.00 C ATOM 0 H THR A 602 5.640 10.609 0.125 1.00 0.00 H new ATOM 0 HA THR A 602 4.035 8.849 1.832 1.00 0.00 H new ATOM 0 HB THR A 602 3.360 9.971 -0.910 1.00 0.00 H new ATOM 0 HG1 THR A 602 1.555 10.886 0.247 1.00 0.00 H new ATOM 0 HG21 THR A 602 1.281 8.697 -0.688 1.00 0.00 H new ATOM 0 HG22 THR A 602 2.711 7.638 -0.690 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.874 7.999 0.838 1.00 0.00 H new ATOM 629 N ILE A 603 5.136 7.015 0.560 1.00 0.00 N ATOM 630 CA ILE A 603 5.805 5.976 -0.149 1.00 0.00 C ATOM 631 C ILE A 603 4.822 5.346 -1.133 1.00 0.00 C ATOM 632 O ILE A 603 3.598 5.376 -0.912 1.00 0.00 O ATOM 633 CB ILE A 603 6.448 4.943 0.796 1.00 0.00 C ATOM 634 CG1 ILE A 603 7.286 3.957 -0.015 1.00 0.00 C ATOM 635 CG2 ILE A 603 5.391 4.238 1.645 1.00 0.00 C ATOM 636 CD1 ILE A 603 8.029 2.967 0.801 1.00 0.00 C ATOM 0 H ILE A 603 4.729 6.736 1.453 1.00 0.00 H new ATOM 0 HA ILE A 603 6.639 6.400 -0.708 1.00 0.00 H new ATOM 0 HB ILE A 603 7.110 5.459 1.492 1.00 0.00 H new ATOM 0 HG12 ILE A 603 6.631 3.423 -0.704 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.998 4.517 -0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 603 5.875 3.515 2.302 1.00 0.00 H new ATOM 0 HG22 ILE A 603 4.857 4.974 2.246 1.00 0.00 H new ATOM 0 HG23 ILE A 603 4.686 3.721 0.993 1.00 0.00 H new ATOM 0 HD11 ILE A 603 8.597 2.307 0.145 1.00 0.00 H new ATOM 0 HD12 ILE A 603 8.713 3.488 1.471 1.00 0.00 H new ATOM 0 HD13 ILE A 603 7.325 2.377 1.388 1.00 0.00 H new ATOM 643 N VAL A 604 5.332 4.851 -2.220 1.00 0.00 N ATOM 644 CA VAL A 604 4.527 4.402 -3.289 1.00 0.00 C ATOM 645 C VAL A 604 4.746 2.898 -3.566 1.00 0.00 C ATOM 646 O VAL A 604 5.796 2.351 -3.251 1.00 0.00 O ATOM 647 CB VAL A 604 4.927 5.215 -4.535 1.00 0.00 C ATOM 648 CG1 VAL A 604 4.964 6.695 -4.230 1.00 0.00 C ATOM 649 CG2 VAL A 604 6.217 4.711 -5.061 1.00 0.00 C ATOM 0 H VAL A 604 6.334 4.751 -2.381 1.00 0.00 H new ATOM 0 HA VAL A 604 3.475 4.540 -3.039 1.00 0.00 H new ATOM 0 HB VAL A 604 4.174 5.083 -5.312 1.00 0.00 H new ATOM 0 HG11 VAL A 604 5.249 7.244 -5.127 1.00 0.00 H new ATOM 0 HG12 VAL A 604 3.978 7.024 -3.901 1.00 0.00 H new ATOM 0 HG13 VAL A 604 5.692 6.886 -3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 604 6.500 5.286 -5.943 1.00 0.00 H new ATOM 0 HG22 VAL A 604 6.987 4.815 -4.297 1.00 0.00 H new ATOM 0 HG23 VAL A 604 6.114 3.660 -5.331 1.00 0.00 H new ATOM 653 N GLY A 605 3.739 2.266 -4.129 1.00 0.00 N ATOM 654 CA GLY A 605 3.851 0.910 -4.657 1.00 0.00 C ATOM 655 C GLY A 605 4.386 -0.175 -3.716 1.00 0.00 C ATOM 656 O GLY A 605 3.812 -0.438 -2.641 1.00 0.00 O ATOM 0 H GLY A 605 2.811 2.675 -4.237 1.00 0.00 H new ATOM 0 HA2 GLY A 605 2.864 0.600 -5.000 1.00 0.00 H new ATOM 0 HA3 GLY A 605 4.498 0.943 -5.534 1.00 0.00 H new ATOM 660 N PRO A 606 5.470 -0.867 -4.142 1.00 0.00 N ATOM 661 CA PRO A 606 6.071 -1.952 -3.386 1.00 0.00 C ATOM 662 C PRO A 606 6.947 -1.445 -2.251 1.00 0.00 C ATOM 663 O PRO A 606 8.118 -1.104 -2.443 1.00 0.00 O ATOM 664 CB PRO A 606 6.912 -2.690 -4.430 1.00 0.00 C ATOM 665 CG PRO A 606 7.320 -1.625 -5.398 1.00 0.00 C ATOM 666 CD PRO A 606 6.197 -0.619 -5.414 1.00 0.00 C ATOM 0 HA PRO A 606 5.322 -2.581 -2.906 1.00 0.00 H new ATOM 0 HB2 PRO A 606 7.780 -3.168 -3.976 1.00 0.00 H new ATOM 0 HB3 PRO A 606 6.337 -3.475 -4.921 1.00 0.00 H new ATOM 0 HG2 PRO A 606 8.256 -1.158 -5.092 1.00 0.00 H new ATOM 0 HG3 PRO A 606 7.482 -2.043 -6.391 1.00 0.00 H new ATOM 0 HD2 PRO A 606 6.577 0.402 -5.464 1.00 0.00 H new ATOM 0 HD3 PRO A 606 5.548 -0.760 -6.278 1.00 0.00 H new ATOM 674 N ASN A 607 6.372 -1.358 -1.082 1.00 0.00 N ATOM 675 CA ASN A 607 7.110 -0.874 0.064 1.00 0.00 C ATOM 676 C ASN A 607 7.971 -1.961 0.630 1.00 0.00 C ATOM 677 O ASN A 607 8.984 -1.699 1.223 1.00 0.00 O ATOM 678 CB ASN A 607 6.200 -0.339 1.171 1.00 0.00 C ATOM 679 CG ASN A 607 5.238 0.723 0.705 1.00 0.00 C ATOM 680 OD1 ASN A 607 5.448 1.381 -0.287 1.00 0.00 O ATOM 681 ND2 ASN A 607 4.221 0.941 1.461 1.00 0.00 N ATOM 0 H ASN A 607 5.402 -1.613 -0.894 1.00 0.00 H new ATOM 0 HA ASN A 607 7.725 -0.049 -0.295 1.00 0.00 H new ATOM 0 HB2 ASN A 607 5.634 -1.168 1.596 1.00 0.00 H new ATOM 0 HB3 ASN A 607 6.818 0.069 1.971 1.00 0.00 H new ATOM 0 HD21 ASN A 607 3.564 1.687 1.230 1.00 0.00 H new ATOM 0 HD22 ASN A 607 4.071 0.368 2.292 1.00 0.00 H new ATOM 688 N SER A 608 7.556 -3.172 0.464 1.00 0.00 N ATOM 689 CA SER A 608 8.282 -4.279 0.973 1.00 0.00 C ATOM 690 C SER A 608 8.848 -5.117 -0.168 1.00 0.00 C ATOM 691 O SER A 608 8.144 -5.949 -0.748 1.00 0.00 O ATOM 692 CB SER A 608 7.353 -5.081 1.874 1.00 0.00 C ATOM 693 OG SER A 608 6.143 -5.408 1.189 1.00 0.00 O ATOM 0 H SER A 608 6.699 -3.419 -0.031 1.00 0.00 H new ATOM 0 HA SER A 608 9.137 -3.942 1.560 1.00 0.00 H new ATOM 0 HB2 SER A 608 7.852 -5.995 2.198 1.00 0.00 H new ATOM 0 HB3 SER A 608 7.125 -4.507 2.772 1.00 0.00 H new ATOM 0 HG SER A 608 6.347 -5.650 0.262 1.00 0.00 H new ATOM 699 N VAL A 609 10.085 -4.854 -0.534 1.00 0.00 N ATOM 700 CA VAL A 609 10.723 -5.599 -1.604 1.00 0.00 C ATOM 701 C VAL A 609 11.602 -6.687 -1.015 1.00 0.00 C ATOM 702 O VAL A 609 12.005 -6.607 0.154 1.00 0.00 O ATOM 703 CB VAL A 609 11.563 -4.698 -2.563 1.00 0.00 C ATOM 704 CG1 VAL A 609 10.709 -3.598 -3.186 1.00 0.00 C ATOM 705 CG2 VAL A 609 12.787 -4.112 -1.867 1.00 0.00 C ATOM 0 H VAL A 609 10.669 -4.133 -0.110 1.00 0.00 H new ATOM 0 HA VAL A 609 9.926 -6.038 -2.205 1.00 0.00 H new ATOM 0 HB VAL A 609 11.922 -5.340 -3.368 1.00 0.00 H new ATOM 0 HG11 VAL A 609 11.325 -2.990 -3.848 1.00 0.00 H new ATOM 0 HG12 VAL A 609 9.897 -4.048 -3.758 1.00 0.00 H new ATOM 0 HG13 VAL A 609 10.293 -2.970 -2.398 1.00 0.00 H new ATOM 0 HG21 VAL A 609 13.343 -3.492 -2.570 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.468 -3.504 -1.020 1.00 0.00 H new ATOM 0 HG23 VAL A 609 13.426 -4.921 -1.512 1.00 0.00 H new ATOM 709 N GLN A 610 11.866 -7.713 -1.784 1.00 0.00 N ATOM 710 CA GLN A 610 12.693 -8.809 -1.324 1.00 0.00 C ATOM 711 C GLN A 610 14.074 -8.682 -1.885 1.00 0.00 C ATOM 712 O GLN A 610 14.284 -8.049 -2.926 1.00 0.00 O ATOM 713 CB GLN A 610 12.170 -10.199 -1.760 1.00 0.00 C ATOM 714 CG GLN A 610 11.134 -10.917 -0.886 1.00 0.00 C ATOM 715 CD GLN A 610 9.700 -10.346 -0.851 1.00 0.00 C ATOM 716 OE1 GLN A 610 8.743 -11.109 -0.740 1.00 0.00 O ATOM 717 NE2 GLN A 610 9.541 -9.064 -0.806 1.00 0.00 N ATOM 0 H GLN A 610 11.520 -7.816 -2.738 1.00 0.00 H new ATOM 0 HA GLN A 610 12.677 -8.746 -0.236 1.00 0.00 H new ATOM 0 HB2 GLN A 610 11.740 -10.090 -2.756 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.032 -10.859 -1.855 1.00 0.00 H new ATOM 0 HG2 GLN A 610 11.074 -11.953 -1.221 1.00 0.00 H new ATOM 0 HG3 GLN A 610 11.512 -10.934 0.136 1.00 0.00 H new ATOM 0 HE21 GLN A 610 10.347 -8.446 -0.900 1.00 0.00 H new ATOM 0 HE22 GLN A 610 8.609 -8.670 -0.676 1.00 0.00 H new ATOM 726 N CYS A 611 15.014 -9.256 -1.208 1.00 0.00 N ATOM 727 CA CYS A 611 16.315 -9.392 -1.783 1.00 0.00 C ATOM 728 C CYS A 611 16.293 -10.613 -2.657 1.00 0.00 C ATOM 729 O CYS A 611 15.949 -11.706 -2.196 1.00 0.00 O ATOM 730 CB CYS A 611 17.433 -9.512 -0.735 1.00 0.00 C ATOM 731 SG CYS A 611 19.106 -9.794 -1.427 1.00 0.00 S ATOM 0 H CYS A 611 14.910 -9.635 -0.267 1.00 0.00 H new ATOM 0 HA CYS A 611 16.539 -8.490 -2.352 1.00 0.00 H new ATOM 0 HB2 CYS A 611 17.451 -8.601 -0.137 1.00 0.00 H new ATOM 0 HB3 CYS A 611 17.192 -10.332 -0.059 1.00 0.00 H new ATOM 736 N TYR A 612 16.557 -10.429 -3.898 1.00 0.00 N ATOM 737 CA TYR A 612 16.660 -11.506 -4.816 1.00 0.00 C ATOM 738 C TYR A 612 18.119 -11.788 -5.029 1.00 0.00 C ATOM 739 O TYR A 612 18.960 -10.974 -4.652 1.00 0.00 O ATOM 740 CB TYR A 612 15.986 -11.164 -6.148 1.00 0.00 C ATOM 741 CG TYR A 612 14.473 -11.292 -6.143 1.00 0.00 C ATOM 742 CD1 TYR A 612 13.670 -10.442 -5.403 1.00 0.00 C ATOM 743 CD2 TYR A 612 13.853 -12.288 -6.884 1.00 0.00 C ATOM 744 CE1 TYR A 612 12.298 -10.579 -5.406 1.00 0.00 C ATOM 745 CE2 TYR A 612 12.483 -12.430 -6.890 1.00 0.00 C ATOM 746 CZ TYR A 612 11.710 -11.570 -6.149 1.00 0.00 C ATOM 747 OH TYR A 612 10.336 -11.708 -6.147 1.00 0.00 O ATOM 0 H TYR A 612 16.711 -9.510 -4.313 1.00 0.00 H new ATOM 0 HA TYR A 612 16.153 -12.383 -4.413 1.00 0.00 H new ATOM 0 HB2 TYR A 612 16.250 -10.143 -6.422 1.00 0.00 H new ATOM 0 HB3 TYR A 612 16.390 -11.816 -6.922 1.00 0.00 H new ATOM 0 HD1 TYR A 612 14.125 -9.659 -4.814 1.00 0.00 H new ATOM 0 HD2 TYR A 612 14.457 -12.966 -7.468 1.00 0.00 H new ATOM 0 HE1 TYR A 612 11.687 -9.906 -4.823 1.00 0.00 H new ATOM 0 HE2 TYR A 612 12.020 -13.212 -7.473 1.00 0.00 H new ATOM 0 HH TYR A 612 10.082 -12.457 -6.725 1.00 0.00 H new ATOM 757 N HIS A 613 18.422 -12.906 -5.646 1.00 0.00 N ATOM 758 CA HIS A 613 19.809 -13.332 -5.903 1.00 0.00 C ATOM 759 C HIS A 613 20.625 -12.259 -6.656 1.00 0.00 C ATOM 760 O HIS A 613 21.842 -12.181 -6.509 1.00 0.00 O ATOM 761 CB HIS A 613 19.850 -14.674 -6.690 1.00 0.00 C ATOM 762 CG HIS A 613 19.406 -14.597 -8.139 1.00 0.00 C ATOM 763 ND1 HIS A 613 20.248 -14.855 -9.191 1.00 0.00 N ATOM 764 CD2 HIS A 613 18.212 -14.276 -8.696 1.00 0.00 C ATOM 765 CE1 HIS A 613 19.606 -14.686 -10.326 1.00 0.00 C ATOM 766 NE2 HIS A 613 18.366 -14.335 -10.055 1.00 0.00 N ATOM 0 H HIS A 613 17.721 -13.561 -5.992 1.00 0.00 H new ATOM 0 HA HIS A 613 20.270 -13.477 -4.926 1.00 0.00 H new ATOM 0 HB2 HIS A 613 20.869 -15.061 -6.661 1.00 0.00 H new ATOM 0 HB3 HIS A 613 19.219 -15.397 -6.173 1.00 0.00 H new ATOM 0 HD2 HIS A 613 17.307 -14.021 -8.165 1.00 0.00 H new ATOM 0 HE1 HIS A 613 20.025 -14.813 -11.313 1.00 0.00 H new ATOM 0 HE2 HIS A 613 17.640 -14.139 -10.744 1.00 0.00 H new ATOM 775 N PHE A 614 19.936 -11.423 -7.422 1.00 0.00 N ATOM 776 CA PHE A 614 20.594 -10.444 -8.247 1.00 0.00 C ATOM 777 C PHE A 614 20.398 -9.031 -7.701 1.00 0.00 C ATOM 778 O PHE A 614 20.772 -8.054 -8.337 1.00 0.00 O ATOM 779 CB PHE A 614 20.113 -10.557 -9.705 1.00 0.00 C ATOM 780 CG PHE A 614 18.733 -10.027 -9.988 1.00 0.00 C ATOM 781 CD1 PHE A 614 17.608 -10.555 -9.377 1.00 0.00 C ATOM 782 CD2 PHE A 614 18.575 -8.990 -10.880 1.00 0.00 C ATOM 783 CE1 PHE A 614 16.369 -10.058 -9.655 1.00 0.00 C ATOM 784 CE2 PHE A 614 17.335 -8.491 -11.165 1.00 0.00 C ATOM 785 CZ PHE A 614 16.226 -9.023 -10.553 1.00 0.00 C ATOM 0 H PHE A 614 18.918 -11.411 -7.482 1.00 0.00 H new ATOM 0 HA PHE A 614 21.664 -10.649 -8.227 1.00 0.00 H new ATOM 0 HB2 PHE A 614 20.821 -10.028 -10.342 1.00 0.00 H new ATOM 0 HB3 PHE A 614 20.144 -11.607 -9.997 1.00 0.00 H new ATOM 0 HD1 PHE A 614 17.713 -11.368 -8.674 1.00 0.00 H new ATOM 0 HD2 PHE A 614 19.443 -8.565 -11.361 1.00 0.00 H new ATOM 0 HE1 PHE A 614 15.499 -10.476 -9.171 1.00 0.00 H new ATOM 0 HE2 PHE A 614 17.227 -7.680 -11.870 1.00 0.00 H new ATOM 0 HZ PHE A 614 15.245 -8.631 -10.775 1.00 0.00 H new ATOM 795 N GLY A 615 19.832 -8.931 -6.519 1.00 0.00 N ATOM 796 CA GLY A 615 19.607 -7.644 -5.929 1.00 0.00 C ATOM 797 C GLY A 615 18.200 -7.491 -5.442 1.00 0.00 C ATOM 798 O GLY A 615 17.411 -8.418 -5.538 1.00 0.00 O ATOM 0 H GLY A 615 19.523 -9.723 -5.956 1.00 0.00 H new ATOM 0 HA2 GLY A 615 20.297 -7.501 -5.097 1.00 0.00 H new ATOM 0 HA3 GLY A 615 19.824 -6.866 -6.661 1.00 0.00 H new ATOM 802 N LEU A 616 17.879 -6.330 -4.926 1.00 0.00 N ATOM 803 CA LEU A 616 16.553 -6.076 -4.405 1.00 0.00 C ATOM 804 C LEU A 616 15.554 -6.012 -5.540 1.00 0.00 C ATOM 805 O LEU A 616 15.794 -5.335 -6.548 1.00 0.00 O ATOM 806 CB LEU A 616 16.513 -4.769 -3.622 1.00 0.00 C ATOM 807 CG LEU A 616 17.334 -4.714 -2.348 1.00 0.00 C ATOM 808 CD1 LEU A 616 17.144 -3.385 -1.678 1.00 0.00 C ATOM 809 CD2 LEU A 616 16.935 -5.841 -1.429 1.00 0.00 C ATOM 0 H LEU A 616 18.520 -5.540 -4.854 1.00 0.00 H new ATOM 0 HA LEU A 616 16.294 -6.893 -3.732 1.00 0.00 H new ATOM 0 HB2 LEU A 616 16.851 -3.968 -4.279 1.00 0.00 H new ATOM 0 HB3 LEU A 616 15.475 -4.556 -3.367 1.00 0.00 H new ATOM 0 HG LEU A 616 18.390 -4.830 -2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 616 17.736 -3.351 -0.763 1.00 0.00 H new ATOM 0 HD12 LEU A 616 17.467 -2.590 -2.349 1.00 0.00 H new ATOM 0 HD13 LEU A 616 16.091 -3.248 -1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 616 17.529 -5.794 -0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 616 15.878 -5.750 -1.179 1.00 0.00 H new ATOM 0 HD23 LEU A 616 17.109 -6.795 -1.927 1.00 0.00 H new ATOM 821 N SER A 617 14.482 -6.732 -5.417 1.00 0.00 N ATOM 822 CA SER A 617 13.457 -6.744 -6.418 1.00 0.00 C ATOM 823 C SER A 617 12.073 -6.913 -5.767 1.00 0.00 C ATOM 824 O SER A 617 11.947 -7.576 -4.723 1.00 0.00 O ATOM 825 CB SER A 617 13.762 -7.800 -7.498 1.00 0.00 C ATOM 826 OG SER A 617 14.973 -7.466 -8.157 1.00 0.00 O ATOM 0 H SER A 617 14.291 -7.332 -4.615 1.00 0.00 H new ATOM 0 HA SER A 617 13.440 -5.783 -6.932 1.00 0.00 H new ATOM 0 HB2 SER A 617 13.843 -8.787 -7.044 1.00 0.00 H new ATOM 0 HB3 SER A 617 12.945 -7.846 -8.218 1.00 0.00 H new ATOM 0 HG SER A 617 15.262 -8.220 -8.712 1.00 0.00 H new ATOM 832 N PRO A 618 11.024 -6.263 -6.323 1.00 0.00 N ATOM 833 CA PRO A 618 11.134 -5.411 -7.531 1.00 0.00 C ATOM 834 C PRO A 618 11.920 -4.106 -7.272 1.00 0.00 C ATOM 835 O PRO A 618 12.495 -3.923 -6.188 1.00 0.00 O ATOM 836 CB PRO A 618 9.675 -5.103 -7.881 1.00 0.00 C ATOM 837 CG PRO A 618 8.938 -5.231 -6.593 1.00 0.00 C ATOM 838 CD PRO A 618 9.647 -6.296 -5.801 1.00 0.00 C ATOM 0 HA PRO A 618 11.683 -5.910 -8.330 1.00 0.00 H new ATOM 0 HB2 PRO A 618 9.571 -4.101 -8.298 1.00 0.00 H new ATOM 0 HB3 PRO A 618 9.292 -5.800 -8.627 1.00 0.00 H new ATOM 0 HG2 PRO A 618 8.933 -4.284 -6.053 1.00 0.00 H new ATOM 0 HG3 PRO A 618 7.897 -5.504 -6.767 1.00 0.00 H new ATOM 0 HD2 PRO A 618 9.619 -6.085 -4.732 1.00 0.00 H new ATOM 0 HD3 PRO A 618 9.188 -7.274 -5.945 1.00 0.00 H new ATOM 846 N ASP A 619 11.963 -3.220 -8.261 1.00 0.00 N ATOM 847 CA ASP A 619 12.706 -1.967 -8.115 1.00 0.00 C ATOM 848 C ASP A 619 12.118 -1.127 -6.997 1.00 0.00 C ATOM 849 O ASP A 619 10.915 -1.206 -6.693 1.00 0.00 O ATOM 850 CB ASP A 619 12.812 -1.160 -9.427 1.00 0.00 C ATOM 851 CG ASP A 619 11.511 -0.550 -9.890 1.00 0.00 C ATOM 852 OD1 ASP A 619 10.695 -1.268 -10.480 1.00 0.00 O ATOM 853 OD2 ASP A 619 11.283 0.674 -9.675 1.00 0.00 O ATOM 0 H ASP A 619 11.500 -3.340 -9.162 1.00 0.00 H new ATOM 0 HA ASP A 619 13.728 -2.240 -7.852 1.00 0.00 H new ATOM 0 HB2 ASP A 619 13.545 -0.364 -9.292 1.00 0.00 H new ATOM 0 HB3 ASP A 619 13.192 -1.814 -10.212 1.00 0.00 H new ATOM 858 N LEU A 620 12.958 -0.335 -6.414 1.00 0.00 N ATOM 859 CA LEU A 620 12.650 0.388 -5.215 1.00 0.00 C ATOM 860 C LEU A 620 11.663 1.541 -5.447 1.00 0.00 C ATOM 861 O LEU A 620 11.705 2.229 -6.482 1.00 0.00 O ATOM 862 CB LEU A 620 13.945 0.837 -4.497 1.00 0.00 C ATOM 863 CG LEU A 620 14.903 -0.303 -4.044 1.00 0.00 C ATOM 864 CD1 LEU A 620 15.742 -0.875 -5.189 1.00 0.00 C ATOM 865 CD2 LEU A 620 15.784 0.149 -2.920 1.00 0.00 C ATOM 0 H LEU A 620 13.901 -0.166 -6.764 1.00 0.00 H new ATOM 0 HA LEU A 620 12.128 -0.297 -4.547 1.00 0.00 H new ATOM 0 HB2 LEU A 620 14.494 1.503 -5.163 1.00 0.00 H new ATOM 0 HB3 LEU A 620 13.667 1.421 -3.620 1.00 0.00 H new ATOM 0 HG LEU A 620 14.265 -1.112 -3.690 1.00 0.00 H new ATOM 0 HD11 LEU A 620 16.388 -1.665 -4.807 1.00 0.00 H new ATOM 0 HD12 LEU A 620 15.082 -1.284 -5.954 1.00 0.00 H new ATOM 0 HD13 LEU A 620 16.354 -0.084 -5.622 1.00 0.00 H new ATOM 0 HD21 LEU A 620 16.443 -0.667 -2.623 1.00 0.00 H new ATOM 0 HD22 LEU A 620 16.383 0.999 -3.247 1.00 0.00 H new ATOM 0 HD23 LEU A 620 15.168 0.445 -2.071 1.00 0.00 H new ATOM 877 N PRO A 621 10.757 1.748 -4.482 1.00 0.00 N ATOM 878 CA PRO A 621 9.684 2.742 -4.570 1.00 0.00 C ATOM 879 C PRO A 621 10.182 4.194 -4.496 1.00 0.00 C ATOM 880 O PRO A 621 11.314 4.458 -4.098 1.00 0.00 O ATOM 881 CB PRO A 621 8.824 2.421 -3.346 1.00 0.00 C ATOM 882 CG PRO A 621 9.758 1.814 -2.377 1.00 0.00 C ATOM 883 CD PRO A 621 10.713 1.018 -3.198 1.00 0.00 C ATOM 0 HA PRO A 621 9.164 2.682 -5.526 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.362 3.321 -2.940 1.00 0.00 H new ATOM 0 HB3 PRO A 621 8.016 1.735 -3.599 1.00 0.00 H new ATOM 0 HG2 PRO A 621 10.278 2.579 -1.800 1.00 0.00 H new ATOM 0 HG3 PRO A 621 9.229 1.181 -1.664 1.00 0.00 H new ATOM 0 HD2 PRO A 621 11.697 0.967 -2.732 1.00 0.00 H new ATOM 0 HD3 PRO A 621 10.369 -0.008 -3.331 1.00 0.00 H new ATOM 891 N ILE A 622 9.325 5.106 -4.882 1.00 0.00 N ATOM 892 CA ILE A 622 9.603 6.542 -4.857 1.00 0.00 C ATOM 893 C ILE A 622 8.844 7.164 -3.678 1.00 0.00 C ATOM 894 O ILE A 622 8.163 6.455 -2.921 1.00 0.00 O ATOM 895 CB ILE A 622 9.107 7.274 -6.165 1.00 0.00 C ATOM 896 CG1 ILE A 622 7.557 7.277 -6.228 1.00 0.00 C ATOM 897 CG2 ILE A 622 9.705 6.621 -7.403 1.00 0.00 C ATOM 898 CD1 ILE A 622 6.919 8.096 -7.304 1.00 0.00 C ATOM 0 H ILE A 622 8.394 4.879 -5.231 1.00 0.00 H new ATOM 0 HA ILE A 622 10.683 6.664 -4.774 1.00 0.00 H new ATOM 0 HB ILE A 622 9.447 8.309 -6.135 1.00 0.00 H new ATOM 0 HG12 ILE A 622 7.222 6.246 -6.344 1.00 0.00 H new ATOM 0 HG13 ILE A 622 7.180 7.629 -5.267 1.00 0.00 H new ATOM 0 HG21 ILE A 622 9.352 7.139 -8.294 1.00 0.00 H new ATOM 0 HG22 ILE A 622 10.792 6.680 -7.356 1.00 0.00 H new ATOM 0 HG23 ILE A 622 9.400 5.575 -7.446 1.00 0.00 H new ATOM 0 HD11 ILE A 622 5.835 8.009 -7.233 1.00 0.00 H new ATOM 0 HD12 ILE A 622 7.207 9.140 -7.186 1.00 0.00 H new ATOM 0 HD13 ILE A 622 7.249 7.737 -8.279 1.00 0.00 H new ATOM 905 N CYS A 623 8.928 8.463 -3.559 1.00 0.00 N ATOM 906 CA CYS A 623 8.211 9.199 -2.561 1.00 0.00 C ATOM 907 C CYS A 623 7.381 10.312 -3.232 1.00 0.00 C ATOM 908 O CYS A 623 7.894 11.098 -4.028 1.00 0.00 O ATOM 909 CB CYS A 623 9.186 9.764 -1.530 1.00 0.00 C ATOM 910 SG CYS A 623 10.092 8.501 -0.587 1.00 0.00 S ATOM 0 H CYS A 623 9.507 9.045 -4.164 1.00 0.00 H new ATOM 0 HA CYS A 623 7.522 8.536 -2.037 1.00 0.00 H new ATOM 0 HB2 CYS A 623 9.905 10.405 -2.040 1.00 0.00 H new ATOM 0 HB3 CYS A 623 8.634 10.395 -0.833 1.00 0.00 H new ATOM 915 N LYS A 624 6.094 10.352 -2.927 1.00 0.00 N ATOM 916 CA LYS A 624 5.175 11.309 -3.544 1.00 0.00 C ATOM 917 C LYS A 624 5.093 12.653 -2.867 1.00 0.00 C ATOM 918 O LYS A 624 5.330 13.686 -3.500 1.00 0.00 O ATOM 919 CB LYS A 624 3.771 10.732 -3.684 1.00 0.00 C ATOM 920 CG LYS A 624 3.654 9.640 -4.720 1.00 0.00 C ATOM 921 CD LYS A 624 4.031 10.113 -6.103 1.00 0.00 C ATOM 922 CE LYS A 624 3.098 11.181 -6.585 1.00 0.00 C ATOM 923 NZ LYS A 624 1.787 10.664 -7.008 1.00 0.00 N ATOM 0 H LYS A 624 5.654 9.729 -2.250 1.00 0.00 H new ATOM 0 HA LYS A 624 5.613 11.486 -4.526 1.00 0.00 H new ATOM 0 HB2 LYS A 624 3.454 10.338 -2.719 1.00 0.00 H new ATOM 0 HB3 LYS A 624 3.083 11.537 -3.941 1.00 0.00 H new ATOM 0 HG2 LYS A 624 4.296 8.805 -4.437 1.00 0.00 H new ATOM 0 HG3 LYS A 624 2.631 9.265 -4.734 1.00 0.00 H new ATOM 0 HD2 LYS A 624 5.052 10.496 -6.093 1.00 0.00 H new ATOM 0 HD3 LYS A 624 4.013 9.271 -6.795 1.00 0.00 H new ATOM 0 HE2 LYS A 624 2.953 11.912 -5.790 1.00 0.00 H new ATOM 0 HE3 LYS A 624 3.560 11.707 -7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 1.184 11.454 -7.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 1.914 10.000 -7.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 1.335 10.172 -6.211 1.00 0.00 H new ATOM 937 N GLU A 625 4.715 12.618 -1.605 1.00 0.00 N ATOM 938 CA GLU A 625 4.401 13.802 -0.751 1.00 0.00 C ATOM 939 C GLU A 625 2.989 14.258 -1.061 1.00 0.00 C ATOM 940 O GLU A 625 2.125 14.307 -0.189 1.00 0.00 O ATOM 941 CB GLU A 625 5.442 14.938 -0.904 1.00 0.00 C ATOM 942 CG GLU A 625 5.333 16.080 0.092 1.00 0.00 C ATOM 943 CD GLU A 625 4.280 17.109 -0.236 1.00 0.00 C ATOM 944 OE1 GLU A 625 4.517 17.940 -1.131 1.00 0.00 O ATOM 945 OE2 GLU A 625 3.213 17.125 0.405 1.00 0.00 O ATOM 0 H GLU A 625 4.606 11.737 -1.102 1.00 0.00 H new ATOM 0 HA GLU A 625 4.460 13.512 0.298 1.00 0.00 H new ATOM 0 HB2 GLU A 625 6.439 14.504 -0.821 1.00 0.00 H new ATOM 0 HB3 GLU A 625 5.356 15.350 -1.910 1.00 0.00 H new ATOM 0 HG2 GLU A 625 5.120 15.665 1.077 1.00 0.00 H new ATOM 0 HG3 GLU A 625 6.300 16.579 0.158 1.00 0.00 H new ATOM 952 N GLN A 626 2.754 14.509 -2.311 1.00 0.00 N ATOM 953 CA GLN A 626 1.474 14.891 -2.784 1.00 0.00 C ATOM 954 C GLN A 626 0.780 13.694 -3.358 1.00 0.00 C ATOM 955 O GLN A 626 1.280 13.042 -4.284 1.00 0.00 O ATOM 956 CB GLN A 626 1.564 15.995 -3.813 1.00 0.00 C ATOM 957 CG GLN A 626 2.121 17.262 -3.246 1.00 0.00 C ATOM 958 CD GLN A 626 2.104 18.405 -4.211 1.00 0.00 C ATOM 959 OE1 GLN A 626 2.209 18.234 -5.431 1.00 0.00 O ATOM 960 NE2 GLN A 626 1.950 19.572 -3.685 1.00 0.00 N ATOM 0 H GLN A 626 3.465 14.451 -3.040 1.00 0.00 H new ATOM 0 HA GLN A 626 0.899 15.281 -1.944 1.00 0.00 H new ATOM 0 HB2 GLN A 626 2.191 15.665 -4.641 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.572 16.189 -4.221 1.00 0.00 H new ATOM 0 HG2 GLN A 626 1.549 17.536 -2.360 1.00 0.00 H new ATOM 0 HG3 GLN A 626 3.147 17.086 -2.922 1.00 0.00 H new ATOM 0 HE21 GLN A 626 1.867 19.668 -2.673 1.00 0.00 H new ATOM 0 HE22 GLN A 626 1.911 20.399 -4.281 1.00 0.00 H new ATOM 969 N VAL A 627 -0.312 13.382 -2.767 1.00 0.00 N ATOM 970 CA VAL A 627 -1.160 12.296 -3.169 1.00 0.00 C ATOM 971 C VAL A 627 -2.566 12.806 -3.323 1.00 0.00 C ATOM 972 O VAL A 627 -2.854 13.939 -2.927 1.00 0.00 O ATOM 973 CB VAL A 627 -1.116 11.122 -2.161 1.00 0.00 C ATOM 974 CG1 VAL A 627 0.162 10.337 -2.329 1.00 0.00 C ATOM 975 CG2 VAL A 627 -1.206 11.656 -0.736 1.00 0.00 C ATOM 0 H VAL A 627 -0.664 13.890 -1.956 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.797 11.908 -4.121 1.00 0.00 H new ATOM 0 HB VAL A 627 -1.964 10.465 -2.353 1.00 0.00 H new ATOM 0 HG11 VAL A 627 0.180 9.514 -1.614 1.00 0.00 H new ATOM 0 HG12 VAL A 627 0.214 9.939 -3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 627 1.016 10.990 -2.152 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -1.174 10.824 -0.033 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -0.367 12.325 -0.544 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -2.141 12.202 -0.610 1.00 0.00 H new ATOM 979 N GLN A 628 -3.433 12.001 -3.856 1.00 0.00 N ATOM 980 CA GLN A 628 -4.785 12.426 -4.108 1.00 0.00 C ATOM 981 C GLN A 628 -5.649 12.185 -2.902 1.00 0.00 C ATOM 982 O GLN A 628 -5.189 11.658 -1.878 1.00 0.00 O ATOM 983 CB GLN A 628 -5.394 11.728 -5.322 1.00 0.00 C ATOM 984 CG GLN A 628 -4.777 12.093 -6.658 1.00 0.00 C ATOM 985 CD GLN A 628 -5.561 11.486 -7.799 1.00 0.00 C ATOM 986 OE1 GLN A 628 -6.495 12.086 -8.317 1.00 0.00 O ATOM 987 NE2 GLN A 628 -5.179 10.329 -8.234 1.00 0.00 N ATOM 0 H GLN A 628 -3.231 11.039 -4.128 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.745 13.494 -4.322 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -5.306 10.651 -5.182 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -6.459 11.959 -5.357 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -4.750 13.177 -6.766 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -3.745 11.743 -6.694 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -4.399 9.848 -7.787 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -5.658 9.898 -9.024 1.00 0.00 H new ATOM 996 N SER A 629 -6.879 12.569 -3.008 1.00 0.00 N ATOM 997 CA SER A 629 -7.796 12.379 -1.947 1.00 0.00 C ATOM 998 C SER A 629 -8.739 11.233 -2.304 1.00 0.00 C ATOM 999 O SER A 629 -9.503 10.750 -1.465 1.00 0.00 O ATOM 1000 CB SER A 629 -8.532 13.670 -1.681 1.00 0.00 C ATOM 1001 OG SER A 629 -7.599 14.758 -1.609 1.00 0.00 O ATOM 0 H SER A 629 -7.270 13.022 -3.834 1.00 0.00 H new ATOM 0 HA SER A 629 -7.276 12.108 -1.028 1.00 0.00 H new ATOM 0 HB2 SER A 629 -9.259 13.854 -2.472 1.00 0.00 H new ATOM 0 HB3 SER A 629 -9.090 13.595 -0.747 1.00 0.00 H new ATOM 0 HG SER A 629 -8.083 15.593 -1.438 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.722 10.870 -3.584 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.368 9.669 -4.131 1.00 0.00 C ATOM 1009 C CYS A 630 -10.895 9.778 -4.187 1.00 0.00 C ATOM 1010 O CYS A 630 -11.554 8.948 -4.821 1.00 0.00 O ATOM 1011 CB CYS A 630 -8.916 8.434 -3.334 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.107 8.405 -3.043 1.00 0.00 S ATOM 0 H CYS A 630 -8.243 11.419 -4.297 1.00 0.00 H new ATOM 0 HA CYS A 630 -9.048 9.565 -5.168 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -9.435 8.415 -2.375 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -9.208 7.532 -3.872 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.439 10.820 -3.557 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.864 11.020 -3.494 1.00 0.00 C ATOM 1019 C GLY A 631 -13.558 9.852 -2.819 1.00 0.00 C ATOM 1020 O GLY A 631 -13.039 9.318 -1.827 1.00 0.00 O ATOM 0 H GLY A 631 -10.895 11.540 -3.081 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -13.080 11.938 -2.948 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -13.260 11.147 -4.502 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.734 9.464 -3.304 1.00 0.00 N ATOM 1025 CA PRO A 632 -15.444 8.284 -2.816 1.00 0.00 C ATOM 1026 C PRO A 632 -14.786 6.970 -3.306 1.00 0.00 C ATOM 1027 O PRO A 632 -14.111 6.939 -4.341 1.00 0.00 O ATOM 1028 CB PRO A 632 -16.844 8.442 -3.428 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.627 9.247 -4.657 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.503 10.182 -4.340 1.00 0.00 C ATOM 0 HA PRO A 632 -15.443 8.219 -1.728 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -17.286 7.473 -3.661 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -17.523 8.945 -2.740 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.377 8.608 -5.504 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.528 9.797 -4.928 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -14.894 10.389 -5.220 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.870 11.141 -3.974 1.00 0.00 H new ATOM 1038 N PRO A 633 -14.971 5.883 -2.560 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.431 4.563 -2.907 1.00 0.00 C ATOM 1040 C PRO A 633 -15.307 3.841 -3.931 1.00 0.00 C ATOM 1041 O PRO A 633 -16.449 4.272 -4.209 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.507 3.829 -1.569 1.00 0.00 C ATOM 1043 CG PRO A 633 -15.697 4.405 -0.904 1.00 0.00 C ATOM 1044 CD PRO A 633 -15.737 5.843 -1.306 1.00 0.00 C ATOM 0 HA PRO A 633 -13.437 4.617 -3.351 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.612 2.753 -1.711 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.605 3.986 -0.977 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -16.605 3.888 -1.213 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -15.626 4.304 0.179 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -16.760 6.188 -1.452 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -15.290 6.483 -0.545 1.00 0.00 H new ATOM 1052 N PRO A 634 -14.797 2.753 -4.520 1.00 0.00 N ATOM 1053 CA PRO A 634 -15.571 1.921 -5.430 1.00 0.00 C ATOM 1054 C PRO A 634 -16.656 1.147 -4.669 1.00 0.00 C ATOM 1055 O PRO A 634 -16.866 1.352 -3.459 1.00 0.00 O ATOM 1056 CB PRO A 634 -14.524 0.944 -5.994 1.00 0.00 C ATOM 1057 CG PRO A 634 -13.464 0.887 -4.962 1.00 0.00 C ATOM 1058 CD PRO A 634 -13.417 2.252 -4.354 1.00 0.00 C ATOM 0 HA PRO A 634 -16.085 2.499 -6.198 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -14.957 -0.041 -6.171 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -14.129 1.295 -6.948 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -13.690 0.131 -4.210 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -12.503 0.621 -5.402 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.128 2.214 -3.304 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -12.694 2.892 -4.860 1.00 0.00 H new ATOM 1066 N GLU A 635 -17.366 0.305 -5.349 1.00 0.00 N ATOM 1067 CA GLU A 635 -18.319 -0.510 -4.682 1.00 0.00 C ATOM 1068 C GLU A 635 -17.801 -1.919 -4.643 1.00 0.00 C ATOM 1069 O GLU A 635 -16.908 -2.282 -5.404 1.00 0.00 O ATOM 1070 CB GLU A 635 -19.687 -0.450 -5.341 1.00 0.00 C ATOM 1071 CG GLU A 635 -19.770 -1.074 -6.718 1.00 0.00 C ATOM 1072 CD GLU A 635 -21.164 -1.020 -7.254 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -21.995 -1.881 -6.898 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -21.480 -0.101 -8.029 1.00 0.00 O ATOM 0 H GLU A 635 -17.303 0.167 -6.358 1.00 0.00 H new ATOM 0 HA GLU A 635 -18.453 -0.134 -3.668 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -20.407 -0.947 -4.691 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -19.991 0.594 -5.414 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -19.096 -0.552 -7.398 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -19.436 -2.110 -6.671 1.00 0.00 H new ATOM 1081 N LEU A 636 -18.340 -2.703 -3.775 1.00 0.00 N ATOM 1082 CA LEU A 636 -17.910 -4.045 -3.653 1.00 0.00 C ATOM 1083 C LEU A 636 -18.650 -4.890 -4.660 1.00 0.00 C ATOM 1084 O LEU A 636 -19.871 -4.835 -4.722 1.00 0.00 O ATOM 1085 CB LEU A 636 -18.172 -4.529 -2.245 1.00 0.00 C ATOM 1086 CG LEU A 636 -17.690 -5.916 -1.895 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.251 -6.083 -2.311 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -17.779 -6.066 -0.428 1.00 0.00 C ATOM 0 H LEU A 636 -19.086 -2.431 -3.135 1.00 0.00 H new ATOM 0 HA LEU A 636 -16.840 -4.121 -3.849 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -17.709 -3.825 -1.553 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -19.247 -4.489 -2.068 1.00 0.00 H new ATOM 0 HG LEU A 636 -18.297 -6.662 -2.407 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -15.912 -7.087 -2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.164 -5.935 -3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -15.635 -5.348 -1.793 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -17.437 -7.061 -0.143 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -17.153 -5.315 0.053 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -18.813 -5.933 -0.111 1.00 0.00 H new ATOM 1100 N LEU A 637 -17.904 -5.664 -5.433 1.00 0.00 N ATOM 1101 CA LEU A 637 -18.447 -6.530 -6.491 1.00 0.00 C ATOM 1102 C LEU A 637 -19.657 -7.372 -6.074 1.00 0.00 C ATOM 1103 O LEU A 637 -20.585 -7.548 -6.850 1.00 0.00 O ATOM 1104 CB LEU A 637 -17.331 -7.374 -7.159 1.00 0.00 C ATOM 1105 CG LEU A 637 -16.266 -8.048 -6.254 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -16.822 -9.224 -5.475 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -15.063 -8.473 -7.076 1.00 0.00 C ATOM 0 H LEU A 637 -16.889 -5.715 -5.349 1.00 0.00 H new ATOM 0 HA LEU A 637 -18.849 -5.852 -7.244 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -17.814 -8.158 -7.742 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -16.806 -6.730 -7.864 1.00 0.00 H new ATOM 0 HG LEU A 637 -15.954 -7.303 -5.522 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -16.034 -9.657 -4.859 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -17.637 -8.884 -4.836 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -17.195 -9.977 -6.169 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -14.326 -8.944 -6.426 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -15.378 -9.183 -7.841 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -14.620 -7.598 -7.552 1.00 0.00 H new ATOM 1119 N ASN A 638 -19.656 -7.852 -4.854 1.00 0.00 N ATOM 1120 CA ASN A 638 -20.762 -8.648 -4.342 1.00 0.00 C ATOM 1121 C ASN A 638 -21.155 -8.150 -2.964 1.00 0.00 C ATOM 1122 O ASN A 638 -21.659 -8.913 -2.126 1.00 0.00 O ATOM 1123 CB ASN A 638 -20.398 -10.144 -4.278 1.00 0.00 C ATOM 1124 CG ASN A 638 -20.261 -10.848 -5.630 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -19.448 -11.772 -5.778 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -21.055 -10.463 -6.595 1.00 0.00 N ATOM 0 H ASN A 638 -18.898 -7.707 -4.187 1.00 0.00 H new ATOM 0 HA ASN A 638 -21.604 -8.539 -5.025 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -19.457 -10.248 -3.737 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -21.160 -10.661 -3.695 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -21.017 -10.927 -7.503 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -21.713 -9.699 -6.440 1.00 0.00 H new ATOM 1133 N GLY A 639 -20.920 -6.876 -2.727 1.00 0.00 N ATOM 1134 CA GLY A 639 -21.290 -6.253 -1.494 1.00 0.00 C ATOM 1135 C GLY A 639 -21.479 -4.774 -1.675 1.00 0.00 C ATOM 1136 O GLY A 639 -21.951 -4.335 -2.722 1.00 0.00 O ATOM 0 H GLY A 639 -20.465 -6.250 -3.392 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -22.212 -6.698 -1.120 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -20.520 -6.436 -0.744 1.00 0.00 H new ATOM 1140 N ASN A 640 -21.075 -4.013 -0.683 1.00 0.00 N ATOM 1141 CA ASN A 640 -21.144 -2.555 -0.709 1.00 0.00 C ATOM 1142 C ASN A 640 -20.303 -1.991 0.411 1.00 0.00 C ATOM 1143 O ASN A 640 -19.685 -2.752 1.154 1.00 0.00 O ATOM 1144 CB ASN A 640 -22.592 -2.063 -0.571 1.00 0.00 C ATOM 1145 CG ASN A 640 -23.192 -1.490 -1.856 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -24.385 -1.644 -2.112 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -22.408 -0.768 -2.637 1.00 0.00 N ATOM 0 H ASN A 640 -20.682 -4.387 0.181 1.00 0.00 H new ATOM 0 HA ASN A 640 -20.761 -2.210 -1.670 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -23.214 -2.892 -0.233 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -22.630 -1.299 0.205 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -22.789 -0.324 -3.473 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -21.421 -0.654 -2.404 1.00 0.00 H new ATOM 1154 N VAL A 641 -20.272 -0.678 0.532 1.00 0.00 N ATOM 1155 CA VAL A 641 -19.521 -0.020 1.587 1.00 0.00 C ATOM 1156 C VAL A 641 -20.451 0.140 2.792 1.00 0.00 C ATOM 1157 O VAL A 641 -21.604 0.533 2.629 1.00 0.00 O ATOM 1158 CB VAL A 641 -19.016 1.385 1.124 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -18.158 2.050 2.180 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -18.248 1.295 -0.181 1.00 0.00 C ATOM 0 H VAL A 641 -20.763 -0.039 -0.093 1.00 0.00 H new ATOM 0 HA VAL A 641 -18.648 -0.620 1.843 1.00 0.00 H new ATOM 0 HB VAL A 641 -19.903 1.999 0.966 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -17.827 3.024 1.820 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -18.739 2.179 3.093 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -17.289 1.426 2.389 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -17.911 2.289 -0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -17.384 0.643 -0.051 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -18.896 0.888 -0.957 1.00 0.00 H new ATOM 1164 N LYS A 642 -19.975 -0.196 3.980 1.00 0.00 N ATOM 1165 CA LYS A 642 -20.808 -0.102 5.195 1.00 0.00 C ATOM 1166 C LYS A 642 -20.662 1.251 5.847 1.00 0.00 C ATOM 1167 O LYS A 642 -21.456 1.642 6.712 1.00 0.00 O ATOM 1168 CB LYS A 642 -20.450 -1.189 6.208 1.00 0.00 C ATOM 1169 CG LYS A 642 -18.983 -1.214 6.610 1.00 0.00 C ATOM 1170 CD LYS A 642 -18.740 -2.185 7.748 1.00 0.00 C ATOM 1171 CE LYS A 642 -19.288 -1.648 9.065 1.00 0.00 C ATOM 1172 NZ LYS A 642 -18.375 -0.698 9.726 1.00 0.00 N ATOM 0 H LYS A 642 -19.027 -0.535 4.141 1.00 0.00 H new ATOM 0 HA LYS A 642 -21.842 -0.243 4.881 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -21.057 -1.049 7.102 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -20.716 -2.160 5.790 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -18.373 -1.497 5.752 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -18.669 -0.214 6.909 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -19.211 -3.141 7.519 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -17.671 -2.372 7.847 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -20.243 -1.156 8.881 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -19.484 -2.483 9.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -18.794 -0.381 10.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -17.465 -1.165 9.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -18.221 0.123 9.107 1.00 0.00 H new ATOM 1186 N GLU A 643 -19.641 1.938 5.454 1.00 0.00 N ATOM 1187 CA GLU A 643 -19.348 3.235 5.969 1.00 0.00 C ATOM 1188 C GLU A 643 -20.031 4.237 5.060 1.00 0.00 C ATOM 1189 O GLU A 643 -20.360 3.879 3.922 1.00 0.00 O ATOM 1190 CB GLU A 643 -17.848 3.460 5.879 1.00 0.00 C ATOM 1191 CG GLU A 643 -17.031 2.396 6.551 1.00 0.00 C ATOM 1192 CD GLU A 643 -17.214 2.347 8.029 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -16.487 3.047 8.751 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -18.064 1.598 8.501 1.00 0.00 O ATOM 0 H GLU A 643 -18.976 1.609 4.754 1.00 0.00 H new ATOM 0 HA GLU A 643 -19.683 3.337 7.001 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -17.561 3.515 4.829 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -17.608 4.425 6.326 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -17.294 1.426 6.128 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -15.977 2.565 6.329 1.00 0.00 H new ATOM 1201 N LYS A 644 -20.265 5.457 5.511 1.00 0.00 N ATOM 1202 CA LYS A 644 -20.762 6.447 4.579 1.00 0.00 C ATOM 1203 C LYS A 644 -19.627 6.823 3.686 1.00 0.00 C ATOM 1204 O LYS A 644 -18.566 7.241 4.181 1.00 0.00 O ATOM 1205 CB LYS A 644 -21.277 7.748 5.220 1.00 0.00 C ATOM 1206 CG LYS A 644 -21.672 8.772 4.131 1.00 0.00 C ATOM 1207 CD LYS A 644 -21.927 10.171 4.652 1.00 0.00 C ATOM 1208 CE LYS A 644 -22.246 11.136 3.498 1.00 0.00 C ATOM 1209 NZ LYS A 644 -21.116 11.276 2.523 1.00 0.00 N ATOM 0 H LYS A 644 -20.127 5.774 6.470 1.00 0.00 H new ATOM 0 HA LYS A 644 -21.611 5.991 4.069 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -22.138 7.532 5.853 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -20.506 8.172 5.864 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -20.879 8.814 3.384 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -22.569 8.417 3.624 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -22.757 10.155 5.358 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -21.052 10.526 5.197 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -23.132 10.783 2.971 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -22.489 12.116 3.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -21.389 11.938 1.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -20.275 11.640 3.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -20.899 10.348 2.107 1.00 0.00 H new ATOM 1223 N THR A 645 -19.814 6.664 2.412 1.00 0.00 N ATOM 1224 CA THR A 645 -18.844 7.067 1.470 1.00 0.00 C ATOM 1225 C THR A 645 -18.639 8.578 1.562 1.00 0.00 C ATOM 1226 O THR A 645 -19.560 9.371 1.301 1.00 0.00 O ATOM 1227 CB THR A 645 -19.266 6.655 0.055 1.00 0.00 C ATOM 1228 OG1 THR A 645 -20.628 7.065 -0.182 1.00 0.00 O ATOM 1229 CG2 THR A 645 -19.148 5.151 -0.119 1.00 0.00 C ATOM 0 H THR A 645 -20.652 6.248 2.005 1.00 0.00 H new ATOM 0 HA THR A 645 -17.899 6.571 1.693 1.00 0.00 H new ATOM 0 HB THR A 645 -18.607 7.142 -0.663 1.00 0.00 H new ATOM 0 HG1 THR A 645 -20.808 7.897 0.303 1.00 0.00 H new ATOM 0 HG21 THR A 645 -19.452 4.877 -1.129 1.00 0.00 H new ATOM 0 HG22 THR A 645 -18.115 4.846 0.045 1.00 0.00 H new ATOM 0 HG23 THR A 645 -19.793 4.650 0.602 1.00 0.00 H new ATOM 1237 N LYS A 646 -17.488 8.962 2.049 1.00 0.00 N ATOM 1238 CA LYS A 646 -17.132 10.348 2.143 1.00 0.00 C ATOM 1239 C LYS A 646 -16.845 10.848 0.755 1.00 0.00 C ATOM 1240 O LYS A 646 -16.415 10.077 -0.107 1.00 0.00 O ATOM 1241 CB LYS A 646 -15.913 10.558 3.072 1.00 0.00 C ATOM 1242 CG LYS A 646 -16.103 9.920 4.440 1.00 0.00 C ATOM 1243 CD LYS A 646 -15.031 10.295 5.479 1.00 0.00 C ATOM 1244 CE LYS A 646 -13.612 9.904 5.086 1.00 0.00 C ATOM 1245 NZ LYS A 646 -12.683 10.004 6.246 1.00 0.00 N ATOM 0 H LYS A 646 -16.773 8.320 2.391 1.00 0.00 H new ATOM 0 HA LYS A 646 -17.957 10.910 2.581 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -15.025 10.139 2.600 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -15.734 11.626 3.195 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -17.081 10.207 4.827 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -16.112 8.836 4.322 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -15.065 11.371 5.647 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -15.278 9.817 6.427 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -13.607 8.885 4.700 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -13.264 10.551 4.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -11.701 9.932 5.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -12.820 10.918 6.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -12.878 9.232 6.915 1.00 0.00 H new ATOM 1259 N GLU A 647 -17.058 12.114 0.542 1.00 0.00 N ATOM 1260 CA GLU A 647 -16.897 12.708 -0.777 1.00 0.00 C ATOM 1261 C GLU A 647 -15.416 12.898 -1.064 1.00 0.00 C ATOM 1262 O GLU A 647 -14.997 13.130 -2.199 1.00 0.00 O ATOM 1263 CB GLU A 647 -17.618 14.056 -0.829 1.00 0.00 C ATOM 1264 CG GLU A 647 -19.049 14.028 -0.287 1.00 0.00 C ATOM 1265 CD GLU A 647 -19.907 12.965 -0.924 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -20.066 12.983 -2.166 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -20.435 12.081 -0.190 1.00 0.00 O ATOM 0 H GLU A 647 -17.347 12.771 1.266 1.00 0.00 H new ATOM 0 HA GLU A 647 -17.329 12.049 -1.530 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -17.041 14.785 -0.260 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -17.640 14.403 -1.862 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -19.019 13.864 0.790 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -19.510 15.002 -0.448 1.00 0.00 H new ATOM 1274 N GLU A 648 -14.648 12.790 -0.017 1.00 0.00 N ATOM 1275 CA GLU A 648 -13.235 12.928 -0.051 1.00 0.00 C ATOM 1276 C GLU A 648 -12.658 12.056 1.047 1.00 0.00 C ATOM 1277 O GLU A 648 -12.915 12.289 2.227 1.00 0.00 O ATOM 1278 CB GLU A 648 -12.881 14.388 0.175 1.00 0.00 C ATOM 1279 CG GLU A 648 -11.408 14.687 0.187 1.00 0.00 C ATOM 1280 CD GLU A 648 -11.158 16.153 0.277 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -11.113 16.817 -0.776 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -11.030 16.675 1.404 1.00 0.00 O ATOM 0 H GLU A 648 -15.012 12.596 0.916 1.00 0.00 H new ATOM 0 HA GLU A 648 -12.826 12.618 -1.013 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -13.352 14.986 -0.605 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -13.310 14.708 1.125 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -10.938 14.183 1.031 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -10.946 14.291 -0.718 1.00 0.00 H new ATOM 1289 N TYR A 649 -11.959 11.027 0.671 1.00 0.00 N ATOM 1290 CA TYR A 649 -11.387 10.125 1.639 1.00 0.00 C ATOM 1291 C TYR A 649 -10.004 10.512 2.085 1.00 0.00 C ATOM 1292 O TYR A 649 -9.783 10.785 3.264 1.00 0.00 O ATOM 1293 CB TYR A 649 -11.432 8.691 1.155 1.00 0.00 C ATOM 1294 CG TYR A 649 -12.643 7.989 1.675 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -13.845 8.025 1.016 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -12.576 7.333 2.873 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -14.948 7.405 1.549 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -13.659 6.726 3.425 1.00 0.00 C ATOM 1299 CZ TYR A 649 -14.853 6.761 2.758 1.00 0.00 C ATOM 1300 OH TYR A 649 -15.959 6.165 3.301 1.00 0.00 O ATOM 0 H TYR A 649 -11.768 10.786 -0.302 1.00 0.00 H new ATOM 0 HA TYR A 649 -12.016 10.207 2.525 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -11.436 8.671 0.065 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -10.534 8.165 1.481 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -13.925 8.544 0.072 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -11.632 7.296 3.397 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -15.888 7.424 1.018 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -13.578 6.223 4.377 1.00 0.00 H new ATOM 0 HH TYR A 649 -16.587 6.854 3.602 1.00 0.00 H new ATOM 1310 N GLY A 650 -9.094 10.536 1.174 1.00 0.00 N ATOM 1311 CA GLY A 650 -7.747 10.858 1.494 1.00 0.00 C ATOM 1312 C GLY A 650 -6.867 9.641 1.464 1.00 0.00 C ATOM 1313 O GLY A 650 -7.350 8.500 1.578 1.00 0.00 O ATOM 0 H GLY A 650 -9.262 10.334 0.188 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -7.371 11.597 0.787 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -7.706 11.313 2.483 1.00 0.00 H new ATOM 1317 N HIS A 651 -5.596 9.860 1.272 1.00 0.00 N ATOM 1318 CA HIS A 651 -4.619 8.807 1.283 1.00 0.00 C ATOM 1319 C HIS A 651 -4.590 8.121 2.656 1.00 0.00 C ATOM 1320 O HIS A 651 -4.636 8.789 3.690 1.00 0.00 O ATOM 1321 CB HIS A 651 -3.239 9.373 0.926 1.00 0.00 C ATOM 1322 CG HIS A 651 -2.157 8.353 0.896 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -1.953 7.538 -0.168 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -1.260 7.988 1.823 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.975 6.702 0.111 1.00 0.00 C ATOM 1326 NE2 HIS A 651 -0.539 6.950 1.306 1.00 0.00 N ATOM 0 H HIS A 651 -5.205 10.786 1.101 1.00 0.00 H new ATOM 0 HA HIS A 651 -4.891 8.060 0.537 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -3.297 9.856 -0.050 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -2.976 10.146 1.649 1.00 0.00 H new ATOM 0 HD2 HIS A 651 -1.131 8.433 2.799 1.00 0.00 H new ATOM 0 HE1 HIS A 651 -0.598 5.935 -0.549 1.00 0.00 H new ATOM 0 HE2 HIS A 651 0.215 6.454 1.780 1.00 0.00 H new ATOM 1335 N SER A 652 -4.535 6.793 2.635 1.00 0.00 N ATOM 1336 CA SER A 652 -4.497 5.944 3.838 1.00 0.00 C ATOM 1337 C SER A 652 -5.832 5.928 4.591 1.00 0.00 C ATOM 1338 O SER A 652 -5.902 5.498 5.749 1.00 0.00 O ATOM 1339 CB SER A 652 -3.344 6.317 4.773 1.00 0.00 C ATOM 1340 OG SER A 652 -2.098 6.209 4.100 1.00 0.00 O ATOM 0 H SER A 652 -4.515 6.258 1.767 1.00 0.00 H new ATOM 0 HA SER A 652 -4.317 4.930 3.481 1.00 0.00 H new ATOM 0 HB2 SER A 652 -3.479 7.335 5.137 1.00 0.00 H new ATOM 0 HB3 SER A 652 -3.350 5.663 5.645 1.00 0.00 H new ATOM 0 HG SER A 652 -1.373 6.453 4.713 1.00 0.00 H new ATOM 1346 N GLU A 653 -6.879 6.392 3.954 1.00 0.00 N ATOM 1347 CA GLU A 653 -8.177 6.303 4.541 1.00 0.00 C ATOM 1348 C GLU A 653 -8.816 5.040 3.997 1.00 0.00 C ATOM 1349 O GLU A 653 -8.892 4.858 2.776 1.00 0.00 O ATOM 1350 CB GLU A 653 -9.016 7.522 4.203 1.00 0.00 C ATOM 1351 CG GLU A 653 -10.235 7.670 5.092 1.00 0.00 C ATOM 1352 CD GLU A 653 -9.895 7.978 6.516 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -9.519 7.063 7.270 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -10.013 9.154 6.907 1.00 0.00 O ATOM 0 H GLU A 653 -6.850 6.832 3.034 1.00 0.00 H new ATOM 0 HA GLU A 653 -8.106 6.267 5.628 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -8.399 8.416 4.291 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -9.337 7.458 3.163 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -10.870 8.464 4.697 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -10.817 6.749 5.056 1.00 0.00 H new ATOM 1361 N VAL A 654 -9.179 4.149 4.884 1.00 0.00 N ATOM 1362 CA VAL A 654 -9.752 2.871 4.501 1.00 0.00 C ATOM 1363 C VAL A 654 -11.242 2.979 4.366 1.00 0.00 C ATOM 1364 O VAL A 654 -11.866 3.925 4.873 1.00 0.00 O ATOM 1365 CB VAL A 654 -9.411 1.768 5.527 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -10.332 1.683 6.729 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -9.151 0.475 4.880 1.00 0.00 C ATOM 0 H VAL A 654 -9.089 4.282 5.891 1.00 0.00 H new ATOM 0 HA VAL A 654 -9.318 2.598 3.539 1.00 0.00 H new ATOM 0 HB VAL A 654 -8.472 2.088 5.977 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -10.002 0.876 7.384 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -10.307 2.626 7.274 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -11.350 1.485 6.394 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -8.915 -0.271 5.639 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -10.035 0.161 4.325 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -8.309 0.574 4.195 1.00 0.00 H new ATOM 1371 N VAL A 655 -11.798 2.042 3.656 1.00 0.00 N ATOM 1372 CA VAL A 655 -13.201 1.939 3.495 1.00 0.00 C ATOM 1373 C VAL A 655 -13.671 0.527 3.800 1.00 0.00 C ATOM 1374 O VAL A 655 -13.288 -0.419 3.133 1.00 0.00 O ATOM 1375 CB VAL A 655 -13.680 2.402 2.086 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -13.440 3.847 1.890 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -12.987 1.654 0.976 1.00 0.00 C ATOM 0 H VAL A 655 -11.271 1.319 3.167 1.00 0.00 H new ATOM 0 HA VAL A 655 -13.657 2.621 4.213 1.00 0.00 H new ATOM 0 HB VAL A 655 -14.748 2.190 2.046 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -13.784 4.142 0.899 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -13.985 4.412 2.646 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -12.374 4.054 1.981 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -13.353 2.011 0.013 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -11.912 1.822 1.040 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -13.194 0.588 1.071 1.00 0.00 H new ATOM 1381 N GLU A 656 -14.427 0.402 4.857 1.00 0.00 N ATOM 1382 CA GLU A 656 -15.015 -0.869 5.249 1.00 0.00 C ATOM 1383 C GLU A 656 -16.195 -1.222 4.370 1.00 0.00 C ATOM 1384 O GLU A 656 -17.119 -0.422 4.163 1.00 0.00 O ATOM 1385 CB GLU A 656 -15.468 -0.830 6.690 1.00 0.00 C ATOM 1386 CG GLU A 656 -14.434 -1.235 7.702 1.00 0.00 C ATOM 1387 CD GLU A 656 -14.873 -0.920 9.099 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -15.797 -1.572 9.614 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -14.314 0.001 9.709 1.00 0.00 O ATOM 0 H GLU A 656 -14.659 1.176 5.479 1.00 0.00 H new ATOM 0 HA GLU A 656 -14.244 -1.630 5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -15.801 0.182 6.921 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -16.334 -1.483 6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -14.238 -2.304 7.614 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -13.497 -0.721 7.490 1.00 0.00 H new ATOM 1396 N TYR A 657 -16.154 -2.394 3.879 1.00 0.00 N ATOM 1397 CA TYR A 657 -17.165 -2.950 3.058 1.00 0.00 C ATOM 1398 C TYR A 657 -17.884 -4.064 3.797 1.00 0.00 C ATOM 1399 O TYR A 657 -17.494 -4.451 4.911 1.00 0.00 O ATOM 1400 CB TYR A 657 -16.525 -3.562 1.823 1.00 0.00 C ATOM 1401 CG TYR A 657 -15.898 -2.602 0.853 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -16.655 -1.996 -0.131 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -14.547 -2.324 0.899 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -16.084 -1.138 -1.040 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -13.972 -1.466 0.000 1.00 0.00 C ATOM 1406 CZ TYR A 657 -14.742 -0.876 -0.968 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.163 -0.025 -1.869 1.00 0.00 O ATOM 0 H TYR A 657 -15.375 -3.032 4.044 1.00 0.00 H new ATOM 0 HA TYR A 657 -17.867 -2.161 2.789 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -15.761 -4.268 2.148 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -17.285 -4.136 1.293 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -17.714 -2.200 -0.187 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -13.934 -2.790 1.656 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -16.689 -0.674 -1.805 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -12.914 -1.255 0.054 1.00 0.00 H new ATOM 0 HH TYR A 657 -14.819 0.644 -2.156 1.00 0.00 H new ATOM 1417 N TYR A 658 -18.911 -4.566 3.169 1.00 0.00 N ATOM 1418 CA TYR A 658 -19.649 -5.720 3.609 1.00 0.00 C ATOM 1419 C TYR A 658 -20.134 -6.404 2.351 1.00 0.00 C ATOM 1420 O TYR A 658 -20.435 -5.719 1.374 1.00 0.00 O ATOM 1421 CB TYR A 658 -20.852 -5.327 4.510 1.00 0.00 C ATOM 1422 CG TYR A 658 -21.954 -4.537 3.819 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -21.842 -3.176 3.630 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -23.104 -5.165 3.354 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -22.821 -2.461 3.009 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -24.098 -4.446 2.722 1.00 0.00 C ATOM 1427 CZ TYR A 658 -23.944 -3.089 2.554 1.00 0.00 C ATOM 1428 OH TYR A 658 -24.920 -2.350 1.930 1.00 0.00 O ATOM 0 H TYR A 658 -19.272 -4.167 2.302 1.00 0.00 H new ATOM 0 HA TYR A 658 -19.019 -6.372 4.213 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -21.286 -6.237 4.925 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -20.479 -4.740 5.349 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -20.958 -2.665 3.982 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -23.221 -6.230 3.489 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -22.708 -1.395 2.876 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -24.987 -4.943 2.363 1.00 0.00 H new ATOM 0 HH TYR A 658 -25.656 -2.939 1.662 1.00 0.00 H new ATOM 1438 N CYS A 659 -20.148 -7.696 2.325 1.00 0.00 N ATOM 1439 CA CYS A 659 -20.663 -8.405 1.173 1.00 0.00 C ATOM 1440 C CYS A 659 -22.100 -8.816 1.439 1.00 0.00 C ATOM 1441 O CYS A 659 -22.650 -8.517 2.505 1.00 0.00 O ATOM 1442 CB CYS A 659 -19.814 -9.642 0.842 1.00 0.00 C ATOM 1443 SG CYS A 659 -18.068 -9.311 0.465 1.00 0.00 S ATOM 0 H CYS A 659 -19.812 -8.292 3.081 1.00 0.00 H new ATOM 0 HA CYS A 659 -20.620 -7.738 0.312 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -19.862 -10.331 1.686 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -20.262 -10.151 -0.011 1.00 0.00 H new ATOM 1448 N ASN A 660 -22.727 -9.442 0.474 1.00 0.00 N ATOM 1449 CA ASN A 660 -24.059 -9.983 0.677 1.00 0.00 C ATOM 1450 C ASN A 660 -23.979 -11.197 1.585 1.00 0.00 C ATOM 1451 O ASN A 660 -22.955 -11.885 1.599 1.00 0.00 O ATOM 1452 CB ASN A 660 -24.739 -10.360 -0.644 1.00 0.00 C ATOM 1453 CG ASN A 660 -25.213 -9.172 -1.447 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -26.345 -8.738 -1.295 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -24.385 -8.654 -2.301 1.00 0.00 N ATOM 0 H ASN A 660 -22.343 -9.592 -0.459 1.00 0.00 H new ATOM 0 HA ASN A 660 -24.666 -9.207 1.142 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -24.041 -10.940 -1.248 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -25.591 -11.006 -0.432 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -24.672 -7.859 -2.872 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -23.447 -9.042 -2.402 1.00 0.00 H new ATOM 1462 N PRO A 661 -25.074 -11.518 2.302 1.00 0.00 N ATOM 1463 CA PRO A 661 -25.127 -12.624 3.309 1.00 0.00 C ATOM 1464 C PRO A 661 -25.167 -14.024 2.670 1.00 0.00 C ATOM 1465 O PRO A 661 -25.815 -14.948 3.169 1.00 0.00 O ATOM 1466 CB PRO A 661 -26.440 -12.340 4.030 1.00 0.00 C ATOM 1467 CG PRO A 661 -27.293 -11.698 2.994 1.00 0.00 C ATOM 1468 CD PRO A 661 -26.375 -10.832 2.197 1.00 0.00 C ATOM 0 HA PRO A 661 -24.243 -12.640 3.947 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -26.894 -13.256 4.407 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -26.290 -11.682 4.886 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -27.772 -12.446 2.363 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -28.088 -11.109 3.451 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -26.702 -10.748 1.160 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -26.328 -9.820 2.599 1.00 0.00 H new ATOM 1476 N ARG A 662 -24.431 -14.159 1.619 1.00 0.00 N ATOM 1477 CA ARG A 662 -24.376 -15.345 0.815 1.00 0.00 C ATOM 1478 C ARG A 662 -22.996 -15.463 0.176 1.00 0.00 C ATOM 1479 O ARG A 662 -22.777 -16.261 -0.745 1.00 0.00 O ATOM 1480 CB ARG A 662 -25.481 -15.241 -0.228 1.00 0.00 C ATOM 1481 CG ARG A 662 -25.504 -13.895 -0.897 1.00 0.00 C ATOM 1482 CD ARG A 662 -26.835 -13.589 -1.503 1.00 0.00 C ATOM 1483 NE ARG A 662 -27.165 -14.439 -2.642 1.00 0.00 N ATOM 1484 CZ ARG A 662 -28.154 -14.197 -3.500 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -28.857 -13.075 -3.418 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -28.411 -15.057 -4.467 1.00 0.00 N ATOM 0 H ARG A 662 -23.822 -13.416 1.277 1.00 0.00 H new ATOM 0 HA ARG A 662 -24.531 -16.244 1.412 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -25.342 -16.017 -0.981 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -26.445 -15.426 0.246 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -25.253 -13.124 -0.168 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -24.738 -13.863 -1.672 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -27.606 -13.700 -0.741 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -26.849 -12.547 -1.821 1.00 0.00 H new ATOM 0 HE ARG A 662 -26.600 -15.275 -2.791 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -28.641 -12.390 -2.694 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -29.613 -12.897 -4.079 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -27.852 -15.906 -4.556 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -29.168 -14.873 -5.125 1.00 0.00 H new ATOM 1500 N PHE A 663 -22.055 -14.662 0.676 1.00 0.00 N ATOM 1501 CA PHE A 663 -20.699 -14.660 0.180 1.00 0.00 C ATOM 1502 C PHE A 663 -19.711 -14.551 1.320 1.00 0.00 C ATOM 1503 O PHE A 663 -19.993 -13.959 2.365 1.00 0.00 O ATOM 1504 CB PHE A 663 -20.411 -13.492 -0.775 1.00 0.00 C ATOM 1505 CG PHE A 663 -21.259 -13.421 -2.002 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -22.457 -12.745 -1.992 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -20.847 -14.018 -3.169 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -23.229 -12.666 -3.125 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -21.611 -13.950 -4.305 1.00 0.00 C ATOM 1510 CZ PHE A 663 -22.810 -13.272 -4.286 1.00 0.00 C ATOM 0 H PHE A 663 -22.221 -14.001 1.435 1.00 0.00 H new ATOM 0 HA PHE A 663 -20.588 -15.601 -0.358 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -20.529 -12.560 -0.222 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -19.367 -13.550 -1.083 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -22.794 -12.271 -1.082 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -19.907 -14.549 -3.192 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -24.165 -12.128 -3.104 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -21.274 -14.427 -5.213 1.00 0.00 H new ATOM 0 HZ PHE A 663 -23.417 -13.217 -5.177 1.00 0.00 H new ATOM 1520 N LEU A 664 -18.573 -15.093 1.093 1.00 0.00 N ATOM 1521 CA LEU A 664 -17.464 -15.031 1.982 1.00 0.00 C ATOM 1522 C LEU A 664 -16.623 -13.843 1.583 1.00 0.00 C ATOM 1523 O LEU A 664 -16.646 -13.434 0.417 1.00 0.00 O ATOM 1524 CB LEU A 664 -16.646 -16.306 1.830 1.00 0.00 C ATOM 1525 CG LEU A 664 -17.358 -17.589 2.187 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -16.524 -18.782 1.763 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -17.628 -17.634 3.679 1.00 0.00 C ATOM 0 H LEU A 664 -18.375 -15.619 0.242 1.00 0.00 H new ATOM 0 HA LEU A 664 -17.793 -14.933 3.016 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -16.306 -16.376 0.797 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -15.756 -16.221 2.453 1.00 0.00 H new ATOM 0 HG LEU A 664 -18.311 -17.626 1.659 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -17.046 -19.702 2.025 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -16.364 -18.750 0.685 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -15.561 -18.753 2.274 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -18.142 -18.563 3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -16.684 -17.585 4.221 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -18.253 -16.787 3.961 1.00 0.00 H new ATOM 1539 N MET A 665 -15.917 -13.281 2.513 1.00 0.00 N ATOM 1540 CA MET A 665 -15.057 -12.167 2.215 1.00 0.00 C ATOM 1541 C MET A 665 -13.618 -12.655 2.277 1.00 0.00 C ATOM 1542 O MET A 665 -13.116 -13.005 3.355 1.00 0.00 O ATOM 1543 CB MET A 665 -15.329 -11.034 3.202 1.00 0.00 C ATOM 1544 CG MET A 665 -15.447 -9.683 2.537 1.00 0.00 C ATOM 1545 SD MET A 665 -16.130 -8.426 3.620 1.00 0.00 S ATOM 1546 CE MET A 665 -16.406 -7.112 2.447 1.00 0.00 C ATOM 0 H MET A 665 -15.916 -13.573 3.490 1.00 0.00 H new ATOM 0 HA MET A 665 -15.247 -11.773 1.217 1.00 0.00 H new ATOM 0 HB2 MET A 665 -16.250 -11.247 3.745 1.00 0.00 H new ATOM 0 HB3 MET A 665 -14.526 -11.001 3.938 1.00 0.00 H new ATOM 0 HG2 MET A 665 -14.462 -9.365 2.196 1.00 0.00 H new ATOM 0 HG3 MET A 665 -16.077 -9.774 1.652 1.00 0.00 H new ATOM 0 HE1 MET A 665 -16.006 -6.179 2.845 1.00 0.00 H new ATOM 0 HE2 MET A 665 -15.905 -7.351 1.509 1.00 0.00 H new ATOM 0 HE3 MET A 665 -17.476 -7.002 2.269 1.00 0.00 H new ATOM 1556 N LYS A 666 -12.979 -12.730 1.122 1.00 0.00 N ATOM 1557 CA LYS A 666 -11.651 -13.323 1.000 1.00 0.00 C ATOM 1558 C LYS A 666 -10.567 -12.447 1.619 1.00 0.00 C ATOM 1559 O LYS A 666 -9.886 -12.857 2.569 1.00 0.00 O ATOM 1560 CB LYS A 666 -11.320 -13.582 -0.476 1.00 0.00 C ATOM 1561 CG LYS A 666 -10.000 -14.309 -0.716 1.00 0.00 C ATOM 1562 CD LYS A 666 -10.040 -15.749 -0.210 1.00 0.00 C ATOM 1563 CE LYS A 666 -11.040 -16.594 -0.999 1.00 0.00 C ATOM 1564 NZ LYS A 666 -11.072 -18.000 -0.543 1.00 0.00 N ATOM 0 H LYS A 666 -13.362 -12.384 0.242 1.00 0.00 H new ATOM 0 HA LYS A 666 -11.670 -14.265 1.548 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -12.127 -14.167 -0.918 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -11.294 -12.627 -1.001 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -9.773 -14.306 -1.782 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -9.194 -13.771 -0.217 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -9.047 -16.191 -0.289 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -10.309 -15.757 0.846 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -12.035 -16.160 -0.901 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -10.782 -16.564 -2.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -11.764 -18.532 -1.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -10.130 -18.425 -0.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -11.344 -18.033 0.460 1.00 0.00 H new ATOM 1578 N GLY A 667 -10.425 -11.264 1.088 1.00 0.00 N ATOM 1579 CA GLY A 667 -9.378 -10.385 1.510 1.00 0.00 C ATOM 1580 C GLY A 667 -9.854 -9.356 2.502 1.00 0.00 C ATOM 1581 O GLY A 667 -10.934 -9.517 3.095 1.00 0.00 O ATOM 0 H GLY A 667 -11.028 -10.887 0.357 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -8.574 -10.970 1.956 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -8.959 -9.880 0.640 1.00 0.00 H new ATOM 1585 N PRO A 668 -9.085 -8.282 2.690 1.00 0.00 N ATOM 1586 CA PRO A 668 -9.401 -7.219 3.649 1.00 0.00 C ATOM 1587 C PRO A 668 -10.710 -6.507 3.318 1.00 0.00 C ATOM 1588 O PRO A 668 -10.841 -5.910 2.252 1.00 0.00 O ATOM 1589 CB PRO A 668 -8.222 -6.237 3.496 1.00 0.00 C ATOM 1590 CG PRO A 668 -7.657 -6.534 2.151 1.00 0.00 C ATOM 1591 CD PRO A 668 -7.829 -8.002 1.965 1.00 0.00 C ATOM 0 HA PRO A 668 -9.528 -7.612 4.658 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -8.557 -5.202 3.565 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -7.479 -6.385 4.280 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -8.179 -5.976 1.374 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -6.606 -6.251 2.095 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -7.903 -8.270 0.911 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -6.990 -8.563 2.378 1.00 0.00 H new ATOM 1599 N ASN A 669 -11.675 -6.557 4.248 1.00 0.00 N ATOM 1600 CA ASN A 669 -12.995 -5.883 4.081 1.00 0.00 C ATOM 1601 C ASN A 669 -12.884 -4.387 4.008 1.00 0.00 C ATOM 1602 O ASN A 669 -13.871 -3.709 3.860 1.00 0.00 O ATOM 1603 CB ASN A 669 -14.000 -6.244 5.188 1.00 0.00 C ATOM 1604 CG ASN A 669 -13.530 -5.942 6.588 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -12.843 -6.745 7.200 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -13.941 -4.827 7.129 1.00 0.00 N ATOM 0 H ASN A 669 -11.576 -7.057 5.132 1.00 0.00 H new ATOM 0 HA ASN A 669 -13.367 -6.260 3.128 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -14.929 -5.704 5.007 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -14.231 -7.307 5.118 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -13.689 -4.604 8.092 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -14.514 -4.179 6.589 1.00 0.00 H new ATOM 1613 N LYS A 670 -11.709 -3.887 4.143 1.00 0.00 N ATOM 1614 CA LYS A 670 -11.454 -2.507 4.049 1.00 0.00 C ATOM 1615 C LYS A 670 -10.158 -2.262 3.303 1.00 0.00 C ATOM 1616 O LYS A 670 -9.194 -3.013 3.467 1.00 0.00 O ATOM 1617 CB LYS A 670 -11.585 -1.789 5.423 1.00 0.00 C ATOM 1618 CG LYS A 670 -11.484 -2.658 6.648 1.00 0.00 C ATOM 1619 CD LYS A 670 -10.077 -3.000 7.017 1.00 0.00 C ATOM 1620 CE LYS A 670 -9.413 -1.802 7.646 1.00 0.00 C ATOM 1621 NZ LYS A 670 -7.957 -2.005 7.839 1.00 0.00 N ATOM 0 H LYS A 670 -10.878 -4.449 4.327 1.00 0.00 H new ATOM 0 HA LYS A 670 -12.230 -2.036 3.446 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -10.811 -1.024 5.483 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -12.545 -1.274 5.448 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -11.958 -2.148 7.487 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -12.042 -3.579 6.478 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -10.067 -3.840 7.711 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -9.524 -3.312 6.131 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -9.576 -0.927 7.017 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -9.880 -1.594 8.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -7.543 -1.156 8.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -7.800 -2.824 8.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -7.505 -2.178 6.918 1.00 0.00 H new ATOM 1635 N ILE A 671 -10.128 -1.198 2.510 1.00 0.00 N ATOM 1636 CA ILE A 671 -9.036 -0.916 1.592 1.00 0.00 C ATOM 1637 C ILE A 671 -8.737 0.552 1.717 1.00 0.00 C ATOM 1638 O ILE A 671 -9.652 1.343 1.933 1.00 0.00 O ATOM 1639 CB ILE A 671 -9.405 -1.214 0.093 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -10.476 -0.236 -0.415 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -9.871 -2.651 -0.069 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -10.801 -0.338 -1.878 1.00 0.00 C ATOM 0 H ILE A 671 -10.871 -0.500 2.487 1.00 0.00 H new ATOM 0 HA ILE A 671 -8.190 -1.554 1.849 1.00 0.00 H new ATOM 0 HB ILE A 671 -8.508 -1.074 -0.510 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -11.391 -0.398 0.155 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -10.145 0.781 -0.204 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -10.121 -2.837 -1.113 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -9.075 -3.329 0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -10.752 -2.820 0.551 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -11.567 0.395 -2.132 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -9.903 -0.143 -2.465 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -11.169 -1.340 -2.100 1.00 0.00 H new ATOM 1649 N GLN A 672 -7.515 0.914 1.654 1.00 0.00 N ATOM 1650 CA GLN A 672 -7.155 2.291 1.798 1.00 0.00 C ATOM 1651 C GLN A 672 -6.631 2.802 0.491 1.00 0.00 C ATOM 1652 O GLN A 672 -6.080 2.030 -0.298 1.00 0.00 O ATOM 1653 CB GLN A 672 -6.125 2.512 2.920 1.00 0.00 C ATOM 1654 CG GLN A 672 -4.755 1.879 2.699 1.00 0.00 C ATOM 1655 CD GLN A 672 -4.725 0.358 2.820 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -4.530 -0.187 3.907 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -4.873 -0.331 1.716 1.00 0.00 N ATOM 0 H GLN A 672 -6.732 0.279 1.503 1.00 0.00 H new ATOM 0 HA GLN A 672 -8.048 2.847 2.082 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -5.990 3.585 3.057 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -6.539 2.121 3.849 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -4.397 2.158 1.708 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -4.055 2.301 3.420 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -5.033 0.151 0.832 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -4.828 -1.350 1.741 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.819 4.063 0.237 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.342 4.632 -0.996 1.00 0.00 C ATOM 1668 C CYS A 673 -4.897 4.931 -0.928 1.00 0.00 C ATOM 1669 O CYS A 673 -4.385 5.646 -0.032 1.00 0.00 O ATOM 1670 CB CYS A 673 -7.168 5.818 -1.472 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.639 6.437 -3.092 1.00 0.00 S ATOM 0 H CYS A 673 -7.295 4.716 0.859 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.477 3.869 -1.763 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -8.217 5.527 -1.524 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -7.096 6.622 -0.740 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.254 4.375 -1.881 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.885 4.385 -2.030 1.00 0.00 C ATOM 1678 C VAL A 674 -2.518 5.251 -3.226 1.00 0.00 C ATOM 1679 O VAL A 674 -2.895 4.963 -4.363 1.00 0.00 O ATOM 1680 CB VAL A 674 -2.415 2.943 -2.187 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -1.035 2.904 -2.657 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.529 2.230 -0.864 1.00 0.00 C ATOM 0 H VAL A 674 -4.727 3.865 -2.627 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.389 4.813 -1.159 1.00 0.00 H new ATOM 0 HB VAL A 674 -3.044 2.444 -2.924 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -0.716 1.867 -2.763 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -0.965 3.406 -3.622 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -0.391 3.410 -1.937 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -2.193 1.199 -0.976 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -1.909 2.735 -0.124 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -3.568 2.239 -0.534 1.00 0.00 H new ATOM 1686 N ASP A 675 -1.769 6.301 -2.935 1.00 0.00 N ATOM 1687 CA ASP A 675 -1.421 7.367 -3.873 1.00 0.00 C ATOM 1688 C ASP A 675 -2.676 8.117 -4.328 1.00 0.00 C ATOM 1689 O ASP A 675 -2.988 9.178 -3.806 1.00 0.00 O ATOM 1690 CB ASP A 675 -0.574 6.862 -5.052 1.00 0.00 C ATOM 1691 CG ASP A 675 -0.268 7.952 -6.033 1.00 0.00 C ATOM 1692 OD1 ASP A 675 0.352 8.954 -5.646 1.00 0.00 O ATOM 1693 OD2 ASP A 675 -0.685 7.848 -7.200 1.00 0.00 O ATOM 0 H ASP A 675 -1.370 6.444 -2.007 1.00 0.00 H new ATOM 0 HA ASP A 675 -0.787 8.078 -3.344 1.00 0.00 H new ATOM 0 HB2 ASP A 675 0.358 6.442 -4.675 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -1.104 6.056 -5.560 1.00 0.00 H new ATOM 1698 N GLY A 676 -3.396 7.529 -5.223 1.00 0.00 N ATOM 1699 CA GLY A 676 -4.639 8.069 -5.695 1.00 0.00 C ATOM 1700 C GLY A 676 -5.422 6.967 -6.344 1.00 0.00 C ATOM 1701 O GLY A 676 -6.202 7.187 -7.275 1.00 0.00 O ATOM 0 H GLY A 676 -3.138 6.644 -5.659 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -5.204 8.498 -4.867 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -4.456 8.874 -6.407 1.00 0.00 H new ATOM 1705 N GLU A 677 -5.169 5.757 -5.875 1.00 0.00 N ATOM 1706 CA GLU A 677 -5.790 4.565 -6.380 1.00 0.00 C ATOM 1707 C GLU A 677 -6.126 3.714 -5.190 1.00 0.00 C ATOM 1708 O GLU A 677 -5.406 3.734 -4.199 1.00 0.00 O ATOM 1709 CB GLU A 677 -4.818 3.790 -7.266 1.00 0.00 C ATOM 1710 CG GLU A 677 -4.247 4.576 -8.424 1.00 0.00 C ATOM 1711 CD GLU A 677 -3.260 3.773 -9.203 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -2.050 3.789 -8.859 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -3.665 3.103 -10.172 1.00 0.00 O ATOM 0 H GLU A 677 -4.510 5.582 -5.116 1.00 0.00 H new ATOM 0 HA GLU A 677 -6.672 4.820 -6.968 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -3.995 3.430 -6.649 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -5.329 2.911 -7.659 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -5.056 4.895 -9.081 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -3.766 5.479 -8.049 1.00 0.00 H new ATOM 1720 N TRP A 678 -7.176 2.997 -5.248 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.531 2.164 -4.140 1.00 0.00 C ATOM 1722 C TRP A 678 -6.842 0.816 -4.264 1.00 0.00 C ATOM 1723 O TRP A 678 -6.374 0.446 -5.345 1.00 0.00 O ATOM 1724 CB TRP A 678 -9.026 2.001 -4.076 1.00 0.00 C ATOM 1725 CG TRP A 678 -9.774 3.262 -3.736 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.289 4.190 -4.600 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -10.090 3.718 -2.425 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -10.909 5.198 -3.895 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.797 4.928 -2.553 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.839 3.216 -1.156 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -11.256 5.638 -1.443 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -10.289 3.908 -0.063 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -10.990 5.111 -0.208 1.00 0.00 C ATOM 0 H TRP A 678 -7.814 2.959 -6.043 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.199 2.635 -3.214 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.381 1.631 -5.038 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.265 1.240 -3.334 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.220 4.139 -5.677 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.374 6.010 -4.302 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -9.296 2.291 -1.032 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.799 6.565 -1.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -10.100 3.519 0.927 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -11.328 5.635 0.674 1.00 0.00 H new ATOM 1744 N THR A 679 -6.745 0.107 -3.174 1.00 0.00 N ATOM 1745 CA THR A 679 -6.123 -1.185 -3.177 1.00 0.00 C ATOM 1746 C THR A 679 -7.097 -2.282 -3.615 1.00 0.00 C ATOM 1747 O THR A 679 -8.260 -2.002 -3.929 1.00 0.00 O ATOM 1748 CB THR A 679 -5.533 -1.492 -1.793 1.00 0.00 C ATOM 1749 OG1 THR A 679 -6.504 -1.206 -0.770 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.289 -0.670 -1.562 1.00 0.00 C ATOM 0 H THR A 679 -7.093 0.407 -2.264 1.00 0.00 H new ATOM 0 HA THR A 679 -5.313 -1.167 -3.906 1.00 0.00 H new ATOM 0 HB THR A 679 -5.270 -2.549 -1.751 1.00 0.00 H new ATOM 0 HG1 THR A 679 -6.266 -1.686 0.051 1.00 0.00 H new ATOM 0 HG21 THR A 679 -3.881 -0.897 -0.577 1.00 0.00 H new ATOM 0 HG22 THR A 679 -3.549 -0.908 -2.326 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.538 0.390 -1.616 1.00 0.00 H new ATOM 1758 N THR A 680 -6.618 -3.508 -3.648 1.00 0.00 N ATOM 1759 CA THR A 680 -7.414 -4.641 -4.041 1.00 0.00 C ATOM 1760 C THR A 680 -8.529 -4.872 -3.027 1.00 0.00 C ATOM 1761 O THR A 680 -8.267 -4.990 -1.817 1.00 0.00 O ATOM 1762 CB THR A 680 -6.520 -5.882 -4.133 1.00 0.00 C ATOM 1763 OG1 THR A 680 -5.341 -5.544 -4.891 1.00 0.00 O ATOM 1764 CG2 THR A 680 -7.247 -7.029 -4.822 1.00 0.00 C ATOM 0 H THR A 680 -5.657 -3.743 -3.400 1.00 0.00 H new ATOM 0 HA THR A 680 -7.863 -4.448 -5.015 1.00 0.00 H new ATOM 0 HB THR A 680 -6.253 -6.201 -3.126 1.00 0.00 H new ATOM 0 HG1 THR A 680 -4.758 -6.329 -4.957 1.00 0.00 H new ATOM 0 HG21 THR A 680 -6.590 -7.897 -4.874 1.00 0.00 H new ATOM 0 HG22 THR A 680 -8.142 -7.285 -4.255 1.00 0.00 H new ATOM 0 HG23 THR A 680 -7.530 -6.727 -5.830 1.00 0.00 H new ATOM 1772 N LEU A 681 -9.747 -4.897 -3.527 1.00 0.00 N ATOM 1773 CA LEU A 681 -10.941 -5.087 -2.733 1.00 0.00 C ATOM 1774 C LEU A 681 -11.013 -6.454 -2.050 1.00 0.00 C ATOM 1775 O LEU A 681 -10.340 -7.396 -2.456 1.00 0.00 O ATOM 1776 CB LEU A 681 -12.210 -4.820 -3.555 1.00 0.00 C ATOM 1777 CG LEU A 681 -12.723 -3.391 -3.525 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -11.842 -2.444 -4.292 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -14.153 -3.326 -3.969 1.00 0.00 C ATOM 0 H LEU A 681 -9.938 -4.783 -4.522 1.00 0.00 H new ATOM 0 HA LEU A 681 -10.881 -4.349 -1.933 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -12.014 -5.095 -4.591 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -13.000 -5.478 -3.194 1.00 0.00 H new ATOM 0 HG LEU A 681 -12.685 -3.055 -2.489 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -12.256 -1.437 -4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -10.841 -2.449 -3.861 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -11.790 -2.759 -5.334 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -14.497 -2.292 -3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -14.235 -3.706 -4.987 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -14.768 -3.933 -3.304 1.00 0.00 H new ATOM 1791 N PRO A 682 -11.882 -6.574 -1.008 1.00 0.00 N ATOM 1792 CA PRO A 682 -12.028 -7.801 -0.196 1.00 0.00 C ATOM 1793 C PRO A 682 -12.498 -9.017 -0.954 1.00 0.00 C ATOM 1794 O PRO A 682 -12.376 -10.122 -0.448 1.00 0.00 O ATOM 1795 CB PRO A 682 -13.061 -7.422 0.854 1.00 0.00 C ATOM 1796 CG PRO A 682 -13.771 -6.245 0.298 1.00 0.00 C ATOM 1797 CD PRO A 682 -12.767 -5.497 -0.500 1.00 0.00 C ATOM 0 HA PRO A 682 -11.056 -8.098 0.198 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -13.751 -8.245 1.042 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -12.585 -7.181 1.805 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -14.611 -6.555 -0.324 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -14.177 -5.623 1.095 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -13.231 -4.938 -1.313 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -12.220 -4.778 0.110 1.00 0.00 H new ATOM 1805 N VAL A 683 -13.047 -8.794 -2.135 1.00 0.00 N ATOM 1806 CA VAL A 683 -13.523 -9.842 -3.051 1.00 0.00 C ATOM 1807 C VAL A 683 -14.420 -10.935 -2.415 1.00 0.00 C ATOM 1808 O VAL A 683 -13.958 -11.882 -1.777 1.00 0.00 O ATOM 1809 CB VAL A 683 -12.413 -10.440 -3.986 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -11.902 -9.385 -4.951 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -11.239 -11.065 -3.226 1.00 0.00 C ATOM 0 H VAL A 683 -13.183 -7.853 -2.504 1.00 0.00 H new ATOM 0 HA VAL A 683 -14.197 -9.285 -3.702 1.00 0.00 H new ATOM 0 HB VAL A 683 -12.892 -11.248 -4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -11.133 -9.819 -5.591 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -12.726 -9.026 -5.567 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -11.479 -8.552 -4.389 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -10.512 -11.457 -3.938 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -10.764 -10.307 -2.603 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -11.604 -11.876 -2.596 1.00 0.00 H new ATOM 1815 N CYS A 684 -15.705 -10.765 -2.588 1.00 0.00 N ATOM 1816 CA CYS A 684 -16.683 -11.702 -2.073 1.00 0.00 C ATOM 1817 C CYS A 684 -16.779 -12.878 -2.999 1.00 0.00 C ATOM 1818 O CYS A 684 -16.701 -12.726 -4.216 1.00 0.00 O ATOM 1819 CB CYS A 684 -18.039 -11.046 -2.012 1.00 0.00 C ATOM 1820 SG CYS A 684 -17.997 -9.293 -1.560 1.00 0.00 S ATOM 0 H CYS A 684 -16.108 -9.974 -3.090 1.00 0.00 H new ATOM 0 HA CYS A 684 -16.375 -12.020 -1.077 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -18.523 -11.148 -2.983 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -18.657 -11.581 -1.290 1.00 0.00 H new ATOM 1825 N ILE A 685 -16.941 -14.021 -2.427 1.00 0.00 N ATOM 1826 CA ILE A 685 -17.052 -15.266 -3.143 1.00 0.00 C ATOM 1827 C ILE A 685 -18.128 -16.061 -2.547 1.00 0.00 C ATOM 1828 O ILE A 685 -18.363 -15.981 -1.365 1.00 0.00 O ATOM 1829 CB ILE A 685 -15.734 -16.094 -3.200 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -15.150 -16.356 -1.785 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -14.705 -15.419 -4.105 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -14.415 -15.200 -1.165 1.00 0.00 C ATOM 0 H ILE A 685 -17.003 -14.129 -1.415 1.00 0.00 H new ATOM 0 HA ILE A 685 -17.277 -15.015 -4.179 1.00 0.00 H new ATOM 0 HB ILE A 685 -15.980 -17.066 -3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -15.966 -16.643 -1.122 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -14.471 -17.207 -1.843 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -13.794 -16.016 -4.128 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -15.109 -15.333 -5.114 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -14.478 -14.425 -3.719 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -14.048 -15.488 -0.180 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -13.573 -14.922 -1.799 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -15.090 -14.350 -1.066 1.00 0.00 H new ATOM 1839 N VAL A 686 -18.788 -16.781 -3.377 1.00 0.00 N ATOM 1840 CA VAL A 686 -19.893 -17.540 -3.072 1.00 0.00 C ATOM 1841 C VAL A 686 -19.701 -18.470 -1.847 1.00 0.00 C ATOM 1842 O VAL A 686 -18.718 -19.225 -1.750 1.00 0.00 O ATOM 1843 CB VAL A 686 -20.292 -18.305 -4.324 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -20.772 -17.368 -5.430 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -19.206 -19.259 -4.828 1.00 0.00 C ATOM 0 H VAL A 686 -18.529 -16.844 -4.362 1.00 0.00 H new ATOM 0 HA VAL A 686 -20.698 -16.873 -2.763 1.00 0.00 H new ATOM 0 HB VAL A 686 -21.131 -18.935 -4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -21.048 -17.952 -6.308 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -21.639 -16.807 -5.081 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -19.973 -16.675 -5.692 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -19.559 -19.771 -5.723 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -18.305 -18.692 -5.065 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -18.980 -19.994 -4.055 1.00 0.00 H new ATOM 1849 N GLU A 687 -20.614 -18.343 -0.902 1.00 0.00 N ATOM 1850 CA GLU A 687 -20.595 -19.112 0.312 1.00 0.00 C ATOM 1851 C GLU A 687 -21.463 -20.343 0.079 1.00 0.00 C ATOM 1852 O GLU A 687 -22.711 -20.231 0.113 1.00 0.00 O ATOM 1853 CB GLU A 687 -21.144 -18.250 1.475 1.00 0.00 C ATOM 1854 CG GLU A 687 -20.868 -18.752 2.906 1.00 0.00 C ATOM 1855 CD GLU A 687 -21.522 -20.062 3.271 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -22.715 -20.062 3.620 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -20.841 -21.114 3.238 1.00 0.00 O ATOM 1858 OXT GLU A 687 -20.910 -21.429 -0.158 1.00 0.00 O ATOM 0 H GLU A 687 -21.397 -17.692 -0.964 1.00 0.00 H new ATOM 0 HA GLU A 687 -19.583 -19.419 0.578 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -20.726 -17.248 1.381 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -22.223 -18.159 1.350 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -19.791 -18.855 3.035 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -21.202 -17.990 3.611 1.00 0.00 H new