USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=24 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= -3.25! K(o=-4!,f=0.27) USER MOD Set 1.2: A 679 THR OG1 : rot 140:sc= -0.716 USER MOD Set 2.1: A 651 HIS : no HE2:sc= -2.49 K(o=-2.5,f=-8.1!) USER MOD Set 2.2: A 652 SER OG : rot 180:sc=-0.000115 USER MOD Set 3.1: A 610 GLN : amide:sc= -1.18 K(o=-0.94,f=0.23) USER MOD Set 3.2: A 612 TYR OH : rot -50:sc= 0.241 USER MOD Single : A 573 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 577 HIS : no HD1:sc= -0.106 K(o=-0.11,f=-0.62) USER MOD Single : A 583 LYS NZ :NH3+ -164:sc= -0.0415 (180deg=-0.307) USER MOD Single : A 584 LYS NZ :NH3+ 147:sc= 1.2 (180deg=1.13) USER MOD Single : A 586 GLN : amide:sc= -2.18! K(o=-2.2!,f=-0.026) USER MOD Single : A 587 TYR OH : rot 151:sc= 0.013 USER MOD Single : A 588 LYS NZ :NH3+ -169:sc= 1.23 (180deg=0.986) USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 SER OG : rot 180:sc= 0 USER MOD Single : A 598 LYS NZ :NH3+ 171:sc=-0.000501 (180deg=-0.103) USER MOD Single : A 602 THR OG1 : rot -93:sc= 0 USER MOD Single : A 607 ASN : amide:sc= -0.523 K(o=-0.52,f=0) USER MOD Single : A 608 SER OG : 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 156:sc= 1.2 USER MOD Single : A 624 LYS NZ :NH3+ 179:sc= 1.13 (180deg=1.12) USER MOD Single : A 626 GLN : amide:sc= -1.19! K(o=-1.2!,f=-0.008) USER MOD Single : A 628 GLN : amide:sc= -1.7! K(o=-1.7!,f=-0.93) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -0.507 K(o=-0.51,f=0) USER MOD Single : A 640 ASN : amide:sc= -1.8 K(o=-1.8,f=-0.1) USER MOD Single : A 642 LYS NZ :NH3+ -146:sc= 2.41 (180deg=2.1) USER MOD Single : A 644 LYS NZ :NH3+ -144:sc= -1.7! (180deg=-3.86!) USER MOD Single : A 645 THR OG1 : rot 180:sc= 0.036 USER MOD Single : A 646 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 649 TYR OH : rot -77:sc= -1.08! USER MOD Single : A 657 TYR OH : rot -164:sc= -1.09 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= -1.37 K(o=-1.4,f=-4.8!) USER MOD Single : A 665 MET CE :methyl -110:sc= -0.657 (180deg=-9.12!) USER MOD Single : A 666 LYS NZ :NH3+ 166:sc= -0.0731 (180deg=-0.306) USER MOD Single : A 669 ASN : amide:sc= -0.349 X(o=-0.35,f=-0.51) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0.0564 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 26.347 -10.236 0.455 1.00 0.00 N ATOM 85 CA GLU A 568 24.989 -10.387 0.040 1.00 0.00 C ATOM 86 C GLU A 568 24.385 -9.011 -0.127 1.00 0.00 C ATOM 87 O GLU A 568 25.144 -8.045 -0.315 1.00 0.00 O ATOM 88 CB GLU A 568 24.231 -11.320 1.018 1.00 0.00 C ATOM 89 CG GLU A 568 24.535 -11.115 2.497 1.00 0.00 C ATOM 90 CD GLU A 568 24.120 -12.320 3.320 1.00 0.00 C ATOM 91 OE1 GLU A 568 24.652 -13.438 3.069 1.00 0.00 O ATOM 92 OE2 GLU A 568 23.307 -12.191 4.246 1.00 0.00 O ATOM 0 HA GLU A 568 24.915 -10.881 -0.929 1.00 0.00 H new ATOM 0 HB2 GLU A 568 23.160 -11.185 0.864 1.00 0.00 H new ATOM 0 HB3 GLU A 568 24.462 -12.353 0.758 1.00 0.00 H new ATOM 0 HG2 GLU A 568 25.601 -10.932 2.629 1.00 0.00 H new ATOM 0 HG3 GLU A 568 24.013 -10.229 2.858 1.00 0.00 H new ATOM 99 N CYS A 569 23.082 -8.901 -0.077 1.00 0.00 N ATOM 100 CA CYS A 569 22.401 -7.656 -0.343 1.00 0.00 C ATOM 101 C CYS A 569 22.823 -6.547 0.599 1.00 0.00 C ATOM 102 O CYS A 569 22.932 -6.745 1.795 1.00 0.00 O ATOM 103 CB CYS A 569 20.899 -7.866 -0.285 1.00 0.00 C ATOM 104 SG CYS A 569 20.256 -8.959 -1.561 1.00 0.00 S ATOM 0 H CYS A 569 22.459 -9.676 0.150 1.00 0.00 H new ATOM 0 HA CYS A 569 22.685 -7.337 -1.346 1.00 0.00 H new ATOM 0 HB2 CYS A 569 20.638 -8.274 0.692 1.00 0.00 H new ATOM 0 HB3 CYS A 569 20.405 -6.898 -0.369 1.00 0.00 H new ATOM 109 N GLU A 570 23.095 -5.408 0.046 1.00 0.00 N ATOM 110 CA GLU A 570 23.463 -4.264 0.820 1.00 0.00 C ATOM 111 C GLU A 570 22.228 -3.450 1.077 1.00 0.00 C ATOM 112 O GLU A 570 21.838 -3.260 2.212 1.00 0.00 O ATOM 113 CB GLU A 570 24.515 -3.452 0.074 1.00 0.00 C ATOM 114 CG GLU A 570 25.022 -2.239 0.818 1.00 0.00 C ATOM 115 CD GLU A 570 26.074 -1.515 0.038 1.00 0.00 C ATOM 116 OE1 GLU A 570 27.213 -1.994 -0.012 1.00 0.00 O ATOM 117 OE2 GLU A 570 25.785 -0.457 -0.550 1.00 0.00 O ATOM 0 H GLU A 570 23.068 -5.244 -0.960 1.00 0.00 H new ATOM 0 HA GLU A 570 23.895 -4.569 1.773 1.00 0.00 H new ATOM 0 HB2 GLU A 570 25.361 -4.101 -0.154 1.00 0.00 H new ATOM 0 HB3 GLU A 570 24.096 -3.128 -0.879 1.00 0.00 H new ATOM 0 HG2 GLU A 570 24.191 -1.564 1.024 1.00 0.00 H new ATOM 0 HG3 GLU A 570 25.429 -2.546 1.781 1.00 0.00 H new ATOM 124 N LEU A 571 21.654 -2.998 -0.014 1.00 0.00 N ATOM 125 CA LEU A 571 20.398 -2.219 -0.139 1.00 0.00 C ATOM 126 C LEU A 571 20.629 -1.394 -1.397 1.00 0.00 C ATOM 127 O LEU A 571 21.704 -0.796 -1.528 1.00 0.00 O ATOM 128 CB LEU A 571 20.184 -1.221 1.058 1.00 0.00 C ATOM 129 CG LEU A 571 18.741 -0.725 1.404 1.00 0.00 C ATOM 130 CD1 LEU A 571 18.781 0.133 2.649 1.00 0.00 C ATOM 131 CD2 LEU A 571 18.086 0.071 0.288 1.00 0.00 C ATOM 0 H LEU A 571 22.074 -3.170 -0.928 1.00 0.00 H new ATOM 0 HA LEU A 571 19.528 -2.876 -0.158 1.00 0.00 H new ATOM 0 HB2 LEU A 571 20.589 -1.694 1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 571 20.793 -0.339 0.860 1.00 0.00 H new ATOM 0 HG LEU A 571 18.141 -1.622 1.558 1.00 0.00 H new ATOM 0 HD11 LEU A 571 17.774 0.476 2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 571 19.171 -0.452 3.482 1.00 0.00 H new ATOM 0 HD13 LEU A 571 19.427 0.994 2.477 1.00 0.00 H new ATOM 0 HD21 LEU A 571 17.089 0.381 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 571 18.688 0.953 0.068 1.00 0.00 H new ATOM 0 HD23 LEU A 571 18.011 -0.549 -0.605 1.00 0.00 H new ATOM 143 N PRO A 572 19.705 -1.380 -2.353 1.00 0.00 N ATOM 144 CA PRO A 572 19.854 -0.557 -3.560 1.00 0.00 C ATOM 145 C PRO A 572 19.704 0.942 -3.238 1.00 0.00 C ATOM 146 O PRO A 572 19.667 1.353 -2.066 1.00 0.00 O ATOM 147 CB PRO A 572 18.690 -1.028 -4.433 1.00 0.00 C ATOM 148 CG PRO A 572 17.674 -1.468 -3.452 1.00 0.00 C ATOM 149 CD PRO A 572 18.451 -2.152 -2.382 1.00 0.00 C ATOM 0 HA PRO A 572 20.832 -0.664 -4.029 1.00 0.00 H new ATOM 0 HB2 PRO A 572 18.314 -0.225 -5.067 1.00 0.00 H new ATOM 0 HB3 PRO A 572 18.988 -1.842 -5.094 1.00 0.00 H new ATOM 0 HG2 PRO A 572 17.114 -0.621 -3.055 1.00 0.00 H new ATOM 0 HG3 PRO A 572 16.950 -2.143 -3.908 1.00 0.00 H new ATOM 0 HD2 PRO A 572 17.934 -2.122 -1.423 1.00 0.00 H new ATOM 0 HD3 PRO A 572 18.627 -3.202 -2.616 1.00 0.00 H new ATOM 157 N LYS A 573 19.633 1.749 -4.240 1.00 0.00 N ATOM 158 CA LYS A 573 19.446 3.151 -4.027 1.00 0.00 C ATOM 159 C LYS A 573 17.965 3.465 -4.055 1.00 0.00 C ATOM 160 O LYS A 573 17.341 3.483 -5.119 1.00 0.00 O ATOM 161 CB LYS A 573 20.202 3.996 -5.067 1.00 0.00 C ATOM 162 CG LYS A 573 21.693 3.668 -5.198 1.00 0.00 C ATOM 163 CD LYS A 573 22.406 3.700 -3.858 1.00 0.00 C ATOM 164 CE LYS A 573 23.891 3.428 -4.014 1.00 0.00 C ATOM 165 NZ LYS A 573 24.560 3.298 -2.708 1.00 0.00 N ATOM 0 H LYS A 573 19.701 1.466 -5.218 1.00 0.00 H new ATOM 0 HA LYS A 573 19.858 3.410 -3.051 1.00 0.00 H new ATOM 0 HB2 LYS A 573 19.728 3.861 -6.039 1.00 0.00 H new ATOM 0 HB3 LYS A 573 20.097 5.049 -4.805 1.00 0.00 H new ATOM 0 HG2 LYS A 573 21.808 2.681 -5.646 1.00 0.00 H new ATOM 0 HG3 LYS A 573 22.162 4.382 -5.875 1.00 0.00 H new ATOM 0 HD2 LYS A 573 22.260 4.673 -3.390 1.00 0.00 H new ATOM 0 HD3 LYS A 573 21.966 2.957 -3.192 1.00 0.00 H new ATOM 0 HE2 LYS A 573 24.035 2.514 -4.590 1.00 0.00 H new ATOM 0 HE3 LYS A 573 24.352 4.237 -4.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 25.573 3.113 -2.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 24.443 4.180 -2.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 24.137 2.510 -2.178 1.00 0.00 H new ATOM 179 N ILE A 574 17.394 3.644 -2.884 1.00 0.00 N ATOM 180 CA ILE A 574 15.984 3.997 -2.758 1.00 0.00 C ATOM 181 C ILE A 574 15.792 5.481 -3.101 1.00 0.00 C ATOM 182 O ILE A 574 16.681 6.127 -3.674 1.00 0.00 O ATOM 183 CB ILE A 574 15.458 3.763 -1.308 1.00 0.00 C ATOM 184 CG1 ILE A 574 16.325 4.554 -0.317 1.00 0.00 C ATOM 185 CG2 ILE A 574 15.473 2.280 -0.976 1.00 0.00 C ATOM 186 CD1 ILE A 574 15.761 4.626 1.063 1.00 0.00 C ATOM 0 H ILE A 574 17.884 3.551 -1.994 1.00 0.00 H new ATOM 0 HA ILE A 574 15.426 3.360 -3.444 1.00 0.00 H new ATOM 0 HB ILE A 574 14.429 4.114 -1.234 1.00 0.00 H new ATOM 0 HG12 ILE A 574 17.314 4.097 -0.271 1.00 0.00 H new ATOM 0 HG13 ILE A 574 16.459 5.567 -0.696 1.00 0.00 H new ATOM 0 HG21 ILE A 574 15.104 2.131 0.039 1.00 0.00 H new ATOM 0 HG22 ILE A 574 14.834 1.744 -1.678 1.00 0.00 H new ATOM 0 HG23 ILE A 574 16.492 1.901 -1.051 1.00 0.00 H new ATOM 0 HD11 ILE A 574 16.432 5.201 1.701 1.00 0.00 H new ATOM 0 HD12 ILE A 574 14.785 5.111 1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 574 15.653 3.619 1.465 1.00 0.00 H new ATOM 193 N ASP A 575 14.660 6.012 -2.734 1.00 0.00 N ATOM 194 CA ASP A 575 14.362 7.416 -2.966 1.00 0.00 C ATOM 195 C ASP A 575 15.033 8.237 -1.876 1.00 0.00 C ATOM 196 O ASP A 575 15.398 7.705 -0.822 1.00 0.00 O ATOM 197 CB ASP A 575 12.879 7.664 -2.857 1.00 0.00 C ATOM 198 CG ASP A 575 12.459 8.982 -3.460 1.00 0.00 C ATOM 199 OD1 ASP A 575 12.349 9.084 -4.701 1.00 0.00 O ATOM 200 OD2 ASP A 575 12.306 9.970 -2.702 1.00 0.00 O ATOM 0 H ASP A 575 13.915 5.495 -2.267 1.00 0.00 H new ATOM 0 HA ASP A 575 14.716 7.690 -3.960 1.00 0.00 H new ATOM 0 HB2 ASP A 575 12.343 6.855 -3.354 1.00 0.00 H new ATOM 0 HB3 ASP A 575 12.588 7.641 -1.807 1.00 0.00 H new ATOM 205 N VAL A 576 15.152 9.513 -2.092 1.00 0.00 N ATOM 206 CA VAL A 576 15.757 10.399 -1.124 1.00 0.00 C ATOM 207 C VAL A 576 14.803 10.644 0.067 1.00 0.00 C ATOM 208 O VAL A 576 15.238 10.861 1.197 1.00 0.00 O ATOM 209 CB VAL A 576 16.197 11.742 -1.784 1.00 0.00 C ATOM 210 CG1 VAL A 576 15.010 12.491 -2.366 1.00 0.00 C ATOM 211 CG2 VAL A 576 16.975 12.622 -0.814 1.00 0.00 C ATOM 0 H VAL A 576 14.834 9.976 -2.943 1.00 0.00 H new ATOM 0 HA VAL A 576 16.655 9.915 -0.740 1.00 0.00 H new ATOM 0 HB VAL A 576 16.867 11.488 -2.605 1.00 0.00 H new ATOM 0 HG11 VAL A 576 15.353 13.422 -2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 576 14.528 11.875 -3.125 1.00 0.00 H new ATOM 0 HG13 VAL A 576 14.296 12.714 -1.573 1.00 0.00 H new ATOM 0 HG21 VAL A 576 17.263 13.547 -1.313 1.00 0.00 H new ATOM 0 HG22 VAL A 576 16.350 12.854 0.048 1.00 0.00 H new ATOM 0 HG23 VAL A 576 17.870 12.095 -0.482 1.00 0.00 H new ATOM 215 N HIS A 577 13.506 10.557 -0.174 1.00 0.00 N ATOM 216 CA HIS A 577 12.530 10.781 0.885 1.00 0.00 C ATOM 217 C HIS A 577 11.987 9.488 1.411 1.00 0.00 C ATOM 218 O HIS A 577 11.064 9.482 2.211 1.00 0.00 O ATOM 219 CB HIS A 577 11.397 11.700 0.419 1.00 0.00 C ATOM 220 CG HIS A 577 11.802 13.134 0.337 1.00 0.00 C ATOM 221 ND1 HIS A 577 12.027 13.793 -0.846 1.00 0.00 N ATOM 222 CD2 HIS A 577 12.020 14.041 1.314 1.00 0.00 C ATOM 223 CE1 HIS A 577 12.372 15.036 -0.599 1.00 0.00 C ATOM 224 NE2 HIS A 577 12.374 15.209 0.706 1.00 0.00 N ATOM 0 H HIS A 577 13.104 10.335 -1.085 1.00 0.00 H new ATOM 0 HA HIS A 577 13.050 11.282 1.702 1.00 0.00 H new ATOM 0 HB2 HIS A 577 11.049 11.370 -0.560 1.00 0.00 H new ATOM 0 HB3 HIS A 577 10.555 11.605 1.105 1.00 0.00 H new ATOM 0 HD2 HIS A 577 11.931 13.873 2.377 1.00 0.00 H new ATOM 0 HE1 HIS A 577 12.612 15.786 -1.338 1.00 0.00 H new ATOM 0 HE2 HIS A 577 12.604 16.079 1.186 1.00 0.00 H new ATOM 233 N LEU A 578 12.594 8.416 0.994 1.00 0.00 N ATOM 234 CA LEU A 578 12.179 7.080 1.341 1.00 0.00 C ATOM 235 C LEU A 578 13.105 6.595 2.451 1.00 0.00 C ATOM 236 O LEU A 578 14.275 6.984 2.494 1.00 0.00 O ATOM 237 CB LEU A 578 12.334 6.230 0.059 1.00 0.00 C ATOM 238 CG LEU A 578 11.662 4.865 -0.089 1.00 0.00 C ATOM 239 CD1 LEU A 578 12.240 3.865 0.775 1.00 0.00 C ATOM 240 CD2 LEU A 578 10.179 4.943 0.034 1.00 0.00 C ATOM 0 H LEU A 578 13.413 8.443 0.387 1.00 0.00 H new ATOM 0 HA LEU A 578 11.150 7.019 1.695 1.00 0.00 H new ATOM 0 HB2 LEU A 578 11.985 6.845 -0.771 1.00 0.00 H new ATOM 0 HB3 LEU A 578 13.403 6.073 -0.088 1.00 0.00 H new ATOM 0 HG LEU A 578 11.865 4.535 -1.108 1.00 0.00 H new ATOM 0 HD11 LEU A 578 11.725 2.916 0.629 1.00 0.00 H new ATOM 0 HD12 LEU A 578 13.297 3.745 0.536 1.00 0.00 H new ATOM 0 HD13 LEU A 578 12.136 4.178 1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 578 9.752 3.947 -0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 578 9.916 5.342 1.014 1.00 0.00 H new ATOM 0 HD23 LEU A 578 9.783 5.598 -0.743 1.00 0.00 H new ATOM 252 N VAL A 579 12.584 5.804 3.341 1.00 0.00 N ATOM 253 CA VAL A 579 13.327 5.229 4.435 1.00 0.00 C ATOM 254 C VAL A 579 12.871 3.784 4.653 1.00 0.00 C ATOM 255 O VAL A 579 11.667 3.509 4.790 1.00 0.00 O ATOM 256 CB VAL A 579 13.206 6.050 5.783 1.00 0.00 C ATOM 257 CG1 VAL A 579 13.927 7.390 5.691 1.00 0.00 C ATOM 258 CG2 VAL A 579 11.748 6.279 6.181 1.00 0.00 C ATOM 0 H VAL A 579 11.602 5.530 3.330 1.00 0.00 H new ATOM 0 HA VAL A 579 14.380 5.260 4.156 1.00 0.00 H new ATOM 0 HB VAL A 579 13.685 5.446 6.554 1.00 0.00 H new ATOM 0 HG11 VAL A 579 13.822 7.925 6.635 1.00 0.00 H new ATOM 0 HG12 VAL A 579 14.984 7.221 5.485 1.00 0.00 H new ATOM 0 HG13 VAL A 579 13.491 7.983 4.887 1.00 0.00 H new ATOM 0 HG21 VAL A 579 11.709 6.846 7.111 1.00 0.00 H new ATOM 0 HG22 VAL A 579 11.240 6.837 5.395 1.00 0.00 H new ATOM 0 HG23 VAL A 579 11.254 5.318 6.321 1.00 0.00 H new ATOM 262 N PRO A 580 13.788 2.833 4.553 1.00 0.00 N ATOM 263 CA PRO A 580 13.493 1.443 4.856 1.00 0.00 C ATOM 264 C PRO A 580 13.342 1.216 6.371 1.00 0.00 C ATOM 265 O PRO A 580 14.133 1.712 7.169 1.00 0.00 O ATOM 266 CB PRO A 580 14.713 0.694 4.323 1.00 0.00 C ATOM 267 CG PRO A 580 15.815 1.695 4.360 1.00 0.00 C ATOM 268 CD PRO A 580 15.167 3.017 4.074 1.00 0.00 C ATOM 0 HA PRO A 580 12.554 1.112 4.413 1.00 0.00 H new ATOM 0 HB2 PRO A 580 14.945 -0.174 4.940 1.00 0.00 H new ATOM 0 HB3 PRO A 580 14.543 0.329 3.310 1.00 0.00 H new ATOM 0 HG2 PRO A 580 16.306 1.701 5.333 1.00 0.00 H new ATOM 0 HG3 PRO A 580 16.580 1.464 3.618 1.00 0.00 H new ATOM 0 HD2 PRO A 580 15.668 3.831 4.597 1.00 0.00 H new ATOM 0 HD3 PRO A 580 15.194 3.256 3.011 1.00 0.00 H new ATOM 276 N ASP A 581 12.336 0.462 6.730 1.00 0.00 N ATOM 277 CA ASP A 581 11.995 0.138 8.116 1.00 0.00 C ATOM 278 C ASP A 581 13.098 -0.688 8.765 1.00 0.00 C ATOM 279 O ASP A 581 13.432 -0.491 9.935 1.00 0.00 O ATOM 280 CB ASP A 581 10.674 -0.647 8.137 1.00 0.00 C ATOM 281 CG ASP A 581 10.123 -0.894 9.521 1.00 0.00 C ATOM 282 OD1 ASP A 581 10.443 -1.930 10.138 1.00 0.00 O ATOM 283 OD2 ASP A 581 9.297 -0.076 9.992 1.00 0.00 O ATOM 0 H ASP A 581 11.703 0.036 6.053 1.00 0.00 H new ATOM 0 HA ASP A 581 11.886 1.064 8.681 1.00 0.00 H new ATOM 0 HB2 ASP A 581 9.931 -0.102 7.554 1.00 0.00 H new ATOM 0 HB3 ASP A 581 10.826 -1.606 7.642 1.00 0.00 H new ATOM 288 N ARG A 582 13.675 -1.610 7.985 1.00 0.00 N ATOM 289 CA ARG A 582 14.750 -2.463 8.483 1.00 0.00 C ATOM 290 C ARG A 582 15.977 -1.631 8.751 1.00 0.00 C ATOM 291 O ARG A 582 16.441 -1.548 9.888 1.00 0.00 O ATOM 292 CB ARG A 582 15.110 -3.563 7.475 1.00 0.00 C ATOM 293 CG ARG A 582 13.983 -4.505 7.138 1.00 0.00 C ATOM 294 CD ARG A 582 13.501 -5.249 8.353 1.00 0.00 C ATOM 295 NE ARG A 582 12.310 -6.049 8.061 1.00 0.00 N ATOM 296 CZ ARG A 582 11.443 -6.488 8.980 1.00 0.00 C ATOM 297 NH1 ARG A 582 11.626 -6.204 10.260 1.00 0.00 N ATOM 298 NH2 ARG A 582 10.388 -7.180 8.617 1.00 0.00 N ATOM 0 H ARG A 582 13.415 -1.781 7.014 1.00 0.00 H new ATOM 0 HA ARG A 582 14.400 -2.933 9.402 1.00 0.00 H new ATOM 0 HB2 ARG A 582 15.459 -3.093 6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 582 15.943 -4.143 7.873 1.00 0.00 H new ATOM 0 HG2 ARG A 582 13.156 -3.943 6.703 1.00 0.00 H new ATOM 0 HG3 ARG A 582 14.317 -5.217 6.383 1.00 0.00 H new ATOM 0 HD2 ARG A 582 14.295 -5.899 8.720 1.00 0.00 H new ATOM 0 HD3 ARG A 582 13.276 -4.539 9.149 1.00 0.00 H new ATOM 0 HE ARG A 582 12.128 -6.289 7.086 1.00 0.00 H new ATOM 0 HH11 ARG A 582 12.431 -5.648 10.549 1.00 0.00 H new ATOM 0 HH12 ARG A 582 10.962 -6.541 10.957 1.00 0.00 H new ATOM 0 HH21 ARG A 582 10.227 -7.385 7.631 1.00 0.00 H new ATOM 0 HH22 ARG A 582 9.729 -7.513 9.321 1.00 0.00 H new ATOM 312 N LYS A 583 16.474 -1.008 7.681 1.00 0.00 N ATOM 313 CA LYS A 583 17.656 -0.170 7.700 1.00 0.00 C ATOM 314 C LYS A 583 18.824 -0.896 8.342 1.00 0.00 C ATOM 315 O LYS A 583 19.161 -0.691 9.519 1.00 0.00 O ATOM 316 CB LYS A 583 17.382 1.207 8.331 1.00 0.00 C ATOM 317 CG LYS A 583 18.563 2.129 8.389 1.00 0.00 C ATOM 318 CD LYS A 583 18.175 3.413 9.058 1.00 0.00 C ATOM 319 CE LYS A 583 19.346 4.340 9.174 1.00 0.00 C ATOM 320 NZ LYS A 583 20.437 3.776 10.004 1.00 0.00 N ATOM 0 H LYS A 583 16.048 -1.080 6.757 1.00 0.00 H new ATOM 0 HA LYS A 583 17.938 0.034 6.667 1.00 0.00 H new ATOM 0 HB2 LYS A 583 16.587 1.696 7.767 1.00 0.00 H new ATOM 0 HB3 LYS A 583 17.008 1.057 9.344 1.00 0.00 H new ATOM 0 HG2 LYS A 583 19.378 1.656 8.936 1.00 0.00 H new ATOM 0 HG3 LYS A 583 18.929 2.329 7.382 1.00 0.00 H new ATOM 0 HD2 LYS A 583 17.380 3.896 8.490 1.00 0.00 H new ATOM 0 HD3 LYS A 583 17.775 3.203 10.050 1.00 0.00 H new ATOM 0 HE2 LYS A 583 19.729 4.562 8.178 1.00 0.00 H new ATOM 0 HE3 LYS A 583 19.016 5.285 9.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 21.092 4.535 10.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 20.034 3.341 10.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 20.951 3.056 9.458 1.00 0.00 H new ATOM 334 N LYS A 584 19.355 -1.806 7.600 1.00 0.00 N ATOM 335 CA LYS A 584 20.472 -2.572 8.022 1.00 0.00 C ATOM 336 C LYS A 584 21.490 -2.545 6.902 1.00 0.00 C ATOM 337 O LYS A 584 21.131 -2.301 5.739 1.00 0.00 O ATOM 338 CB LYS A 584 20.053 -4.007 8.428 1.00 0.00 C ATOM 339 CG LYS A 584 19.373 -4.796 7.330 1.00 0.00 C ATOM 340 CD LYS A 584 18.988 -6.212 7.751 1.00 0.00 C ATOM 341 CE LYS A 584 17.728 -6.216 8.598 1.00 0.00 C ATOM 342 NZ LYS A 584 17.413 -7.553 9.152 1.00 0.00 N ATOM 0 H LYS A 584 19.018 -2.041 6.667 1.00 0.00 H new ATOM 0 HA LYS A 584 20.918 -2.145 8.920 1.00 0.00 H new ATOM 0 HB2 LYS A 584 20.939 -4.552 8.755 1.00 0.00 H new ATOM 0 HB3 LYS A 584 19.382 -3.947 9.285 1.00 0.00 H new ATOM 0 HG2 LYS A 584 18.477 -4.263 7.011 1.00 0.00 H new ATOM 0 HG3 LYS A 584 20.036 -4.849 6.467 1.00 0.00 H new ATOM 0 HD2 LYS A 584 18.834 -6.827 6.865 1.00 0.00 H new ATOM 0 HD3 LYS A 584 19.807 -6.661 8.313 1.00 0.00 H new ATOM 0 HE2 LYS A 584 17.844 -5.506 9.417 1.00 0.00 H new ATOM 0 HE3 LYS A 584 16.889 -5.871 7.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 16.964 -7.446 10.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 16.764 -8.051 8.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 18.290 -8.103 9.252 1.00 0.00 H new ATOM 356 N ASP A 585 22.731 -2.758 7.230 1.00 0.00 N ATOM 357 CA ASP A 585 23.806 -2.614 6.258 1.00 0.00 C ATOM 358 C ASP A 585 23.900 -3.771 5.293 1.00 0.00 C ATOM 359 O ASP A 585 24.337 -3.600 4.153 1.00 0.00 O ATOM 360 CB ASP A 585 25.141 -2.324 6.933 1.00 0.00 C ATOM 361 CG ASP A 585 25.149 -0.963 7.603 1.00 0.00 C ATOM 362 OD1 ASP A 585 25.333 0.050 6.907 1.00 0.00 O ATOM 363 OD2 ASP A 585 24.926 -0.885 8.836 1.00 0.00 O ATOM 0 H ASP A 585 23.037 -3.033 8.163 1.00 0.00 H new ATOM 0 HA ASP A 585 23.548 -1.745 5.652 1.00 0.00 H new ATOM 0 HB2 ASP A 585 25.349 -3.095 7.674 1.00 0.00 H new ATOM 0 HB3 ASP A 585 25.940 -2.370 6.193 1.00 0.00 H new ATOM 368 N GLN A 586 23.543 -4.953 5.748 1.00 0.00 N ATOM 369 CA GLN A 586 23.483 -6.111 4.869 1.00 0.00 C ATOM 370 C GLN A 586 22.206 -6.888 5.090 1.00 0.00 C ATOM 371 O GLN A 586 21.822 -7.162 6.227 1.00 0.00 O ATOM 372 CB GLN A 586 24.709 -7.058 4.977 1.00 0.00 C ATOM 373 CG GLN A 586 26.034 -6.449 4.526 1.00 0.00 C ATOM 374 CD GLN A 586 26.897 -5.921 5.668 1.00 0.00 C ATOM 375 OE1 GLN A 586 28.115 -5.890 5.576 1.00 0.00 O ATOM 376 NE2 GLN A 586 26.296 -5.568 6.751 1.00 0.00 N ATOM 0 H GLN A 586 23.290 -5.142 6.718 1.00 0.00 H new ATOM 0 HA GLN A 586 23.501 -5.706 3.857 1.00 0.00 H new ATOM 0 HB2 GLN A 586 24.809 -7.382 6.013 1.00 0.00 H new ATOM 0 HB3 GLN A 586 24.514 -7.950 4.381 1.00 0.00 H new ATOM 0 HG2 GLN A 586 26.599 -7.201 3.976 1.00 0.00 H new ATOM 0 HG3 GLN A 586 25.829 -5.634 3.832 1.00 0.00 H new ATOM 0 HE21 GLN A 586 25.278 -5.602 6.804 1.00 0.00 H new ATOM 0 HE22 GLN A 586 26.838 -5.254 7.556 1.00 0.00 H new ATOM 385 N TYR A 587 21.565 -7.227 4.010 1.00 0.00 N ATOM 386 CA TYR A 587 20.347 -7.982 4.011 1.00 0.00 C ATOM 387 C TYR A 587 20.628 -9.337 3.451 1.00 0.00 C ATOM 388 O TYR A 587 21.412 -9.480 2.510 1.00 0.00 O ATOM 389 CB TYR A 587 19.264 -7.327 3.146 1.00 0.00 C ATOM 390 CG TYR A 587 18.824 -5.963 3.592 1.00 0.00 C ATOM 391 CD1 TYR A 587 19.471 -4.845 3.139 1.00 0.00 C ATOM 392 CD2 TYR A 587 17.752 -5.798 4.456 1.00 0.00 C ATOM 393 CE1 TYR A 587 19.077 -3.584 3.527 1.00 0.00 C ATOM 394 CE2 TYR A 587 17.344 -4.541 4.849 1.00 0.00 C ATOM 395 CZ TYR A 587 18.010 -3.436 4.384 1.00 0.00 C ATOM 396 OH TYR A 587 17.612 -2.176 4.795 1.00 0.00 O ATOM 0 H TYR A 587 21.886 -6.977 3.075 1.00 0.00 H new ATOM 0 HA TYR A 587 19.985 -8.033 5.038 1.00 0.00 H new ATOM 0 HB2 TYR A 587 19.634 -7.255 2.123 1.00 0.00 H new ATOM 0 HB3 TYR A 587 18.393 -7.983 3.125 1.00 0.00 H new ATOM 0 HD1 TYR A 587 20.307 -4.954 2.464 1.00 0.00 H new ATOM 0 HD2 TYR A 587 17.229 -6.667 4.827 1.00 0.00 H new ATOM 0 HE1 TYR A 587 19.603 -2.715 3.161 1.00 0.00 H new ATOM 0 HE2 TYR A 587 16.505 -4.427 5.519 1.00 0.00 H new ATOM 0 HH TYR A 587 16.650 -2.181 4.980 1.00 0.00 H new ATOM 406 N LYS A 588 20.006 -10.308 4.004 1.00 0.00 N ATOM 407 CA LYS A 588 20.146 -11.639 3.535 1.00 0.00 C ATOM 408 C LYS A 588 19.033 -11.893 2.543 1.00 0.00 C ATOM 409 O LYS A 588 17.994 -11.229 2.595 1.00 0.00 O ATOM 410 CB LYS A 588 20.066 -12.595 4.714 1.00 0.00 C ATOM 411 CG LYS A 588 20.339 -14.043 4.369 1.00 0.00 C ATOM 412 CD LYS A 588 20.457 -14.889 5.616 1.00 0.00 C ATOM 413 CE LYS A 588 21.608 -14.416 6.502 1.00 0.00 C ATOM 414 NZ LYS A 588 22.916 -14.410 5.795 1.00 0.00 N ATOM 0 H LYS A 588 19.379 -10.204 4.802 1.00 0.00 H new ATOM 0 HA LYS A 588 21.108 -11.793 3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 588 20.779 -12.275 5.474 1.00 0.00 H new ATOM 0 HB3 LYS A 588 19.073 -12.522 5.158 1.00 0.00 H new ATOM 0 HG2 LYS A 588 19.536 -14.427 3.740 1.00 0.00 H new ATOM 0 HG3 LYS A 588 21.259 -14.114 3.790 1.00 0.00 H new ATOM 0 HD2 LYS A 588 19.523 -14.847 6.176 1.00 0.00 H new ATOM 0 HD3 LYS A 588 20.614 -15.931 5.337 1.00 0.00 H new ATOM 0 HE2 LYS A 588 21.392 -13.411 6.865 1.00 0.00 H new ATOM 0 HE3 LYS A 588 21.676 -15.063 7.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 23.682 -14.263 6.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 23.054 -15.321 5.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 22.928 -13.642 5.094 1.00 0.00 H new ATOM 428 N VAL A 589 19.243 -12.785 1.626 1.00 0.00 N ATOM 429 CA VAL A 589 18.223 -13.092 0.648 1.00 0.00 C ATOM 430 C VAL A 589 16.999 -13.703 1.290 1.00 0.00 C ATOM 431 O VAL A 589 17.063 -14.734 1.959 1.00 0.00 O ATOM 432 CB VAL A 589 18.761 -13.851 -0.612 1.00 0.00 C ATOM 433 CG1 VAL A 589 19.888 -14.743 -0.242 1.00 0.00 C ATOM 434 CG2 VAL A 589 17.676 -14.642 -1.332 1.00 0.00 C ATOM 0 H VAL A 589 20.107 -13.318 1.526 1.00 0.00 H new ATOM 0 HA VAL A 589 17.888 -12.142 0.232 1.00 0.00 H new ATOM 0 HB VAL A 589 19.116 -13.090 -1.308 1.00 0.00 H new ATOM 0 HG11 VAL A 589 20.248 -15.262 -1.130 1.00 0.00 H new ATOM 0 HG12 VAL A 589 20.697 -14.150 0.185 1.00 0.00 H new ATOM 0 HG13 VAL A 589 19.548 -15.474 0.492 1.00 0.00 H new ATOM 0 HG21 VAL A 589 18.107 -15.147 -2.197 1.00 0.00 H new ATOM 0 HG22 VAL A 589 17.254 -15.382 -0.652 1.00 0.00 H new ATOM 0 HG23 VAL A 589 16.890 -13.963 -1.663 1.00 0.00 H new ATOM 438 N GLY A 590 15.912 -12.992 1.140 1.00 0.00 N ATOM 439 CA GLY A 590 14.677 -13.359 1.751 1.00 0.00 C ATOM 440 C GLY A 590 14.279 -12.350 2.803 1.00 0.00 C ATOM 441 O GLY A 590 13.228 -12.477 3.433 1.00 0.00 O ATOM 0 H GLY A 590 15.866 -12.137 0.585 1.00 0.00 H new ATOM 0 HA2 GLY A 590 13.897 -13.428 0.993 1.00 0.00 H new ATOM 0 HA3 GLY A 590 14.769 -14.346 2.204 1.00 0.00 H new ATOM 445 N GLU A 591 15.143 -11.370 3.034 1.00 0.00 N ATOM 446 CA GLU A 591 14.816 -10.257 3.914 1.00 0.00 C ATOM 447 C GLU A 591 13.867 -9.338 3.220 1.00 0.00 C ATOM 448 O GLU A 591 14.059 -9.034 2.034 1.00 0.00 O ATOM 449 CB GLU A 591 16.063 -9.452 4.313 1.00 0.00 C ATOM 450 CG GLU A 591 16.939 -10.113 5.344 1.00 0.00 C ATOM 451 CD GLU A 591 16.245 -10.239 6.657 1.00 0.00 C ATOM 452 OE1 GLU A 591 15.470 -11.198 6.843 1.00 0.00 O ATOM 453 OE2 GLU A 591 16.429 -9.370 7.519 1.00 0.00 O ATOM 0 H GLU A 591 16.076 -11.324 2.624 1.00 0.00 H new ATOM 0 HA GLU A 591 14.370 -10.675 4.817 1.00 0.00 H new ATOM 0 HB2 GLU A 591 16.657 -9.263 3.419 1.00 0.00 H new ATOM 0 HB3 GLU A 591 15.745 -8.482 4.695 1.00 0.00 H new ATOM 0 HG2 GLU A 591 17.234 -11.102 4.992 1.00 0.00 H new ATOM 0 HG3 GLU A 591 17.854 -9.534 5.470 1.00 0.00 H new ATOM 460 N VAL A 592 12.845 -8.919 3.908 1.00 0.00 N ATOM 461 CA VAL A 592 11.945 -7.966 3.348 1.00 0.00 C ATOM 462 C VAL A 592 12.101 -6.648 4.043 1.00 0.00 C ATOM 463 O VAL A 592 12.147 -6.560 5.290 1.00 0.00 O ATOM 464 CB VAL A 592 10.456 -8.407 3.304 1.00 0.00 C ATOM 465 CG1 VAL A 592 10.305 -9.697 2.555 1.00 0.00 C ATOM 466 CG2 VAL A 592 9.833 -8.492 4.673 1.00 0.00 C ATOM 0 H VAL A 592 12.618 -9.224 4.855 1.00 0.00 H new ATOM 0 HA VAL A 592 12.227 -7.874 2.299 1.00 0.00 H new ATOM 0 HB VAL A 592 9.911 -7.630 2.767 1.00 0.00 H new ATOM 0 HG11 VAL A 592 9.254 -9.986 2.537 1.00 0.00 H new ATOM 0 HG12 VAL A 592 10.664 -9.569 1.534 1.00 0.00 H new ATOM 0 HG13 VAL A 592 10.887 -10.475 3.049 1.00 0.00 H new ATOM 0 HG21 VAL A 592 8.793 -8.804 4.581 1.00 0.00 H new ATOM 0 HG22 VAL A 592 10.378 -9.218 5.276 1.00 0.00 H new ATOM 0 HG23 VAL A 592 9.877 -7.515 5.154 1.00 0.00 H new ATOM 470 N LEU A 593 12.250 -5.641 3.268 1.00 0.00 N ATOM 471 CA LEU A 593 12.420 -4.365 3.779 1.00 0.00 C ATOM 472 C LEU A 593 11.338 -3.432 3.433 1.00 0.00 C ATOM 473 O LEU A 593 11.251 -2.939 2.309 1.00 0.00 O ATOM 474 CB LEU A 593 13.824 -3.768 3.662 1.00 0.00 C ATOM 475 CG LEU A 593 14.819 -4.203 2.603 1.00 0.00 C ATOM 476 CD1 LEU A 593 15.021 -5.701 2.345 1.00 0.00 C ATOM 477 CD2 LEU A 593 14.924 -3.326 1.410 1.00 0.00 C ATOM 0 H LEU A 593 12.255 -5.696 2.250 1.00 0.00 H new ATOM 0 HA LEU A 593 12.327 -4.528 4.853 1.00 0.00 H new ATOM 0 HB2 LEU A 593 13.694 -2.692 3.542 1.00 0.00 H new ATOM 0 HB3 LEU A 593 14.309 -3.925 4.626 1.00 0.00 H new ATOM 0 HG LEU A 593 15.736 -4.002 3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 593 15.764 -5.838 1.560 1.00 0.00 H new ATOM 0 HD12 LEU A 593 15.366 -6.184 3.259 1.00 0.00 H new ATOM 0 HD13 LEU A 593 14.077 -6.147 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 593 15.664 -3.735 0.722 1.00 0.00 H new ATOM 0 HD22 LEU A 593 13.956 -3.272 0.912 1.00 0.00 H new ATOM 0 HD23 LEU A 593 15.229 -2.326 1.719 1.00 0.00 H new ATOM 489 N LYS A 594 10.440 -3.279 4.383 1.00 0.00 N ATOM 490 CA LYS A 594 9.361 -2.346 4.283 1.00 0.00 C ATOM 491 C LYS A 594 9.898 -0.949 4.165 1.00 0.00 C ATOM 492 O LYS A 594 10.715 -0.535 4.949 1.00 0.00 O ATOM 493 CB LYS A 594 8.446 -2.469 5.486 1.00 0.00 C ATOM 494 CG LYS A 594 7.509 -3.652 5.393 1.00 0.00 C ATOM 495 CD LYS A 594 6.780 -3.911 6.693 1.00 0.00 C ATOM 496 CE LYS A 594 5.966 -2.713 7.209 1.00 0.00 C ATOM 497 NZ LYS A 594 4.911 -2.266 6.271 1.00 0.00 N ATOM 0 H LYS A 594 10.448 -3.810 5.254 1.00 0.00 H new ATOM 0 HA LYS A 594 8.781 -2.571 3.388 1.00 0.00 H new ATOM 0 HB2 LYS A 594 9.051 -2.561 6.388 1.00 0.00 H new ATOM 0 HB3 LYS A 594 7.861 -1.555 5.586 1.00 0.00 H new ATOM 0 HG2 LYS A 594 6.782 -3.475 4.600 1.00 0.00 H new ATOM 0 HG3 LYS A 594 8.076 -4.540 5.114 1.00 0.00 H new ATOM 0 HD2 LYS A 594 6.110 -4.760 6.558 1.00 0.00 H new ATOM 0 HD3 LYS A 594 7.507 -4.197 7.453 1.00 0.00 H new ATOM 0 HE2 LYS A 594 5.506 -2.980 8.160 1.00 0.00 H new ATOM 0 HE3 LYS A 594 6.643 -1.881 7.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 4.402 -1.457 6.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 5.345 -1.981 5.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 4.243 -3.045 6.102 1.00 0.00 H new ATOM 511 N PHE A 595 9.507 -0.284 3.157 1.00 0.00 N ATOM 512 CA PHE A 595 9.890 1.061 2.927 1.00 0.00 C ATOM 513 C PHE A 595 8.763 1.955 3.226 1.00 0.00 C ATOM 514 O PHE A 595 7.618 1.504 3.318 1.00 0.00 O ATOM 515 CB PHE A 595 10.171 1.267 1.481 1.00 0.00 C ATOM 516 CG PHE A 595 11.291 0.491 0.928 1.00 0.00 C ATOM 517 CD1 PHE A 595 12.504 0.456 1.567 1.00 0.00 C ATOM 518 CD2 PHE A 595 11.137 -0.185 -0.246 1.00 0.00 C ATOM 519 CE1 PHE A 595 13.543 -0.245 1.041 1.00 0.00 C ATOM 520 CE2 PHE A 595 12.168 -0.881 -0.787 1.00 0.00 C ATOM 521 CZ PHE A 595 13.377 -0.914 -0.145 1.00 0.00 C ATOM 0 H PHE A 595 8.890 -0.665 2.439 1.00 0.00 H new ATOM 0 HA PHE A 595 10.761 1.268 3.549 1.00 0.00 H new ATOM 0 HB2 PHE A 595 9.271 1.022 0.917 1.00 0.00 H new ATOM 0 HB3 PHE A 595 10.372 2.326 1.317 1.00 0.00 H new ATOM 0 HD1 PHE A 595 12.635 0.990 2.496 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.183 -0.166 -0.751 1.00 0.00 H new ATOM 0 HE1 PHE A 595 14.493 -0.275 1.554 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.036 -1.407 -1.721 1.00 0.00 H new ATOM 0 HZ PHE A 595 14.200 -1.467 -0.573 1.00 0.00 H new ATOM 531 N SER A 596 9.063 3.209 3.355 1.00 0.00 N ATOM 532 CA SER A 596 8.095 4.220 3.424 1.00 0.00 C ATOM 533 C SER A 596 8.789 5.525 3.295 1.00 0.00 C ATOM 534 O SER A 596 9.987 5.581 3.359 1.00 0.00 O ATOM 535 CB SER A 596 7.218 4.127 4.679 1.00 0.00 C ATOM 536 OG SER A 596 8.030 4.064 5.849 1.00 0.00 O ATOM 0 H SER A 596 10.022 3.552 3.416 1.00 0.00 H new ATOM 0 HA SER A 596 7.388 4.103 2.603 1.00 0.00 H new ATOM 0 HB2 SER A 596 6.557 4.992 4.733 1.00 0.00 H new ATOM 0 HB3 SER A 596 6.582 3.243 4.622 1.00 0.00 H new ATOM 0 HG SER A 596 7.457 4.007 6.642 1.00 0.00 H new ATOM 542 N CYS A 597 8.055 6.519 3.077 1.00 0.00 N ATOM 543 CA CYS A 597 8.586 7.824 2.876 1.00 0.00 C ATOM 544 C CYS A 597 8.506 8.638 4.146 1.00 0.00 C ATOM 545 O CYS A 597 7.939 8.182 5.148 1.00 0.00 O ATOM 546 CB CYS A 597 7.812 8.494 1.761 1.00 0.00 C ATOM 547 SG CYS A 597 7.966 7.640 0.172 1.00 0.00 S ATOM 0 H CYS A 597 7.037 6.470 3.028 1.00 0.00 H new ATOM 0 HA CYS A 597 9.638 7.752 2.601 1.00 0.00 H new ATOM 0 HB2 CYS A 597 6.759 8.545 2.038 1.00 0.00 H new ATOM 0 HB3 CYS A 597 8.162 9.520 1.650 1.00 0.00 H new ATOM 552 N LYS A 598 9.100 9.819 4.104 1.00 0.00 N ATOM 553 CA LYS A 598 9.070 10.788 5.183 1.00 0.00 C ATOM 554 C LYS A 598 7.636 11.100 5.644 1.00 0.00 C ATOM 555 O LYS A 598 6.680 10.841 4.903 1.00 0.00 O ATOM 556 CB LYS A 598 9.824 12.045 4.764 1.00 0.00 C ATOM 557 CG LYS A 598 11.323 11.881 4.805 1.00 0.00 C ATOM 558 CD LYS A 598 11.813 11.501 6.203 1.00 0.00 C ATOM 559 CE LYS A 598 13.322 11.282 6.244 1.00 0.00 C ATOM 560 NZ LYS A 598 14.078 12.483 5.845 1.00 0.00 N ATOM 0 H LYS A 598 9.631 10.138 3.294 1.00 0.00 H new ATOM 0 HA LYS A 598 9.572 10.355 6.048 1.00 0.00 H new ATOM 0 HB2 LYS A 598 9.523 12.321 3.754 1.00 0.00 H new ATOM 0 HB3 LYS A 598 9.537 12.868 5.419 1.00 0.00 H new ATOM 0 HG2 LYS A 598 11.625 11.113 4.093 1.00 0.00 H new ATOM 0 HG3 LYS A 598 11.799 12.810 4.493 1.00 0.00 H new ATOM 0 HD2 LYS A 598 11.542 12.288 6.907 1.00 0.00 H new ATOM 0 HD3 LYS A 598 11.307 10.593 6.529 1.00 0.00 H new ATOM 0 HE2 LYS A 598 13.616 10.990 7.252 1.00 0.00 H new ATOM 0 HE3 LYS A 598 13.584 10.456 5.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 15.090 12.335 6.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 13.938 12.660 4.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 13.741 13.302 6.389 1.00 0.00 H new ATOM 574 N PRO A 599 7.458 11.706 6.848 1.00 0.00 N ATOM 575 CA PRO A 599 6.133 11.864 7.476 1.00 0.00 C ATOM 576 C PRO A 599 5.116 12.689 6.667 1.00 0.00 C ATOM 577 O PRO A 599 3.909 12.630 6.930 1.00 0.00 O ATOM 578 CB PRO A 599 6.419 12.510 8.838 1.00 0.00 C ATOM 579 CG PRO A 599 7.792 13.085 8.737 1.00 0.00 C ATOM 580 CD PRO A 599 8.529 12.307 7.682 1.00 0.00 C ATOM 0 HA PRO A 599 5.647 10.891 7.549 1.00 0.00 H new ATOM 0 HB2 PRO A 599 5.687 13.285 9.064 1.00 0.00 H new ATOM 0 HB3 PRO A 599 6.362 11.773 9.639 1.00 0.00 H new ATOM 0 HG2 PRO A 599 7.747 14.142 8.473 1.00 0.00 H new ATOM 0 HG3 PRO A 599 8.308 13.017 9.695 1.00 0.00 H new ATOM 0 HD2 PRO A 599 9.176 12.955 7.091 1.00 0.00 H new ATOM 0 HD3 PRO A 599 9.164 11.540 8.125 1.00 0.00 H new ATOM 588 N GLY A 600 5.588 13.446 5.706 1.00 0.00 N ATOM 589 CA GLY A 600 4.694 14.223 4.884 1.00 0.00 C ATOM 590 C GLY A 600 4.622 13.704 3.468 1.00 0.00 C ATOM 591 O GLY A 600 4.024 14.338 2.600 1.00 0.00 O ATOM 0 H GLY A 600 6.577 13.540 5.476 1.00 0.00 H new ATOM 0 HA2 GLY A 600 3.697 14.212 5.324 1.00 0.00 H new ATOM 0 HA3 GLY A 600 5.025 15.261 4.872 1.00 0.00 H new ATOM 595 N PHE A 601 5.216 12.554 3.227 1.00 0.00 N ATOM 596 CA PHE A 601 5.249 11.967 1.912 1.00 0.00 C ATOM 597 C PHE A 601 4.450 10.692 1.836 1.00 0.00 C ATOM 598 O PHE A 601 4.107 10.084 2.853 1.00 0.00 O ATOM 599 CB PHE A 601 6.680 11.681 1.484 1.00 0.00 C ATOM 600 CG PHE A 601 7.422 12.855 0.972 1.00 0.00 C ATOM 601 CD1 PHE A 601 7.888 13.831 1.816 1.00 0.00 C ATOM 602 CD2 PHE A 601 7.662 12.964 -0.371 1.00 0.00 C ATOM 603 CE1 PHE A 601 8.582 14.906 1.325 1.00 0.00 C ATOM 604 CE2 PHE A 601 8.355 14.033 -0.881 1.00 0.00 C ATOM 605 CZ PHE A 601 8.817 15.010 -0.028 1.00 0.00 C ATOM 0 H PHE A 601 5.690 12.002 3.942 1.00 0.00 H new ATOM 0 HA PHE A 601 4.799 12.695 1.237 1.00 0.00 H new ATOM 0 HB2 PHE A 601 7.223 11.268 2.334 1.00 0.00 H new ATOM 0 HB3 PHE A 601 6.666 10.912 0.711 1.00 0.00 H new ATOM 0 HD1 PHE A 601 7.706 13.751 2.878 1.00 0.00 H new ATOM 0 HD2 PHE A 601 7.300 12.197 -1.040 1.00 0.00 H new ATOM 0 HE1 PHE A 601 8.944 15.670 1.998 1.00 0.00 H new ATOM 0 HE2 PHE A 601 8.537 14.107 -1.943 1.00 0.00 H new ATOM 0 HZ PHE A 601 9.363 15.856 -0.419 1.00 0.00 H new ATOM 615 N THR A 602 4.154 10.328 0.638 1.00 0.00 N ATOM 616 CA THR A 602 3.473 9.138 0.284 1.00 0.00 C ATOM 617 C THR A 602 4.412 8.201 -0.474 1.00 0.00 C ATOM 618 O THR A 602 5.101 8.625 -1.410 1.00 0.00 O ATOM 619 CB THR A 602 2.257 9.481 -0.606 1.00 0.00 C ATOM 620 OG1 THR A 602 1.189 10.068 0.147 1.00 0.00 O ATOM 621 CG2 THR A 602 1.758 8.299 -1.399 1.00 0.00 C ATOM 0 H THR A 602 4.399 10.894 -0.174 1.00 0.00 H new ATOM 0 HA THR A 602 3.132 8.642 1.193 1.00 0.00 H new ATOM 0 HB THR A 602 2.617 10.221 -1.321 1.00 0.00 H new ATOM 0 HG1 THR A 602 0.565 9.368 0.430 1.00 0.00 H new ATOM 0 HG21 THR A 602 0.904 8.602 -2.004 1.00 0.00 H new ATOM 0 HG22 THR A 602 2.553 7.936 -2.050 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.456 7.504 -0.717 1.00 0.00 H new ATOM 629 N ILE A 603 4.435 6.956 -0.074 1.00 0.00 N ATOM 630 CA ILE A 603 5.219 5.961 -0.751 1.00 0.00 C ATOM 631 C ILE A 603 4.426 5.412 -1.955 1.00 0.00 C ATOM 632 O ILE A 603 3.283 4.943 -1.819 1.00 0.00 O ATOM 633 CB ILE A 603 5.666 4.808 0.210 1.00 0.00 C ATOM 634 CG1 ILE A 603 6.535 3.806 -0.550 1.00 0.00 C ATOM 635 CG2 ILE A 603 4.468 4.127 0.876 1.00 0.00 C ATOM 636 CD1 ILE A 603 7.044 2.648 0.283 1.00 0.00 C ATOM 0 H ILE A 603 3.912 6.606 0.728 1.00 0.00 H new ATOM 0 HA ILE A 603 6.134 6.433 -1.111 1.00 0.00 H new ATOM 0 HB ILE A 603 6.261 5.241 1.014 1.00 0.00 H new ATOM 0 HG12 ILE A 603 5.960 3.409 -1.386 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.389 4.334 -0.973 1.00 0.00 H new ATOM 0 HG21 ILE A 603 4.821 3.333 1.535 1.00 0.00 H new ATOM 0 HG22 ILE A 603 3.910 4.860 1.458 1.00 0.00 H new ATOM 0 HG23 ILE A 603 3.819 3.702 0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 603 7.650 1.990 -0.340 1.00 0.00 H new ATOM 0 HD12 ILE A 603 7.650 3.030 1.105 1.00 0.00 H new ATOM 0 HD13 ILE A 603 6.199 2.089 0.685 1.00 0.00 H new ATOM 643 N VAL A 604 4.995 5.524 -3.124 1.00 0.00 N ATOM 644 CA VAL A 604 4.338 5.061 -4.326 1.00 0.00 C ATOM 645 C VAL A 604 5.162 3.957 -4.973 1.00 0.00 C ATOM 646 O VAL A 604 6.274 4.194 -5.483 1.00 0.00 O ATOM 647 CB VAL A 604 4.086 6.215 -5.342 1.00 0.00 C ATOM 648 CG1 VAL A 604 3.318 5.720 -6.560 1.00 0.00 C ATOM 649 CG2 VAL A 604 3.336 7.362 -4.684 1.00 0.00 C ATOM 0 H VAL A 604 5.917 5.933 -3.275 1.00 0.00 H new ATOM 0 HA VAL A 604 3.363 4.669 -4.038 1.00 0.00 H new ATOM 0 HB VAL A 604 5.059 6.577 -5.674 1.00 0.00 H new ATOM 0 HG11 VAL A 604 3.158 6.548 -7.250 1.00 0.00 H new ATOM 0 HG12 VAL A 604 3.891 4.938 -7.058 1.00 0.00 H new ATOM 0 HG13 VAL A 604 2.355 5.319 -6.245 1.00 0.00 H new ATOM 0 HG21 VAL A 604 3.172 8.155 -5.413 1.00 0.00 H new ATOM 0 HG22 VAL A 604 2.375 7.004 -4.315 1.00 0.00 H new ATOM 0 HG23 VAL A 604 3.923 7.750 -3.851 1.00 0.00 H new ATOM 653 N GLY A 605 4.649 2.761 -4.911 1.00 0.00 N ATOM 654 CA GLY A 605 5.310 1.622 -5.477 1.00 0.00 C ATOM 655 C GLY A 605 5.311 0.494 -4.489 1.00 0.00 C ATOM 656 O GLY A 605 4.542 0.545 -3.533 1.00 0.00 O ATOM 0 H GLY A 605 3.757 2.549 -4.464 1.00 0.00 H new ATOM 0 HA2 GLY A 605 4.805 1.315 -6.393 1.00 0.00 H new ATOM 0 HA3 GLY A 605 6.333 1.881 -5.748 1.00 0.00 H new ATOM 660 N PRO A 606 6.138 -0.537 -4.689 1.00 0.00 N ATOM 661 CA PRO A 606 6.266 -1.655 -3.743 1.00 0.00 C ATOM 662 C PRO A 606 6.732 -1.157 -2.374 1.00 0.00 C ATOM 663 O PRO A 606 7.718 -0.437 -2.265 1.00 0.00 O ATOM 664 CB PRO A 606 7.342 -2.542 -4.378 1.00 0.00 C ATOM 665 CG PRO A 606 8.041 -1.653 -5.344 1.00 0.00 C ATOM 666 CD PRO A 606 7.011 -0.713 -5.853 1.00 0.00 C ATOM 0 HA PRO A 606 5.323 -2.175 -3.576 1.00 0.00 H new ATOM 0 HB2 PRO A 606 8.030 -2.929 -3.627 1.00 0.00 H new ATOM 0 HB3 PRO A 606 6.900 -3.403 -4.880 1.00 0.00 H new ATOM 0 HG2 PRO A 606 8.856 -1.115 -4.860 1.00 0.00 H new ATOM 0 HG3 PRO A 606 8.480 -2.230 -6.158 1.00 0.00 H new ATOM 0 HD2 PRO A 606 7.449 0.231 -6.178 1.00 0.00 H new ATOM 0 HD3 PRO A 606 6.472 -1.125 -6.706 1.00 0.00 H new ATOM 674 N ASN A 607 6.032 -1.533 -1.345 1.00 0.00 N ATOM 675 CA ASN A 607 6.330 -1.030 -0.015 1.00 0.00 C ATOM 676 C ASN A 607 7.233 -1.984 0.734 1.00 0.00 C ATOM 677 O ASN A 607 7.728 -1.656 1.781 1.00 0.00 O ATOM 678 CB ASN A 607 5.053 -0.797 0.825 1.00 0.00 C ATOM 679 CG ASN A 607 3.948 0.000 0.132 1.00 0.00 C ATOM 680 OD1 ASN A 607 2.759 -0.229 0.372 1.00 0.00 O ATOM 681 ND2 ASN A 607 4.309 0.932 -0.702 1.00 0.00 N ATOM 0 H ASN A 607 5.249 -2.185 -1.389 1.00 0.00 H new ATOM 0 HA ASN A 607 6.832 -0.073 -0.158 1.00 0.00 H new ATOM 0 HB2 ASN A 607 4.649 -1.766 1.118 1.00 0.00 H new ATOM 0 HB3 ASN A 607 5.332 -0.278 1.742 1.00 0.00 H new ATOM 0 HD21 ASN A 607 3.602 1.494 -1.176 1.00 0.00 H new ATOM 0 HD22 ASN A 607 5.299 1.100 -0.882 1.00 0.00 H new ATOM 688 N SER A 608 7.435 -3.156 0.201 1.00 0.00 N ATOM 689 CA SER A 608 8.250 -4.166 0.851 1.00 0.00 C ATOM 690 C SER A 608 8.930 -5.080 -0.165 1.00 0.00 C ATOM 691 O SER A 608 8.313 -6.001 -0.717 1.00 0.00 O ATOM 692 CB SER A 608 7.378 -4.930 1.869 1.00 0.00 C ATOM 693 OG SER A 608 6.059 -5.144 1.359 1.00 0.00 O ATOM 0 H SER A 608 7.044 -3.446 -0.695 1.00 0.00 H new ATOM 0 HA SER A 608 9.066 -3.689 1.394 1.00 0.00 H new ATOM 0 HB2 SER A 608 7.841 -5.889 2.102 1.00 0.00 H new ATOM 0 HB3 SER A 608 7.324 -4.367 2.801 1.00 0.00 H new ATOM 0 HG SER A 608 5.527 -5.631 2.022 1.00 0.00 H new ATOM 699 N VAL A 609 10.187 -4.788 -0.461 1.00 0.00 N ATOM 700 CA VAL A 609 10.945 -5.586 -1.415 1.00 0.00 C ATOM 701 C VAL A 609 11.718 -6.659 -0.684 1.00 0.00 C ATOM 702 O VAL A 609 11.824 -6.632 0.557 1.00 0.00 O ATOM 703 CB VAL A 609 11.932 -4.742 -2.280 1.00 0.00 C ATOM 704 CG1 VAL A 609 11.200 -3.634 -3.021 1.00 0.00 C ATOM 705 CG2 VAL A 609 13.065 -4.174 -1.448 1.00 0.00 C ATOM 0 H VAL A 609 10.703 -4.007 -0.056 1.00 0.00 H new ATOM 0 HA VAL A 609 10.218 -6.028 -2.096 1.00 0.00 H new ATOM 0 HB VAL A 609 12.371 -5.415 -3.017 1.00 0.00 H new ATOM 0 HG11 VAL A 609 11.912 -3.062 -3.616 1.00 0.00 H new ATOM 0 HG12 VAL A 609 10.447 -4.071 -3.677 1.00 0.00 H new ATOM 0 HG13 VAL A 609 10.715 -2.974 -2.302 1.00 0.00 H new ATOM 0 HG21 VAL A 609 13.730 -3.593 -2.087 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.657 -3.530 -0.669 1.00 0.00 H new ATOM 0 HG23 VAL A 609 13.624 -4.990 -0.989 1.00 0.00 H new ATOM 709 N GLN A 610 12.234 -7.591 -1.421 1.00 0.00 N ATOM 710 CA GLN A 610 12.990 -8.666 -0.873 1.00 0.00 C ATOM 711 C GLN A 610 14.400 -8.563 -1.327 1.00 0.00 C ATOM 712 O GLN A 610 14.700 -7.946 -2.356 1.00 0.00 O ATOM 713 CB GLN A 610 12.505 -10.041 -1.365 1.00 0.00 C ATOM 714 CG GLN A 610 11.187 -10.565 -0.863 1.00 0.00 C ATOM 715 CD GLN A 610 9.955 -9.824 -1.371 1.00 0.00 C ATOM 716 OE1 GLN A 610 9.411 -10.160 -2.416 1.00 0.00 O ATOM 717 NE2 GLN A 610 9.495 -8.848 -0.637 1.00 0.00 N ATOM 0 H GLN A 610 12.139 -7.625 -2.436 1.00 0.00 H new ATOM 0 HA GLN A 610 12.879 -8.592 0.209 1.00 0.00 H new ATOM 0 HB2 GLN A 610 12.453 -10.003 -2.453 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.271 -10.773 -1.108 1.00 0.00 H new ATOM 0 HG2 GLN A 610 11.101 -11.615 -1.144 1.00 0.00 H new ATOM 0 HG3 GLN A 610 11.190 -10.526 0.226 1.00 0.00 H new ATOM 0 HE21 GLN A 610 9.971 -8.592 0.228 1.00 0.00 H new ATOM 0 HE22 GLN A 610 8.659 -8.341 -0.928 1.00 0.00 H new ATOM 726 N CYS A 611 15.267 -9.133 -0.575 1.00 0.00 N ATOM 727 CA CYS A 611 16.565 -9.372 -1.089 1.00 0.00 C ATOM 728 C CYS A 611 16.515 -10.677 -1.833 1.00 0.00 C ATOM 729 O CYS A 611 15.950 -11.662 -1.335 1.00 0.00 O ATOM 730 CB CYS A 611 17.667 -9.390 -0.027 1.00 0.00 C ATOM 731 SG CYS A 611 19.170 -10.309 -0.516 1.00 0.00 S ATOM 0 H CYS A 611 15.107 -9.439 0.385 1.00 0.00 H new ATOM 0 HA CYS A 611 16.833 -8.543 -1.744 1.00 0.00 H new ATOM 0 HB2 CYS A 611 17.944 -8.363 0.209 1.00 0.00 H new ATOM 0 HB3 CYS A 611 17.268 -9.830 0.887 1.00 0.00 H new ATOM 736 N TYR A 612 17.014 -10.677 -3.016 1.00 0.00 N ATOM 737 CA TYR A 612 17.077 -11.866 -3.823 1.00 0.00 C ATOM 738 C TYR A 612 18.529 -12.211 -4.049 1.00 0.00 C ATOM 739 O TYR A 612 19.409 -11.433 -3.674 1.00 0.00 O ATOM 740 CB TYR A 612 16.374 -11.661 -5.161 1.00 0.00 C ATOM 741 CG TYR A 612 14.866 -11.599 -5.077 1.00 0.00 C ATOM 742 CD1 TYR A 612 14.202 -10.417 -4.813 1.00 0.00 C ATOM 743 CD2 TYR A 612 14.107 -12.743 -5.272 1.00 0.00 C ATOM 744 CE1 TYR A 612 12.828 -10.381 -4.744 1.00 0.00 C ATOM 745 CE2 TYR A 612 12.735 -12.714 -5.204 1.00 0.00 C ATOM 746 CZ TYR A 612 12.099 -11.530 -4.941 1.00 0.00 C ATOM 747 OH TYR A 612 10.725 -11.488 -4.880 1.00 0.00 O ATOM 0 H TYR A 612 17.398 -9.847 -3.467 1.00 0.00 H new ATOM 0 HA TYR A 612 16.569 -12.680 -3.305 1.00 0.00 H new ATOM 0 HB2 TYR A 612 16.738 -10.737 -5.610 1.00 0.00 H new ATOM 0 HB3 TYR A 612 16.654 -12.473 -5.832 1.00 0.00 H new ATOM 0 HD1 TYR A 612 14.768 -9.510 -4.659 1.00 0.00 H new ATOM 0 HD2 TYR A 612 14.605 -13.678 -5.482 1.00 0.00 H new ATOM 0 HE1 TYR A 612 12.322 -9.450 -4.535 1.00 0.00 H new ATOM 0 HE2 TYR A 612 12.163 -13.617 -5.357 1.00 0.00 H new ATOM 0 HH TYR A 612 10.448 -11.030 -4.059 1.00 0.00 H new ATOM 757 N HIS A 613 18.810 -13.332 -4.686 1.00 0.00 N ATOM 758 CA HIS A 613 20.208 -13.719 -4.878 1.00 0.00 C ATOM 759 C HIS A 613 20.899 -12.854 -5.936 1.00 0.00 C ATOM 760 O HIS A 613 22.124 -12.843 -6.035 1.00 0.00 O ATOM 761 CB HIS A 613 20.423 -15.247 -5.128 1.00 0.00 C ATOM 762 CG HIS A 613 19.983 -15.814 -6.464 1.00 0.00 C ATOM 763 ND1 HIS A 613 20.860 -16.102 -7.467 1.00 0.00 N ATOM 764 CD2 HIS A 613 18.776 -16.204 -6.923 1.00 0.00 C ATOM 765 CE1 HIS A 613 20.230 -16.636 -8.478 1.00 0.00 C ATOM 766 NE2 HIS A 613 18.961 -16.716 -8.182 1.00 0.00 N ATOM 0 H HIS A 613 18.120 -13.977 -5.071 1.00 0.00 H new ATOM 0 HA HIS A 613 20.695 -13.522 -3.923 1.00 0.00 H new ATOM 0 HB2 HIS A 613 21.485 -15.460 -5.007 1.00 0.00 H new ATOM 0 HB3 HIS A 613 19.898 -15.792 -4.344 1.00 0.00 H new ATOM 0 HD2 HIS A 613 17.836 -16.127 -6.396 1.00 0.00 H new ATOM 0 HE1 HIS A 613 20.683 -16.958 -9.404 1.00 0.00 H new ATOM 0 HE2 HIS A 613 18.231 -17.095 -8.785 1.00 0.00 H new ATOM 775 N PHE A 614 20.102 -12.098 -6.692 1.00 0.00 N ATOM 776 CA PHE A 614 20.649 -11.204 -7.698 1.00 0.00 C ATOM 777 C PHE A 614 20.668 -9.754 -7.199 1.00 0.00 C ATOM 778 O PHE A 614 21.158 -8.851 -7.881 1.00 0.00 O ATOM 779 CB PHE A 614 19.891 -11.315 -9.040 1.00 0.00 C ATOM 780 CG PHE A 614 18.503 -10.742 -9.063 1.00 0.00 C ATOM 781 CD1 PHE A 614 17.449 -11.392 -8.466 1.00 0.00 C ATOM 782 CD2 PHE A 614 18.259 -9.549 -9.709 1.00 0.00 C ATOM 783 CE1 PHE A 614 16.190 -10.869 -8.509 1.00 0.00 C ATOM 784 CE2 PHE A 614 17.003 -9.022 -9.760 1.00 0.00 C ATOM 785 CZ PHE A 614 15.959 -9.684 -9.158 1.00 0.00 C ATOM 0 H PHE A 614 19.084 -12.090 -6.624 1.00 0.00 H new ATOM 0 HA PHE A 614 21.678 -11.515 -7.878 1.00 0.00 H new ATOM 0 HB2 PHE A 614 20.481 -10.817 -9.810 1.00 0.00 H new ATOM 0 HB3 PHE A 614 19.832 -12.368 -9.315 1.00 0.00 H new ATOM 0 HD1 PHE A 614 17.620 -12.329 -7.956 1.00 0.00 H new ATOM 0 HD2 PHE A 614 19.076 -9.024 -10.182 1.00 0.00 H new ATOM 0 HE1 PHE A 614 15.374 -11.390 -8.031 1.00 0.00 H new ATOM 0 HE2 PHE A 614 16.828 -8.087 -10.272 1.00 0.00 H new ATOM 0 HZ PHE A 614 14.961 -9.272 -9.196 1.00 0.00 H new ATOM 795 N GLY A 615 20.163 -9.541 -6.007 1.00 0.00 N ATOM 796 CA GLY A 615 20.089 -8.211 -5.449 1.00 0.00 C ATOM 797 C GLY A 615 18.721 -7.963 -4.888 1.00 0.00 C ATOM 798 O GLY A 615 17.921 -8.879 -4.830 1.00 0.00 O ATOM 0 H GLY A 615 19.795 -10.275 -5.402 1.00 0.00 H new ATOM 0 HA2 GLY A 615 20.838 -8.095 -4.666 1.00 0.00 H new ATOM 0 HA3 GLY A 615 20.314 -7.472 -6.218 1.00 0.00 H new ATOM 802 N LEU A 616 18.430 -6.757 -4.492 1.00 0.00 N ATOM 803 CA LEU A 616 17.137 -6.461 -3.925 1.00 0.00 C ATOM 804 C LEU A 616 16.165 -6.115 -5.015 1.00 0.00 C ATOM 805 O LEU A 616 16.503 -5.387 -5.969 1.00 0.00 O ATOM 806 CB LEU A 616 17.185 -5.343 -2.890 1.00 0.00 C ATOM 807 CG LEU A 616 18.045 -5.615 -1.678 1.00 0.00 C ATOM 808 CD1 LEU A 616 19.505 -5.396 -1.905 1.00 0.00 C ATOM 809 CD2 LEU A 616 17.512 -5.000 -0.437 1.00 0.00 C ATOM 0 H LEU A 616 19.066 -5.962 -4.549 1.00 0.00 H new ATOM 0 HA LEU A 616 16.805 -7.359 -3.404 1.00 0.00 H new ATOM 0 HB2 LEU A 616 17.548 -4.437 -3.376 1.00 0.00 H new ATOM 0 HB3 LEU A 616 16.168 -5.139 -2.554 1.00 0.00 H new ATOM 0 HG LEU A 616 17.974 -6.689 -1.507 1.00 0.00 H new ATOM 0 HD11 LEU A 616 20.052 -5.613 -0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 616 19.853 -6.056 -2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 616 19.677 -4.359 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 616 18.174 -5.232 0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 616 17.452 -3.919 -0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 616 16.518 -5.397 -0.232 1.00 0.00 H new ATOM 821 N SER A 617 14.990 -6.628 -4.892 1.00 0.00 N ATOM 822 CA SER A 617 13.937 -6.468 -5.879 1.00 0.00 C ATOM 823 C SER A 617 12.570 -6.708 -5.235 1.00 0.00 C ATOM 824 O SER A 617 12.493 -7.348 -4.183 1.00 0.00 O ATOM 825 CB SER A 617 14.196 -7.388 -7.101 1.00 0.00 C ATOM 826 OG SER A 617 15.305 -6.901 -7.853 1.00 0.00 O ATOM 0 H SER A 617 14.711 -7.188 -4.087 1.00 0.00 H new ATOM 0 HA SER A 617 13.939 -5.444 -6.252 1.00 0.00 H new ATOM 0 HB2 SER A 617 14.393 -8.406 -6.765 1.00 0.00 H new ATOM 0 HB3 SER A 617 13.308 -7.427 -7.732 1.00 0.00 H new ATOM 0 HG SER A 617 15.707 -7.638 -8.358 1.00 0.00 H new ATOM 832 N PRO A 618 11.466 -6.176 -5.807 1.00 0.00 N ATOM 833 CA PRO A 618 11.467 -5.370 -7.064 1.00 0.00 C ATOM 834 C PRO A 618 12.138 -3.975 -6.928 1.00 0.00 C ATOM 835 O PRO A 618 12.835 -3.701 -5.945 1.00 0.00 O ATOM 836 CB PRO A 618 9.976 -5.216 -7.359 1.00 0.00 C ATOM 837 CG PRO A 618 9.322 -5.312 -6.032 1.00 0.00 C ATOM 838 CD PRO A 618 10.105 -6.330 -5.272 1.00 0.00 C ATOM 0 HA PRO A 618 12.047 -5.858 -7.847 1.00 0.00 H new ATOM 0 HB2 PRO A 618 9.763 -4.260 -7.838 1.00 0.00 H new ATOM 0 HB3 PRO A 618 9.622 -5.996 -8.033 1.00 0.00 H new ATOM 0 HG2 PRO A 618 9.330 -4.349 -5.521 1.00 0.00 H new ATOM 0 HG3 PRO A 618 8.279 -5.613 -6.130 1.00 0.00 H new ATOM 0 HD2 PRO A 618 10.071 -6.145 -4.198 1.00 0.00 H new ATOM 0 HD3 PRO A 618 9.720 -7.337 -5.434 1.00 0.00 H new ATOM 846 N ASP A 619 11.952 -3.126 -7.939 1.00 0.00 N ATOM 847 CA ASP A 619 12.531 -1.770 -7.938 1.00 0.00 C ATOM 848 C ASP A 619 11.945 -0.934 -6.808 1.00 0.00 C ATOM 849 O ASP A 619 10.885 -1.245 -6.277 1.00 0.00 O ATOM 850 CB ASP A 619 12.388 -1.045 -9.305 1.00 0.00 C ATOM 851 CG ASP A 619 10.972 -0.627 -9.671 1.00 0.00 C ATOM 852 OD1 ASP A 619 10.173 -1.484 -10.097 1.00 0.00 O ATOM 853 OD2 ASP A 619 10.648 0.586 -9.595 1.00 0.00 O ATOM 0 H ASP A 619 11.406 -3.347 -8.772 1.00 0.00 H new ATOM 0 HA ASP A 619 13.601 -1.888 -7.768 1.00 0.00 H new ATOM 0 HB2 ASP A 619 13.021 -0.158 -9.295 1.00 0.00 H new ATOM 0 HB3 ASP A 619 12.770 -1.700 -10.088 1.00 0.00 H new ATOM 858 N LEU A 620 12.629 0.120 -6.461 1.00 0.00 N ATOM 859 CA LEU A 620 12.299 0.902 -5.285 1.00 0.00 C ATOM 860 C LEU A 620 11.127 1.829 -5.509 1.00 0.00 C ATOM 861 O LEU A 620 10.923 2.351 -6.608 1.00 0.00 O ATOM 862 CB LEU A 620 13.523 1.703 -4.784 1.00 0.00 C ATOM 863 CG LEU A 620 14.777 0.897 -4.410 1.00 0.00 C ATOM 864 CD1 LEU A 620 14.424 -0.286 -3.528 1.00 0.00 C ATOM 865 CD2 LEU A 620 15.579 0.469 -5.640 1.00 0.00 C ATOM 0 H LEU A 620 13.434 0.468 -6.981 1.00 0.00 H new ATOM 0 HA LEU A 620 12.005 0.186 -4.517 1.00 0.00 H new ATOM 0 HB2 LEU A 620 13.799 2.420 -5.558 1.00 0.00 H new ATOM 0 HB3 LEU A 620 13.217 2.279 -3.911 1.00 0.00 H new ATOM 0 HG LEU A 620 15.425 1.558 -3.834 1.00 0.00 H new ATOM 0 HD11 LEU A 620 15.331 -0.838 -3.279 1.00 0.00 H new ATOM 0 HD12 LEU A 620 13.954 0.071 -2.612 1.00 0.00 H new ATOM 0 HD13 LEU A 620 13.734 -0.942 -4.058 1.00 0.00 H new ATOM 0 HD21 LEU A 620 16.455 -0.097 -5.324 1.00 0.00 H new ATOM 0 HD22 LEU A 620 14.956 -0.154 -6.282 1.00 0.00 H new ATOM 0 HD23 LEU A 620 15.898 1.353 -6.192 1.00 0.00 H new ATOM 877 N PRO A 621 10.316 2.012 -4.481 1.00 0.00 N ATOM 878 CA PRO A 621 9.209 2.940 -4.508 1.00 0.00 C ATOM 879 C PRO A 621 9.707 4.382 -4.519 1.00 0.00 C ATOM 880 O PRO A 621 10.867 4.660 -4.186 1.00 0.00 O ATOM 881 CB PRO A 621 8.490 2.668 -3.192 1.00 0.00 C ATOM 882 CG PRO A 621 9.537 2.120 -2.313 1.00 0.00 C ATOM 883 CD PRO A 621 10.410 1.314 -3.200 1.00 0.00 C ATOM 0 HA PRO A 621 8.582 2.814 -5.391 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.060 3.580 -2.778 1.00 0.00 H new ATOM 0 HB3 PRO A 621 7.671 1.961 -3.325 1.00 0.00 H new ATOM 0 HG2 PRO A 621 10.099 2.917 -1.827 1.00 0.00 H new ATOM 0 HG3 PRO A 621 9.105 1.506 -1.522 1.00 0.00 H new ATOM 0 HD2 PRO A 621 11.436 1.280 -2.834 1.00 0.00 H new ATOM 0 HD3 PRO A 621 10.065 0.283 -3.276 1.00 0.00 H new ATOM 891 N ILE A 622 8.848 5.272 -4.891 1.00 0.00 N ATOM 892 CA ILE A 622 9.167 6.674 -4.919 1.00 0.00 C ATOM 893 C ILE A 622 8.382 7.361 -3.819 1.00 0.00 C ATOM 894 O ILE A 622 7.593 6.710 -3.111 1.00 0.00 O ATOM 895 CB ILE A 622 8.784 7.332 -6.263 1.00 0.00 C ATOM 896 CG1 ILE A 622 7.273 7.233 -6.471 1.00 0.00 C ATOM 897 CG2 ILE A 622 9.544 6.681 -7.418 1.00 0.00 C ATOM 898 CD1 ILE A 622 6.735 8.101 -7.583 1.00 0.00 C ATOM 0 H ILE A 622 7.897 5.053 -5.187 1.00 0.00 H new ATOM 0 HA ILE A 622 10.243 6.778 -4.783 1.00 0.00 H new ATOM 0 HB ILE A 622 9.064 8.385 -6.238 1.00 0.00 H new ATOM 0 HG12 ILE A 622 7.015 6.195 -6.681 1.00 0.00 H new ATOM 0 HG13 ILE A 622 6.773 7.504 -5.541 1.00 0.00 H new ATOM 0 HG21 ILE A 622 9.260 7.159 -8.356 1.00 0.00 H new ATOM 0 HG22 ILE A 622 10.616 6.799 -7.261 1.00 0.00 H new ATOM 0 HG23 ILE A 622 9.299 5.620 -7.463 1.00 0.00 H new ATOM 0 HD11 ILE A 622 5.656 7.967 -7.659 1.00 0.00 H new ATOM 0 HD12 ILE A 622 6.957 9.146 -7.368 1.00 0.00 H new ATOM 0 HD13 ILE A 622 7.203 7.817 -8.525 1.00 0.00 H new ATOM 905 N CYS A 623 8.532 8.650 -3.718 1.00 0.00 N ATOM 906 CA CYS A 623 7.867 9.411 -2.711 1.00 0.00 C ATOM 907 C CYS A 623 7.154 10.613 -3.296 1.00 0.00 C ATOM 908 O CYS A 623 7.780 11.519 -3.863 1.00 0.00 O ATOM 909 CB CYS A 623 8.862 9.865 -1.660 1.00 0.00 C ATOM 910 SG CYS A 623 9.577 8.512 -0.700 1.00 0.00 S ATOM 0 H CYS A 623 9.124 9.202 -4.338 1.00 0.00 H new ATOM 0 HA CYS A 623 7.117 8.767 -2.252 1.00 0.00 H new ATOM 0 HB2 CYS A 623 9.666 10.416 -2.148 1.00 0.00 H new ATOM 0 HB3 CYS A 623 8.367 10.559 -0.980 1.00 0.00 H new ATOM 915 N LYS A 624 5.857 10.625 -3.171 1.00 0.00 N ATOM 916 CA LYS A 624 5.065 11.750 -3.587 1.00 0.00 C ATOM 917 C LYS A 624 4.658 12.490 -2.374 1.00 0.00 C ATOM 918 O LYS A 624 4.193 11.898 -1.441 1.00 0.00 O ATOM 919 CB LYS A 624 3.826 11.339 -4.368 1.00 0.00 C ATOM 920 CG LYS A 624 4.101 10.823 -5.768 1.00 0.00 C ATOM 921 CD LYS A 624 2.805 10.671 -6.548 1.00 0.00 C ATOM 922 CE LYS A 624 2.080 12.014 -6.656 1.00 0.00 C ATOM 923 NZ LYS A 624 0.812 11.919 -7.372 1.00 0.00 N ATOM 0 H LYS A 624 5.317 9.854 -2.777 1.00 0.00 H new ATOM 0 HA LYS A 624 5.667 12.367 -4.254 1.00 0.00 H new ATOM 0 HB2 LYS A 624 3.300 10.566 -3.808 1.00 0.00 H new ATOM 0 HB3 LYS A 624 3.156 12.196 -4.436 1.00 0.00 H new ATOM 0 HG2 LYS A 624 4.767 11.510 -6.290 1.00 0.00 H new ATOM 0 HG3 LYS A 624 4.613 9.862 -5.713 1.00 0.00 H new ATOM 0 HD2 LYS A 624 3.018 10.285 -7.545 1.00 0.00 H new ATOM 0 HD3 LYS A 624 2.161 9.943 -6.055 1.00 0.00 H new ATOM 0 HE2 LYS A 624 1.898 12.404 -5.655 1.00 0.00 H new ATOM 0 HE3 LYS A 624 2.726 12.730 -7.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 0.358 12.854 -7.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 0.986 11.590 -8.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 0.188 11.245 -6.884 1.00 0.00 H new ATOM 937 N GLU A 625 4.845 13.756 -2.352 1.00 0.00 N ATOM 938 CA GLU A 625 4.496 14.507 -1.173 1.00 0.00 C ATOM 939 C GLU A 625 3.043 14.880 -1.289 1.00 0.00 C ATOM 940 O GLU A 625 2.269 14.822 -0.325 1.00 0.00 O ATOM 941 CB GLU A 625 5.352 15.756 -1.064 1.00 0.00 C ATOM 942 CG GLU A 625 5.319 16.422 0.290 1.00 0.00 C ATOM 943 CD GLU A 625 5.956 17.785 0.278 1.00 0.00 C ATOM 944 OE1 GLU A 625 7.172 17.895 0.020 1.00 0.00 O ATOM 945 OE2 GLU A 625 5.265 18.777 0.564 1.00 0.00 O ATOM 0 H GLU A 625 5.233 14.304 -3.120 1.00 0.00 H new ATOM 0 HA GLU A 625 4.669 13.910 -0.278 1.00 0.00 H new ATOM 0 HB2 GLU A 625 6.383 15.496 -1.302 1.00 0.00 H new ATOM 0 HB3 GLU A 625 5.023 16.473 -1.816 1.00 0.00 H new ATOM 0 HG2 GLU A 625 4.285 16.511 0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 625 5.833 15.791 1.014 1.00 0.00 H new ATOM 952 N GLN A 626 2.682 15.227 -2.481 1.00 0.00 N ATOM 953 CA GLN A 626 1.350 15.609 -2.796 1.00 0.00 C ATOM 954 C GLN A 626 0.676 14.412 -3.384 1.00 0.00 C ATOM 955 O GLN A 626 1.017 13.995 -4.488 1.00 0.00 O ATOM 956 CB GLN A 626 1.366 16.717 -3.826 1.00 0.00 C ATOM 957 CG GLN A 626 2.242 17.899 -3.450 1.00 0.00 C ATOM 958 CD GLN A 626 2.264 18.973 -4.510 1.00 0.00 C ATOM 959 OE1 GLN A 626 2.451 20.153 -4.209 1.00 0.00 O ATOM 960 NE2 GLN A 626 2.065 18.588 -5.749 1.00 0.00 N ATOM 0 H GLN A 626 3.320 15.252 -3.277 1.00 0.00 H new ATOM 0 HA GLN A 626 0.831 15.962 -1.905 1.00 0.00 H new ATOM 0 HB2 GLN A 626 1.711 16.310 -4.776 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.346 17.069 -3.982 1.00 0.00 H new ATOM 0 HG2 GLN A 626 1.884 18.327 -2.514 1.00 0.00 H new ATOM 0 HG3 GLN A 626 3.259 17.549 -3.273 1.00 0.00 H new ATOM 0 HE21 GLN A 626 1.914 17.601 -5.958 1.00 0.00 H new ATOM 0 HE22 GLN A 626 2.062 19.276 -6.502 1.00 0.00 H new ATOM 969 N VAL A 627 -0.207 13.812 -2.657 1.00 0.00 N ATOM 970 CA VAL A 627 -0.890 12.671 -3.180 1.00 0.00 C ATOM 971 C VAL A 627 -2.332 13.092 -3.505 1.00 0.00 C ATOM 972 O VAL A 627 -2.706 14.260 -3.274 1.00 0.00 O ATOM 973 CB VAL A 627 -0.829 11.457 -2.190 1.00 0.00 C ATOM 974 CG1 VAL A 627 -1.811 11.536 -1.062 1.00 0.00 C ATOM 975 CG2 VAL A 627 -0.896 10.149 -2.914 1.00 0.00 C ATOM 0 H VAL A 627 -0.472 14.086 -1.711 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.402 12.326 -4.091 1.00 0.00 H new ATOM 0 HB VAL A 627 0.148 11.519 -1.711 1.00 0.00 H new ATOM 0 HG11 VAL A 627 -1.704 10.659 -0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 627 -1.621 12.436 -0.477 1.00 0.00 H new ATOM 0 HG13 VAL A 627 -2.824 11.571 -1.463 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -0.851 9.332 -2.194 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -1.830 10.090 -3.472 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -0.056 10.071 -3.604 1.00 0.00 H new ATOM 979 N GLN A 628 -3.113 12.216 -4.061 1.00 0.00 N ATOM 980 CA GLN A 628 -4.472 12.520 -4.358 1.00 0.00 C ATOM 981 C GLN A 628 -5.325 12.065 -3.195 1.00 0.00 C ATOM 982 O GLN A 628 -4.904 11.212 -2.406 1.00 0.00 O ATOM 983 CB GLN A 628 -4.892 11.847 -5.652 1.00 0.00 C ATOM 984 CG GLN A 628 -4.073 12.282 -6.855 1.00 0.00 C ATOM 985 CD GLN A 628 -4.545 11.647 -8.134 1.00 0.00 C ATOM 986 OE1 GLN A 628 -5.427 12.183 -8.815 1.00 0.00 O ATOM 987 NE2 GLN A 628 -3.956 10.545 -8.508 1.00 0.00 N ATOM 0 H GLN A 628 -2.823 11.273 -4.320 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.599 13.593 -4.498 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -4.806 10.767 -5.535 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -5.943 12.064 -5.841 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -4.123 13.367 -6.952 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -3.027 12.025 -6.690 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -3.232 10.129 -7.922 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -4.219 10.099 -9.387 1.00 0.00 H new ATOM 996 N SER A 629 -6.478 12.648 -3.036 1.00 0.00 N ATOM 997 CA SER A 629 -7.308 12.284 -1.926 1.00 0.00 C ATOM 998 C SER A 629 -8.400 11.293 -2.338 1.00 0.00 C ATOM 999 O SER A 629 -9.161 10.792 -1.497 1.00 0.00 O ATOM 1000 CB SER A 629 -7.842 13.519 -1.261 1.00 0.00 C ATOM 1001 OG SER A 629 -6.771 14.413 -0.965 1.00 0.00 O ATOM 0 H SER A 629 -6.860 13.367 -3.651 1.00 0.00 H new ATOM 0 HA SER A 629 -6.706 11.756 -1.187 1.00 0.00 H new ATOM 0 HB2 SER A 629 -8.566 14.009 -1.912 1.00 0.00 H new ATOM 0 HB3 SER A 629 -8.367 13.251 -0.344 1.00 0.00 H new ATOM 0 HG SER A 629 -7.126 15.218 -0.533 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.496 11.065 -3.646 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.285 9.977 -4.246 1.00 0.00 C ATOM 1009 C CYS A 630 -10.810 10.140 -4.170 1.00 0.00 C ATOM 1010 O CYS A 630 -11.538 9.424 -4.877 1.00 0.00 O ATOM 1011 CB CYS A 630 -8.847 8.645 -3.641 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.046 8.444 -3.623 1.00 0.00 S ATOM 0 H CYS A 630 -8.019 11.641 -4.339 1.00 0.00 H new ATOM 0 HA CYS A 630 -9.072 10.011 -5.314 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -9.227 8.571 -2.622 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -9.294 7.828 -4.208 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.286 11.077 -3.378 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.706 11.247 -3.184 1.00 0.00 C ATOM 1019 C GLY A 631 -13.325 10.043 -2.489 1.00 0.00 C ATOM 1020 O GLY A 631 -12.673 9.414 -1.636 1.00 0.00 O ATOM 0 H GLY A 631 -10.706 11.734 -2.857 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -12.888 12.143 -2.591 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -13.190 11.399 -4.149 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.580 9.714 -2.807 1.00 0.00 N ATOM 1025 CA PRO A 632 -15.242 8.536 -2.271 1.00 0.00 C ATOM 1026 C PRO A 632 -14.804 7.247 -3.003 1.00 0.00 C ATOM 1027 O PRO A 632 -14.470 7.271 -4.205 1.00 0.00 O ATOM 1028 CB PRO A 632 -16.723 8.813 -2.529 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.744 9.691 -3.726 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.477 10.497 -3.683 1.00 0.00 C ATOM 0 HA PRO A 632 -15.003 8.372 -1.220 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -17.273 7.889 -2.707 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -17.189 9.301 -1.673 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.797 9.100 -4.640 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.619 10.341 -3.715 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -15.051 10.623 -4.678 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.653 11.495 -3.283 1.00 0.00 H new ATOM 1038 N PRO A 633 -14.787 6.122 -2.291 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.411 4.818 -2.847 1.00 0.00 C ATOM 1040 C PRO A 633 -15.531 4.183 -3.720 1.00 0.00 C ATOM 1041 O PRO A 633 -16.675 4.676 -3.747 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.162 3.983 -1.587 1.00 0.00 C ATOM 1043 CG PRO A 633 -15.061 4.571 -0.573 1.00 0.00 C ATOM 1044 CD PRO A 633 -15.113 6.032 -0.859 1.00 0.00 C ATOM 0 HA PRO A 633 -13.556 4.885 -3.520 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.389 2.930 -1.757 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.120 4.038 -1.273 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -16.055 4.128 -0.631 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -14.687 4.385 0.434 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -16.099 6.446 -0.646 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -14.397 6.584 -0.250 1.00 0.00 H new ATOM 1052 N PRO A 634 -15.196 3.112 -4.482 1.00 0.00 N ATOM 1053 CA PRO A 634 -16.161 2.377 -5.335 1.00 0.00 C ATOM 1054 C PRO A 634 -17.201 1.557 -4.530 1.00 0.00 C ATOM 1055 O PRO A 634 -17.352 1.732 -3.315 1.00 0.00 O ATOM 1056 CB PRO A 634 -15.256 1.440 -6.142 1.00 0.00 C ATOM 1057 CG PRO A 634 -14.058 1.245 -5.293 1.00 0.00 C ATOM 1058 CD PRO A 634 -13.837 2.548 -4.599 1.00 0.00 C ATOM 0 HA PRO A 634 -16.764 3.059 -5.935 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -15.753 0.492 -6.349 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -14.991 1.878 -7.104 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -14.214 0.440 -4.574 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -13.192 0.971 -5.895 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.375 2.409 -3.622 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -13.179 3.201 -5.172 1.00 0.00 H new ATOM 1066 N GLU A 635 -17.922 0.686 -5.209 1.00 0.00 N ATOM 1067 CA GLU A 635 -18.913 -0.142 -4.563 1.00 0.00 C ATOM 1068 C GLU A 635 -18.438 -1.581 -4.602 1.00 0.00 C ATOM 1069 O GLU A 635 -17.528 -1.903 -5.354 1.00 0.00 O ATOM 1070 CB GLU A 635 -20.263 -0.032 -5.269 1.00 0.00 C ATOM 1071 CG GLU A 635 -20.303 -0.647 -6.658 1.00 0.00 C ATOM 1072 CD GLU A 635 -21.673 -0.632 -7.252 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -22.513 -1.453 -6.836 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -21.935 0.169 -8.165 1.00 0.00 O ATOM 0 H GLU A 635 -17.837 0.535 -6.214 1.00 0.00 H new ATOM 0 HA GLU A 635 -19.040 0.192 -3.533 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -21.021 -0.513 -4.651 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -20.534 1.021 -5.344 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -19.621 -0.103 -7.312 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -19.944 -1.675 -6.607 1.00 0.00 H new ATOM 1081 N LEU A 636 -19.053 -2.437 -3.831 1.00 0.00 N ATOM 1082 CA LEU A 636 -18.670 -3.828 -3.812 1.00 0.00 C ATOM 1083 C LEU A 636 -19.680 -4.622 -4.621 1.00 0.00 C ATOM 1084 O LEU A 636 -20.891 -4.446 -4.434 1.00 0.00 O ATOM 1085 CB LEU A 636 -18.637 -4.322 -2.370 1.00 0.00 C ATOM 1086 CG LEU A 636 -18.066 -5.707 -2.109 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.714 -5.856 -2.774 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -17.892 -5.854 -0.638 1.00 0.00 C ATOM 0 H LEU A 636 -19.823 -2.198 -3.206 1.00 0.00 H new ATOM 0 HA LEU A 636 -17.679 -3.956 -4.248 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -18.061 -3.606 -1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -19.657 -4.302 -1.985 1.00 0.00 H new ATOM 0 HG LEU A 636 -18.739 -6.465 -2.510 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -16.320 -6.853 -2.577 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.820 -5.713 -3.849 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -16.028 -5.109 -2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -17.483 -6.840 -0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -17.208 -5.087 -0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -18.858 -5.743 -0.145 1.00 0.00 H new ATOM 1100 N LEU A 637 -19.196 -5.482 -5.509 1.00 0.00 N ATOM 1101 CA LEU A 637 -20.056 -6.283 -6.388 1.00 0.00 C ATOM 1102 C LEU A 637 -21.158 -7.068 -5.663 1.00 0.00 C ATOM 1103 O LEU A 637 -22.297 -7.071 -6.094 1.00 0.00 O ATOM 1104 CB LEU A 637 -19.233 -7.163 -7.380 1.00 0.00 C ATOM 1105 CG LEU A 637 -18.025 -7.977 -6.840 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -18.443 -9.180 -6.026 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -17.109 -8.399 -7.974 1.00 0.00 C ATOM 0 H LEU A 637 -18.199 -5.648 -5.644 1.00 0.00 H new ATOM 0 HA LEU A 637 -20.601 -5.554 -6.988 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -19.923 -7.867 -7.845 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -18.863 -6.510 -8.170 1.00 0.00 H new ATOM 0 HG LEU A 637 -17.481 -7.313 -6.168 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -17.556 -9.709 -5.676 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -19.032 -8.853 -5.169 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -19.043 -9.848 -6.645 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -16.270 -8.967 -7.572 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -17.664 -9.019 -8.678 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -16.734 -7.514 -8.488 1.00 0.00 H new ATOM 1119 N ASN A 638 -20.830 -7.682 -4.549 1.00 0.00 N ATOM 1120 CA ASN A 638 -21.802 -8.475 -3.790 1.00 0.00 C ATOM 1121 C ASN A 638 -21.749 -8.075 -2.337 1.00 0.00 C ATOM 1122 O ASN A 638 -21.981 -8.888 -1.427 1.00 0.00 O ATOM 1123 CB ASN A 638 -21.514 -9.975 -3.908 1.00 0.00 C ATOM 1124 CG ASN A 638 -21.721 -10.588 -5.290 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -21.003 -11.499 -5.667 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -22.708 -10.142 -6.023 1.00 0.00 N ATOM 0 H ASN A 638 -19.897 -7.654 -4.138 1.00 0.00 H new ATOM 0 HA ASN A 638 -22.792 -8.282 -4.202 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -20.482 -10.152 -3.605 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -22.150 -10.504 -3.198 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -22.894 -10.558 -6.936 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -23.292 -9.379 -5.682 1.00 0.00 H new ATOM 1133 N GLY A 639 -21.411 -6.844 -2.114 1.00 0.00 N ATOM 1134 CA GLY A 639 -21.390 -6.306 -0.809 1.00 0.00 C ATOM 1135 C GLY A 639 -21.602 -4.841 -0.854 1.00 0.00 C ATOM 1136 O GLY A 639 -22.237 -4.334 -1.775 1.00 0.00 O ATOM 0 H GLY A 639 -21.141 -6.186 -2.845 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -22.165 -6.774 -0.203 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -20.435 -6.528 -0.332 1.00 0.00 H new ATOM 1140 N ASN A 640 -21.050 -4.159 0.089 1.00 0.00 N ATOM 1141 CA ASN A 640 -21.114 -2.734 0.126 1.00 0.00 C ATOM 1142 C ASN A 640 -20.009 -2.271 1.028 1.00 0.00 C ATOM 1143 O ASN A 640 -19.140 -3.057 1.392 1.00 0.00 O ATOM 1144 CB ASN A 640 -22.442 -2.250 0.688 1.00 0.00 C ATOM 1145 CG ASN A 640 -23.003 -1.033 -0.061 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -24.203 -0.827 -0.110 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -22.144 -0.243 -0.676 1.00 0.00 N ATOM 0 H ASN A 640 -20.536 -4.576 0.865 1.00 0.00 H new ATOM 0 HA ASN A 640 -21.016 -2.337 -0.884 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -23.167 -3.063 0.643 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -22.314 -1.995 1.740 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -22.480 0.561 -1.207 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -21.144 -0.436 -0.621 1.00 0.00 H new ATOM 1154 N VAL A 641 -20.049 -1.042 1.406 1.00 0.00 N ATOM 1155 CA VAL A 641 -19.067 -0.484 2.267 1.00 0.00 C ATOM 1156 C VAL A 641 -19.701 -0.272 3.648 1.00 0.00 C ATOM 1157 O VAL A 641 -20.790 0.284 3.753 1.00 0.00 O ATOM 1158 CB VAL A 641 -18.510 0.840 1.665 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -19.608 1.852 1.404 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -17.423 1.417 2.535 1.00 0.00 C ATOM 0 H VAL A 641 -20.776 -0.386 1.121 1.00 0.00 H new ATOM 0 HA VAL A 641 -18.219 -1.160 2.372 1.00 0.00 H new ATOM 0 HB VAL A 641 -18.070 0.595 0.698 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -19.174 2.760 0.985 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -20.328 1.435 0.700 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -20.113 2.090 2.340 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -17.053 2.341 2.090 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -17.824 1.627 3.527 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -16.605 0.701 2.618 1.00 0.00 H new ATOM 1164 N LYS A 642 -19.065 -0.763 4.692 1.00 0.00 N ATOM 1165 CA LYS A 642 -19.635 -0.628 6.027 1.00 0.00 C ATOM 1166 C LYS A 642 -19.254 0.695 6.626 1.00 0.00 C ATOM 1167 O LYS A 642 -19.921 1.200 7.535 1.00 0.00 O ATOM 1168 CB LYS A 642 -19.208 -1.763 6.965 1.00 0.00 C ATOM 1169 CG LYS A 642 -17.709 -1.938 7.089 1.00 0.00 C ATOM 1170 CD LYS A 642 -17.334 -2.906 8.200 1.00 0.00 C ATOM 1171 CE LYS A 642 -17.600 -2.326 9.593 1.00 0.00 C ATOM 1172 NZ LYS A 642 -16.668 -1.245 9.968 1.00 0.00 N ATOM 0 H LYS A 642 -18.170 -1.251 4.651 1.00 0.00 H new ATOM 0 HA LYS A 642 -20.718 -0.685 5.916 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -19.623 -1.576 7.955 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -19.643 -2.697 6.608 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -17.308 -2.301 6.143 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -17.247 -0.970 7.281 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -17.900 -3.830 8.080 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -16.279 -3.165 8.112 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -18.620 -1.945 9.630 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -17.532 -3.126 10.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -16.485 -1.284 10.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -15.773 -1.363 9.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -17.088 -0.325 9.726 1.00 0.00 H new ATOM 1186 N GLU A 643 -18.194 1.254 6.128 1.00 0.00 N ATOM 1187 CA GLU A 643 -17.725 2.495 6.632 1.00 0.00 C ATOM 1188 C GLU A 643 -18.398 3.649 5.944 1.00 0.00 C ATOM 1189 O GLU A 643 -18.732 3.565 4.760 1.00 0.00 O ATOM 1190 CB GLU A 643 -16.213 2.604 6.524 1.00 0.00 C ATOM 1191 CG GLU A 643 -15.491 1.620 7.409 1.00 0.00 C ATOM 1192 CD GLU A 643 -15.830 1.808 8.866 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -16.885 1.322 9.315 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -15.053 2.446 9.588 1.00 0.00 O ATOM 0 H GLU A 643 -17.638 0.862 5.368 1.00 0.00 H new ATOM 0 HA GLU A 643 -17.984 2.537 7.690 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -15.915 2.441 5.488 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -15.907 3.616 6.788 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -15.748 0.605 7.106 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -14.416 1.731 7.271 1.00 0.00 H new ATOM 1201 N LYS A 644 -18.635 4.687 6.707 1.00 0.00 N ATOM 1202 CA LYS A 644 -19.205 5.928 6.226 1.00 0.00 C ATOM 1203 C LYS A 644 -18.343 6.495 5.099 1.00 0.00 C ATOM 1204 O LYS A 644 -17.184 6.898 5.336 1.00 0.00 O ATOM 1205 CB LYS A 644 -19.256 6.917 7.388 1.00 0.00 C ATOM 1206 CG LYS A 644 -19.696 8.320 7.017 1.00 0.00 C ATOM 1207 CD LYS A 644 -19.640 9.290 8.208 1.00 0.00 C ATOM 1208 CE LYS A 644 -18.201 9.636 8.675 1.00 0.00 C ATOM 1209 NZ LYS A 644 -17.464 8.512 9.335 1.00 0.00 N ATOM 0 H LYS A 644 -18.433 4.696 7.707 1.00 0.00 H new ATOM 0 HA LYS A 644 -20.209 5.752 5.840 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -19.935 6.528 8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -18.267 6.971 7.843 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -19.060 8.697 6.216 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -20.713 8.287 6.627 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -20.154 10.212 7.937 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -20.187 8.854 9.044 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -17.626 9.971 7.812 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -18.252 10.475 9.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -16.870 8.889 10.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -18.147 7.833 9.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -16.863 8.032 8.635 1.00 0.00 H new ATOM 1223 N THR A 645 -18.883 6.513 3.904 1.00 0.00 N ATOM 1224 CA THR A 645 -18.179 6.995 2.756 1.00 0.00 C ATOM 1225 C THR A 645 -18.270 8.496 2.636 1.00 0.00 C ATOM 1226 O THR A 645 -19.295 9.052 2.226 1.00 0.00 O ATOM 1227 CB THR A 645 -18.655 6.306 1.467 1.00 0.00 C ATOM 1228 OG1 THR A 645 -20.085 6.178 1.480 1.00 0.00 O ATOM 1229 CG2 THR A 645 -18.017 4.944 1.322 1.00 0.00 C ATOM 0 H THR A 645 -19.830 6.190 3.707 1.00 0.00 H new ATOM 0 HA THR A 645 -17.129 6.739 2.897 1.00 0.00 H new ATOM 0 HB THR A 645 -18.356 6.919 0.617 1.00 0.00 H new ATOM 0 HG1 THR A 645 -20.382 5.740 0.655 1.00 0.00 H new ATOM 0 HG21 THR A 645 -18.368 4.474 0.403 1.00 0.00 H new ATOM 0 HG22 THR A 645 -16.933 5.052 1.283 1.00 0.00 H new ATOM 0 HG23 THR A 645 -18.289 4.322 2.175 1.00 0.00 H new ATOM 1237 N LYS A 646 -17.222 9.143 3.029 1.00 0.00 N ATOM 1238 CA LYS A 646 -17.146 10.572 2.965 1.00 0.00 C ATOM 1239 C LYS A 646 -16.688 11.010 1.581 1.00 0.00 C ATOM 1240 O LYS A 646 -16.111 10.216 0.832 1.00 0.00 O ATOM 1241 CB LYS A 646 -16.231 11.130 4.064 1.00 0.00 C ATOM 1242 CG LYS A 646 -14.862 10.511 4.114 1.00 0.00 C ATOM 1243 CD LYS A 646 -13.997 11.205 5.133 1.00 0.00 C ATOM 1244 CE LYS A 646 -12.643 10.551 5.212 1.00 0.00 C ATOM 1245 NZ LYS A 646 -11.694 11.352 6.000 1.00 0.00 N ATOM 0 H LYS A 646 -16.387 8.695 3.407 1.00 0.00 H new ATOM 0 HA LYS A 646 -18.141 10.980 3.140 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -16.124 12.205 3.918 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -16.716 10.986 5.030 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -14.945 9.453 4.362 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -14.394 10.572 3.131 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -13.884 12.256 4.867 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -14.480 11.173 6.110 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -12.743 9.562 5.659 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -12.249 10.408 4.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -10.774 10.869 6.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -11.579 12.287 5.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -12.057 11.468 6.968 1.00 0.00 H new ATOM 1259 N GLU A 647 -16.949 12.259 1.266 1.00 0.00 N ATOM 1260 CA GLU A 647 -16.634 12.862 -0.034 1.00 0.00 C ATOM 1261 C GLU A 647 -15.140 12.844 -0.392 1.00 0.00 C ATOM 1262 O GLU A 647 -14.789 12.955 -1.563 1.00 0.00 O ATOM 1263 CB GLU A 647 -17.179 14.294 -0.093 1.00 0.00 C ATOM 1264 CG GLU A 647 -16.658 15.202 1.013 1.00 0.00 C ATOM 1265 CD GLU A 647 -17.235 16.587 0.945 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -18.357 16.797 1.424 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -16.581 17.487 0.417 1.00 0.00 O ATOM 0 H GLU A 647 -17.396 12.908 1.913 1.00 0.00 H new ATOM 0 HA GLU A 647 -17.124 12.239 -0.783 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -16.922 14.730 -1.058 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -18.267 14.260 -0.039 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -16.895 14.761 1.981 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -15.572 15.262 0.947 1.00 0.00 H new ATOM 1274 N GLU A 648 -14.275 12.714 0.587 1.00 0.00 N ATOM 1275 CA GLU A 648 -12.860 12.710 0.316 1.00 0.00 C ATOM 1276 C GLU A 648 -12.126 11.904 1.379 1.00 0.00 C ATOM 1277 O GLU A 648 -12.294 12.147 2.560 1.00 0.00 O ATOM 1278 CB GLU A 648 -12.349 14.154 0.219 1.00 0.00 C ATOM 1279 CG GLU A 648 -10.900 14.271 -0.156 1.00 0.00 C ATOM 1280 CD GLU A 648 -10.528 15.658 -0.602 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -10.637 15.945 -1.814 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -10.105 16.477 0.226 1.00 0.00 O ATOM 0 H GLU A 648 -14.525 12.610 1.570 1.00 0.00 H new ATOM 0 HA GLU A 648 -12.665 12.228 -0.642 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -12.948 14.690 -0.517 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -12.505 14.648 1.178 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -10.284 13.991 0.698 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -10.677 13.564 -0.955 1.00 0.00 H new ATOM 1289 N TYR A 649 -11.358 10.923 0.953 1.00 0.00 N ATOM 1290 CA TYR A 649 -10.648 10.048 1.873 1.00 0.00 C ATOM 1291 C TYR A 649 -9.191 10.413 2.069 1.00 0.00 C ATOM 1292 O TYR A 649 -8.817 10.970 3.108 1.00 0.00 O ATOM 1293 CB TYR A 649 -10.780 8.591 1.455 1.00 0.00 C ATOM 1294 CG TYR A 649 -11.999 7.912 1.999 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -13.269 8.242 1.573 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -11.865 6.930 2.955 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -14.366 7.599 2.090 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -12.947 6.288 3.478 1.00 0.00 C ATOM 1299 CZ TYR A 649 -14.198 6.625 3.041 1.00 0.00 C ATOM 1300 OH TYR A 649 -15.287 5.985 3.537 1.00 0.00 O ATOM 0 H TYR A 649 -11.206 10.708 -0.032 1.00 0.00 H new ATOM 0 HA TYR A 649 -11.129 10.191 2.840 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -10.801 8.536 0.367 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -9.895 8.047 1.785 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -13.401 9.012 0.827 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -10.877 6.662 3.299 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -15.357 7.859 1.749 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -12.818 5.522 4.229 1.00 0.00 H new ATOM 0 HH TYR A 649 -15.743 6.567 4.180 1.00 0.00 H new ATOM 1310 N GLY A 650 -8.388 10.106 1.098 1.00 0.00 N ATOM 1311 CA GLY A 650 -6.978 10.317 1.193 1.00 0.00 C ATOM 1312 C GLY A 650 -6.233 9.061 0.824 1.00 0.00 C ATOM 1313 O GLY A 650 -6.856 8.014 0.632 1.00 0.00 O ATOM 0 H GLY A 650 -8.694 9.700 0.214 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -6.680 11.131 0.532 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -6.716 10.618 2.207 1.00 0.00 H new ATOM 1317 N HIS A 651 -4.921 9.156 0.714 1.00 0.00 N ATOM 1318 CA HIS A 651 -4.084 8.016 0.366 1.00 0.00 C ATOM 1319 C HIS A 651 -4.178 6.856 1.374 1.00 0.00 C ATOM 1320 O HIS A 651 -4.647 5.764 1.051 1.00 0.00 O ATOM 1321 CB HIS A 651 -2.610 8.463 0.153 1.00 0.00 C ATOM 1322 CG HIS A 651 -1.618 7.340 0.012 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -1.642 6.478 -1.026 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -0.595 6.946 0.794 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.676 5.603 -0.903 1.00 0.00 C ATOM 1326 NE2 HIS A 651 -0.024 5.855 0.198 1.00 0.00 N ATOM 0 H HIS A 651 -4.404 10.022 0.862 1.00 0.00 H new ATOM 0 HA HIS A 651 -4.472 7.623 -0.574 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -2.561 9.085 -0.740 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -2.311 9.088 0.994 1.00 0.00 H new ATOM 0 HD1 HIS A 651 -2.314 6.504 -1.793 1.00 0.00 H new ATOM 0 HD2 HIS A 651 -0.283 7.406 1.720 1.00 0.00 H new ATOM 0 HE1 HIS A 651 -0.456 4.806 -1.597 1.00 0.00 H new ATOM 1335 N SER A 652 -3.774 7.104 2.568 1.00 0.00 N ATOM 1336 CA SER A 652 -3.663 6.064 3.576 1.00 0.00 C ATOM 1337 C SER A 652 -4.980 5.881 4.327 1.00 0.00 C ATOM 1338 O SER A 652 -5.002 5.678 5.549 1.00 0.00 O ATOM 1339 CB SER A 652 -2.540 6.448 4.525 1.00 0.00 C ATOM 1340 OG SER A 652 -1.349 6.708 3.785 1.00 0.00 O ATOM 0 H SER A 652 -3.505 8.033 2.894 1.00 0.00 H new ATOM 0 HA SER A 652 -3.438 5.109 3.101 1.00 0.00 H new ATOM 0 HB2 SER A 652 -2.822 7.331 5.099 1.00 0.00 H new ATOM 0 HB3 SER A 652 -2.366 5.645 5.241 1.00 0.00 H new ATOM 0 HG SER A 652 -0.629 6.957 4.401 1.00 0.00 H new ATOM 1346 N GLU A 653 -6.064 5.909 3.603 1.00 0.00 N ATOM 1347 CA GLU A 653 -7.341 5.782 4.210 1.00 0.00 C ATOM 1348 C GLU A 653 -8.036 4.582 3.648 1.00 0.00 C ATOM 1349 O GLU A 653 -8.424 4.566 2.484 1.00 0.00 O ATOM 1350 CB GLU A 653 -8.146 7.058 3.991 1.00 0.00 C ATOM 1351 CG GLU A 653 -9.273 7.229 4.975 1.00 0.00 C ATOM 1352 CD GLU A 653 -8.774 7.281 6.388 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -8.372 8.359 6.848 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -8.782 6.257 7.068 1.00 0.00 O ATOM 0 H GLU A 653 -6.079 6.019 2.589 1.00 0.00 H new ATOM 0 HA GLU A 653 -7.235 5.641 5.286 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -7.478 7.917 4.061 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -8.554 7.053 2.980 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -9.818 8.145 4.748 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -9.977 6.404 4.868 1.00 0.00 H new ATOM 1361 N VAL A 654 -8.105 3.548 4.451 1.00 0.00 N ATOM 1362 CA VAL A 654 -8.808 2.367 4.063 1.00 0.00 C ATOM 1363 C VAL A 654 -10.270 2.499 4.300 1.00 0.00 C ATOM 1364 O VAL A 654 -10.733 3.259 5.173 1.00 0.00 O ATOM 1365 CB VAL A 654 -8.338 1.081 4.741 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -6.978 0.643 4.284 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -8.433 1.183 6.233 1.00 0.00 C ATOM 0 H VAL A 654 -7.679 3.508 5.377 1.00 0.00 H new ATOM 0 HA VAL A 654 -8.585 2.277 3.000 1.00 0.00 H new ATOM 0 HB VAL A 654 -9.021 0.293 4.425 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -6.699 -0.275 4.801 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -6.996 0.464 3.209 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -6.250 1.422 4.510 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -8.091 0.251 6.684 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -7.809 2.006 6.582 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -9.468 1.366 6.520 1.00 0.00 H new ATOM 1371 N VAL A 655 -10.992 1.755 3.547 1.00 0.00 N ATOM 1372 CA VAL A 655 -12.405 1.747 3.601 1.00 0.00 C ATOM 1373 C VAL A 655 -12.858 0.314 3.770 1.00 0.00 C ATOM 1374 O VAL A 655 -12.607 -0.502 2.890 1.00 0.00 O ATOM 1375 CB VAL A 655 -12.976 2.265 2.274 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -14.376 2.697 2.433 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -12.129 3.354 1.699 1.00 0.00 C ATOM 0 H VAL A 655 -10.603 1.115 2.855 1.00 0.00 H new ATOM 0 HA VAL A 655 -12.746 2.376 4.424 1.00 0.00 H new ATOM 0 HB VAL A 655 -12.962 1.438 1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -14.756 3.059 1.478 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -14.981 1.854 2.768 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -14.428 3.497 3.171 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -12.564 3.696 0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -12.081 4.186 2.401 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -11.124 2.975 1.516 1.00 0.00 H new ATOM 1381 N GLU A 656 -13.413 -0.011 4.916 1.00 0.00 N ATOM 1382 CA GLU A 656 -13.969 -1.336 5.144 1.00 0.00 C ATOM 1383 C GLU A 656 -15.218 -1.589 4.360 1.00 0.00 C ATOM 1384 O GLU A 656 -16.234 -0.887 4.489 1.00 0.00 O ATOM 1385 CB GLU A 656 -14.259 -1.622 6.602 1.00 0.00 C ATOM 1386 CG GLU A 656 -13.093 -2.092 7.407 1.00 0.00 C ATOM 1387 CD GLU A 656 -13.467 -2.361 8.832 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -14.095 -1.499 9.467 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -13.198 -3.473 9.320 1.00 0.00 O ATOM 0 H GLU A 656 -13.494 0.623 5.711 1.00 0.00 H new ATOM 0 HA GLU A 656 -13.184 -2.009 4.800 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -14.654 -0.716 7.061 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -15.045 -2.376 6.658 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -12.687 -3.000 6.961 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -12.304 -1.341 7.375 1.00 0.00 H new ATOM 1396 N TYR A 657 -15.131 -2.572 3.571 1.00 0.00 N ATOM 1397 CA TYR A 657 -16.241 -3.104 2.852 1.00 0.00 C ATOM 1398 C TYR A 657 -16.735 -4.336 3.567 1.00 0.00 C ATOM 1399 O TYR A 657 -16.042 -4.872 4.436 1.00 0.00 O ATOM 1400 CB TYR A 657 -15.832 -3.489 1.439 1.00 0.00 C ATOM 1401 CG TYR A 657 -15.548 -2.341 0.523 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -14.368 -1.649 0.608 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -16.468 -1.954 -0.440 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -14.099 -0.607 -0.225 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -16.200 -0.907 -1.289 1.00 0.00 C ATOM 1406 CZ TYR A 657 -15.008 -0.236 -1.167 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.711 0.795 -1.997 1.00 0.00 O ATOM 0 H TYR A 657 -14.255 -3.062 3.388 1.00 0.00 H new ATOM 0 HA TYR A 657 -17.023 -2.347 2.798 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -14.943 -4.118 1.494 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -16.625 -4.095 1.001 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -13.638 -1.936 1.350 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -17.406 -2.482 -0.524 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -13.164 -0.074 -0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -16.917 -0.616 -2.042 1.00 0.00 H new ATOM 0 HH TYR A 657 -15.531 1.113 -2.430 1.00 0.00 H new ATOM 1417 N TYR A 658 -17.909 -4.768 3.215 1.00 0.00 N ATOM 1418 CA TYR A 658 -18.471 -5.980 3.744 1.00 0.00 C ATOM 1419 C TYR A 658 -19.305 -6.601 2.646 1.00 0.00 C ATOM 1420 O TYR A 658 -19.980 -5.883 1.908 1.00 0.00 O ATOM 1421 CB TYR A 658 -19.341 -5.708 4.999 1.00 0.00 C ATOM 1422 CG TYR A 658 -20.695 -5.066 4.729 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -20.811 -3.729 4.402 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -21.857 -5.818 4.812 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -22.031 -3.161 4.163 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -23.087 -5.257 4.573 1.00 0.00 C ATOM 1427 CZ TYR A 658 -23.172 -3.928 4.249 1.00 0.00 C ATOM 1428 OH TYR A 658 -24.399 -3.365 3.995 1.00 0.00 O ATOM 0 H TYR A 658 -18.511 -4.287 2.547 1.00 0.00 H new ATOM 0 HA TYR A 658 -17.673 -6.653 4.059 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -19.503 -6.652 5.519 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -18.781 -5.063 5.676 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -19.921 -3.121 4.334 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -21.793 -6.865 5.070 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -22.100 -2.114 3.907 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -23.981 -5.859 4.640 1.00 0.00 H new ATOM 0 HH TYR A 658 -25.098 -4.044 4.099 1.00 0.00 H new ATOM 1438 N CYS A 659 -19.233 -7.875 2.488 1.00 0.00 N ATOM 1439 CA CYS A 659 -20.043 -8.541 1.501 1.00 0.00 C ATOM 1440 C CYS A 659 -21.339 -9.002 2.146 1.00 0.00 C ATOM 1441 O CYS A 659 -21.538 -8.808 3.353 1.00 0.00 O ATOM 1442 CB CYS A 659 -19.297 -9.718 0.855 1.00 0.00 C ATOM 1443 SG CYS A 659 -17.764 -9.275 -0.016 1.00 0.00 S ATOM 0 H CYS A 659 -18.622 -8.489 3.027 1.00 0.00 H new ATOM 0 HA CYS A 659 -20.269 -7.836 0.701 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -19.059 -10.446 1.630 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -19.967 -10.210 0.151 1.00 0.00 H new ATOM 1448 N ASN A 660 -22.241 -9.564 1.353 1.00 0.00 N ATOM 1449 CA ASN A 660 -23.494 -10.090 1.897 1.00 0.00 C ATOM 1450 C ASN A 660 -23.191 -11.301 2.774 1.00 0.00 C ATOM 1451 O ASN A 660 -22.166 -11.963 2.561 1.00 0.00 O ATOM 1452 CB ASN A 660 -24.494 -10.500 0.794 1.00 0.00 C ATOM 1453 CG ASN A 660 -25.127 -9.372 -0.005 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -26.250 -9.497 -0.441 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -24.435 -8.303 -0.218 1.00 0.00 N ATOM 0 H ASN A 660 -22.135 -9.669 0.344 1.00 0.00 H new ATOM 0 HA ASN A 660 -23.957 -9.293 2.479 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -23.981 -11.164 0.098 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -25.293 -11.080 1.257 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -24.832 -7.539 -0.765 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -23.491 -8.223 0.160 1.00 0.00 H new ATOM 1462 N PRO A 661 -24.097 -11.656 3.722 1.00 0.00 N ATOM 1463 CA PRO A 661 -23.894 -12.773 4.691 1.00 0.00 C ATOM 1464 C PRO A 661 -24.013 -14.159 4.048 1.00 0.00 C ATOM 1465 O PRO A 661 -24.475 -15.124 4.670 1.00 0.00 O ATOM 1466 CB PRO A 661 -25.029 -12.559 5.690 1.00 0.00 C ATOM 1467 CG PRO A 661 -26.099 -11.893 4.908 1.00 0.00 C ATOM 1468 CD PRO A 661 -25.398 -10.994 3.942 1.00 0.00 C ATOM 0 HA PRO A 661 -22.894 -12.756 5.124 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -25.374 -13.506 6.106 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -24.708 -11.940 6.528 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -26.714 -12.625 4.385 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -26.763 -11.325 5.559 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -25.957 -10.893 3.012 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -25.272 -9.991 4.349 1.00 0.00 H new ATOM 1476 N ARG A 662 -23.522 -14.259 2.856 1.00 0.00 N ATOM 1477 CA ARG A 662 -23.629 -15.443 2.051 1.00 0.00 C ATOM 1478 C ARG A 662 -22.478 -15.523 1.055 1.00 0.00 C ATOM 1479 O ARG A 662 -22.482 -16.344 0.142 1.00 0.00 O ATOM 1480 CB ARG A 662 -24.989 -15.419 1.364 1.00 0.00 C ATOM 1481 CG ARG A 662 -25.285 -14.110 0.668 1.00 0.00 C ATOM 1482 CD ARG A 662 -26.766 -13.902 0.531 1.00 0.00 C ATOM 1483 NE ARG A 662 -27.124 -12.635 -0.144 1.00 0.00 N ATOM 1484 CZ ARG A 662 -28.367 -12.103 -0.168 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -29.362 -12.694 0.484 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -28.590 -10.966 -0.816 1.00 0.00 N ATOM 0 H ARG A 662 -23.019 -13.499 2.397 1.00 0.00 H new ATOM 0 HA ARG A 662 -23.558 -16.338 2.669 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -25.034 -16.228 0.635 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -25.765 -15.613 2.104 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -24.848 -13.286 1.232 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -24.820 -14.104 -0.318 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -27.192 -14.735 -0.028 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -27.220 -13.918 1.522 1.00 0.00 H new ATOM 0 HE ARG A 662 -26.381 -12.127 -0.625 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -29.190 -13.553 1.006 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -30.298 -12.288 0.463 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -27.824 -10.494 -1.296 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -29.528 -10.565 -0.834 1.00 0.00 H new ATOM 1500 N PHE A 663 -21.479 -14.674 1.246 1.00 0.00 N ATOM 1501 CA PHE A 663 -20.328 -14.673 0.380 1.00 0.00 C ATOM 1502 C PHE A 663 -19.067 -14.641 1.194 1.00 0.00 C ATOM 1503 O PHE A 663 -19.048 -14.157 2.340 1.00 0.00 O ATOM 1504 CB PHE A 663 -20.304 -13.475 -0.587 1.00 0.00 C ATOM 1505 CG PHE A 663 -21.452 -13.380 -1.536 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -22.627 -12.770 -1.162 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -21.344 -13.881 -2.808 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -23.676 -12.666 -2.045 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -22.385 -13.785 -3.693 1.00 0.00 C ATOM 1510 CZ PHE A 663 -23.557 -13.176 -3.313 1.00 0.00 C ATOM 0 H PHE A 663 -21.450 -13.981 1.994 1.00 0.00 H new ATOM 0 HA PHE A 663 -20.393 -15.587 -0.210 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -20.268 -12.558 0.002 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -19.382 -13.519 -1.166 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -22.727 -12.369 -0.164 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -20.425 -14.358 -3.116 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -24.593 -12.183 -1.741 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -22.285 -14.188 -4.690 1.00 0.00 H new ATOM 0 HZ PHE A 663 -24.380 -13.099 -4.009 1.00 0.00 H new ATOM 1520 N LEU A 664 -18.041 -15.146 0.610 1.00 0.00 N ATOM 1521 CA LEU A 664 -16.736 -15.119 1.152 1.00 0.00 C ATOM 1522 C LEU A 664 -16.055 -13.897 0.589 1.00 0.00 C ATOM 1523 O LEU A 664 -16.374 -13.468 -0.530 1.00 0.00 O ATOM 1524 CB LEU A 664 -15.972 -16.380 0.741 1.00 0.00 C ATOM 1525 CG LEU A 664 -16.596 -17.709 1.162 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -15.790 -18.869 0.609 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -16.687 -17.803 2.680 1.00 0.00 C ATOM 0 H LEU A 664 -18.093 -15.609 -0.298 1.00 0.00 H new ATOM 0 HA LEU A 664 -16.765 -15.084 2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -15.866 -16.379 -0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -14.967 -16.324 1.160 1.00 0.00 H new ATOM 0 HG LEU A 664 -17.605 -17.759 0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -16.247 -19.809 0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -15.773 -18.814 -0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -14.770 -18.819 0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -17.134 -18.757 2.959 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -15.688 -17.731 3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -17.304 -16.988 3.059 1.00 0.00 H new ATOM 1539 N MET A 665 -15.170 -13.332 1.336 1.00 0.00 N ATOM 1540 CA MET A 665 -14.480 -12.148 0.912 1.00 0.00 C ATOM 1541 C MET A 665 -13.039 -12.533 0.691 1.00 0.00 C ATOM 1542 O MET A 665 -12.384 -13.010 1.611 1.00 0.00 O ATOM 1543 CB MET A 665 -14.631 -11.083 1.990 1.00 0.00 C ATOM 1544 CG MET A 665 -14.539 -9.672 1.476 1.00 0.00 C ATOM 1545 SD MET A 665 -15.214 -8.494 2.650 1.00 0.00 S ATOM 1546 CE MET A 665 -15.602 -7.153 1.543 1.00 0.00 C ATOM 0 H MET A 665 -14.899 -13.672 2.259 1.00 0.00 H new ATOM 0 HA MET A 665 -14.885 -11.737 -0.012 1.00 0.00 H new ATOM 0 HB2 MET A 665 -15.593 -11.216 2.485 1.00 0.00 H new ATOM 0 HB3 MET A 665 -13.860 -11.234 2.746 1.00 0.00 H new ATOM 0 HG2 MET A 665 -13.497 -9.426 1.272 1.00 0.00 H new ATOM 0 HG3 MET A 665 -15.076 -9.593 0.531 1.00 0.00 H new ATOM 0 HE1 MET A 665 -14.920 -6.322 1.725 1.00 0.00 H new ATOM 0 HE2 MET A 665 -15.496 -7.490 0.512 1.00 0.00 H new ATOM 0 HE3 MET A 665 -16.627 -6.825 1.714 1.00 0.00 H new ATOM 1556 N LYS A 666 -12.569 -12.380 -0.525 1.00 0.00 N ATOM 1557 CA LYS A 666 -11.252 -12.872 -0.910 1.00 0.00 C ATOM 1558 C LYS A 666 -10.093 -12.020 -0.380 1.00 0.00 C ATOM 1559 O LYS A 666 -9.370 -12.437 0.534 1.00 0.00 O ATOM 1560 CB LYS A 666 -11.165 -13.003 -2.439 1.00 0.00 C ATOM 1561 CG LYS A 666 -9.840 -13.557 -2.957 1.00 0.00 C ATOM 1562 CD LYS A 666 -9.607 -14.996 -2.520 1.00 0.00 C ATOM 1563 CE LYS A 666 -10.664 -15.934 -3.085 1.00 0.00 C ATOM 1564 NZ LYS A 666 -10.702 -15.896 -4.559 1.00 0.00 N ATOM 0 H LYS A 666 -13.079 -11.915 -1.276 1.00 0.00 H new ATOM 0 HA LYS A 666 -11.142 -13.851 -0.444 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -11.973 -13.650 -2.781 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -11.332 -12.022 -2.884 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -9.827 -13.503 -4.046 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -9.022 -12.933 -2.597 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -8.620 -15.321 -2.848 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -9.615 -15.052 -1.431 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -10.460 -16.952 -2.753 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -11.642 -15.659 -2.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -11.253 -16.704 -4.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -11.147 -15.010 -4.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -9.733 -15.948 -4.933 1.00 0.00 H new ATOM 1578 N GLY A 667 -9.931 -10.855 -0.944 1.00 0.00 N ATOM 1579 CA GLY A 667 -8.805 -10.026 -0.631 1.00 0.00 C ATOM 1580 C GLY A 667 -9.055 -9.070 0.511 1.00 0.00 C ATOM 1581 O GLY A 667 -9.861 -9.360 1.409 1.00 0.00 O ATOM 0 H GLY A 667 -10.573 -10.457 -1.629 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -7.955 -10.661 -0.382 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -8.528 -9.455 -1.517 1.00 0.00 H new ATOM 1585 N PRO A 668 -8.361 -7.928 0.511 1.00 0.00 N ATOM 1586 CA PRO A 668 -8.483 -6.916 1.556 1.00 0.00 C ATOM 1587 C PRO A 668 -9.866 -6.286 1.577 1.00 0.00 C ATOM 1588 O PRO A 668 -10.295 -5.679 0.594 1.00 0.00 O ATOM 1589 CB PRO A 668 -7.426 -5.867 1.170 1.00 0.00 C ATOM 1590 CG PRO A 668 -7.228 -6.059 -0.293 1.00 0.00 C ATOM 1591 CD PRO A 668 -7.392 -7.524 -0.530 1.00 0.00 C ATOM 0 HA PRO A 668 -8.338 -7.337 2.551 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -7.768 -4.857 1.395 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -6.497 -6.019 1.720 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -7.956 -5.485 -0.866 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -6.240 -5.720 -0.603 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -7.768 -7.730 -1.532 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -6.446 -8.057 -0.429 1.00 0.00 H new ATOM 1599 N ASN A 669 -10.571 -6.418 2.698 1.00 0.00 N ATOM 1600 CA ASN A 669 -11.915 -5.843 2.809 1.00 0.00 C ATOM 1601 C ASN A 669 -11.846 -4.369 2.978 1.00 0.00 C ATOM 1602 O ASN A 669 -12.826 -3.682 2.861 1.00 0.00 O ATOM 1603 CB ASN A 669 -12.748 -6.469 3.940 1.00 0.00 C ATOM 1604 CG ASN A 669 -12.123 -6.428 5.306 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -11.277 -7.256 5.636 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -12.600 -5.544 6.140 1.00 0.00 N ATOM 0 H ASN A 669 -10.244 -6.908 3.531 1.00 0.00 H new ATOM 0 HA ASN A 669 -12.424 -6.076 1.874 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -13.710 -5.958 3.985 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -12.952 -7.509 3.684 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -12.271 -5.524 7.105 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -13.302 -4.874 5.826 1.00 0.00 H new ATOM 1613 N LYS A 670 -10.687 -3.894 3.255 1.00 0.00 N ATOM 1614 CA LYS A 670 -10.466 -2.513 3.434 1.00 0.00 C ATOM 1615 C LYS A 670 -9.488 -2.105 2.400 1.00 0.00 C ATOM 1616 O LYS A 670 -8.415 -2.712 2.295 1.00 0.00 O ATOM 1617 CB LYS A 670 -9.849 -2.277 4.758 1.00 0.00 C ATOM 1618 CG LYS A 670 -10.281 -3.238 5.843 1.00 0.00 C ATOM 1619 CD LYS A 670 -9.207 -3.389 6.884 1.00 0.00 C ATOM 1620 CE LYS A 670 -8.763 -2.036 7.405 1.00 0.00 C ATOM 1621 NZ LYS A 670 -7.627 -2.119 8.349 1.00 0.00 N ATOM 0 H LYS A 670 -9.851 -4.469 3.365 1.00 0.00 H new ATOM 0 HA LYS A 670 -11.402 -1.959 3.363 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -8.766 -2.334 4.653 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -10.085 -1.262 5.077 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -11.198 -2.878 6.310 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -10.507 -4.210 5.405 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -9.578 -3.997 7.709 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -8.354 -3.917 6.458 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -8.482 -1.404 6.563 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -9.604 -1.551 7.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -7.371 -1.163 8.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -7.899 -2.697 9.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -6.811 -2.555 7.873 1.00 0.00 H new ATOM 1635 N ILE A 671 -9.813 -1.130 1.635 1.00 0.00 N ATOM 1636 CA ILE A 671 -8.906 -0.726 0.612 1.00 0.00 C ATOM 1637 C ILE A 671 -8.438 0.670 0.847 1.00 0.00 C ATOM 1638 O ILE A 671 -9.206 1.515 1.265 1.00 0.00 O ATOM 1639 CB ILE A 671 -9.477 -0.860 -0.828 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -10.674 0.074 -1.019 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -9.865 -2.309 -1.121 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -11.230 0.098 -2.419 1.00 0.00 C ATOM 0 H ILE A 671 -10.683 -0.601 1.690 1.00 0.00 H new ATOM 0 HA ILE A 671 -8.065 -1.417 0.674 1.00 0.00 H new ATOM 0 HB ILE A 671 -8.701 -0.568 -1.535 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -11.466 -0.225 -0.332 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -10.377 1.086 -0.742 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -10.262 -2.382 -2.133 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -8.986 -2.947 -1.030 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -10.624 -2.633 -0.409 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -12.075 0.785 -2.463 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -10.456 0.429 -3.112 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -11.562 -0.903 -2.696 1.00 0.00 H new ATOM 1649 N GLN A 672 -7.182 0.877 0.639 1.00 0.00 N ATOM 1650 CA GLN A 672 -6.597 2.177 0.730 1.00 0.00 C ATOM 1651 C GLN A 672 -6.382 2.702 -0.658 1.00 0.00 C ATOM 1652 O GLN A 672 -6.375 1.930 -1.632 1.00 0.00 O ATOM 1653 CB GLN A 672 -5.280 2.187 1.522 1.00 0.00 C ATOM 1654 CG GLN A 672 -4.156 1.317 0.964 1.00 0.00 C ATOM 1655 CD GLN A 672 -4.329 -0.180 1.222 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -3.911 -0.687 2.261 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -4.885 -0.904 0.280 1.00 0.00 N ATOM 0 H GLN A 672 -6.521 0.139 0.397 1.00 0.00 H new ATOM 0 HA GLN A 672 -7.283 2.820 1.281 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -4.922 3.215 1.580 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -5.490 1.864 2.542 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -4.085 1.482 -0.111 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -3.211 1.642 1.400 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -5.224 -0.458 -0.573 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -4.979 -1.913 0.400 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.214 3.967 -0.773 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.053 4.561 -2.052 1.00 0.00 C ATOM 1668 C CYS A 673 -4.639 4.876 -2.317 1.00 0.00 C ATOM 1669 O CYS A 673 -4.047 5.760 -1.732 1.00 0.00 O ATOM 1670 CB CYS A 673 -6.928 5.768 -2.225 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.786 6.458 -3.892 1.00 0.00 S ATOM 0 H CYS A 673 -6.184 4.619 0.011 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.375 3.829 -2.792 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -7.966 5.497 -2.029 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -6.653 6.526 -1.492 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.108 4.161 -3.217 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.753 4.283 -3.573 1.00 0.00 C ATOM 1678 C VAL A 674 -2.609 5.378 -4.618 1.00 0.00 C ATOM 1679 O VAL A 674 -3.045 5.237 -5.755 1.00 0.00 O ATOM 1680 CB VAL A 674 -2.229 2.936 -4.052 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -0.846 3.070 -4.560 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.265 1.954 -2.903 1.00 0.00 C ATOM 0 H VAL A 674 -4.615 3.451 -3.746 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.150 4.572 -2.712 1.00 0.00 H new ATOM 0 HB VAL A 674 -2.859 2.574 -4.865 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -0.487 2.098 -4.898 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -0.831 3.773 -5.393 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -0.200 3.438 -3.763 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -1.891 0.987 -3.239 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -1.640 2.322 -2.090 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -3.291 1.844 -2.551 1.00 0.00 H new ATOM 1686 N ASP A 675 -2.002 6.472 -4.186 1.00 0.00 N ATOM 1687 CA ASP A 675 -1.898 7.716 -4.936 1.00 0.00 C ATOM 1688 C ASP A 675 -3.253 8.313 -5.256 1.00 0.00 C ATOM 1689 O ASP A 675 -3.698 9.199 -4.561 1.00 0.00 O ATOM 1690 CB ASP A 675 -0.973 7.652 -6.141 1.00 0.00 C ATOM 1691 CG ASP A 675 -1.040 8.920 -6.965 1.00 0.00 C ATOM 1692 OD1 ASP A 675 -0.610 9.961 -6.477 1.00 0.00 O ATOM 1693 OD2 ASP A 675 -1.517 8.875 -8.122 1.00 0.00 O ATOM 0 H ASP A 675 -1.552 6.521 -3.272 1.00 0.00 H new ATOM 0 HA ASP A 675 -1.403 8.412 -4.259 1.00 0.00 H new ATOM 0 HB2 ASP A 675 0.051 7.490 -5.805 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -1.244 6.799 -6.763 1.00 0.00 H new ATOM 1698 N GLY A 676 -3.896 7.808 -6.268 1.00 0.00 N ATOM 1699 CA GLY A 676 -5.218 8.248 -6.616 1.00 0.00 C ATOM 1700 C GLY A 676 -6.010 7.098 -7.153 1.00 0.00 C ATOM 1701 O GLY A 676 -7.077 7.270 -7.774 1.00 0.00 O ATOM 0 H GLY A 676 -3.520 7.080 -6.876 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -5.714 8.666 -5.740 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -5.163 9.042 -7.360 1.00 0.00 H new ATOM 1705 N GLU A 677 -5.493 5.914 -6.928 1.00 0.00 N ATOM 1706 CA GLU A 677 -6.100 4.711 -7.393 1.00 0.00 C ATOM 1707 C GLU A 677 -6.303 3.783 -6.226 1.00 0.00 C ATOM 1708 O GLU A 677 -5.334 3.349 -5.585 1.00 0.00 O ATOM 1709 CB GLU A 677 -5.224 4.020 -8.429 1.00 0.00 C ATOM 1710 CG GLU A 677 -4.834 4.885 -9.605 1.00 0.00 C ATOM 1711 CD GLU A 677 -4.066 4.117 -10.634 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -2.860 3.841 -10.416 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -4.651 3.766 -11.669 1.00 0.00 O ATOM 0 H GLU A 677 -4.627 5.768 -6.409 1.00 0.00 H new ATOM 0 HA GLU A 677 -7.054 4.961 -7.857 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -4.317 3.666 -7.939 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -5.750 3.141 -8.801 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -5.731 5.304 -10.060 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -4.233 5.724 -9.255 1.00 0.00 H new ATOM 1720 N TRP A 678 -7.532 3.502 -5.923 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.853 2.575 -4.866 1.00 0.00 C ATOM 1722 C TRP A 678 -7.330 1.202 -5.231 1.00 0.00 C ATOM 1723 O TRP A 678 -7.305 0.840 -6.409 1.00 0.00 O ATOM 1724 CB TRP A 678 -9.347 2.490 -4.673 1.00 0.00 C ATOM 1725 CG TRP A 678 -9.984 3.742 -4.154 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.603 4.736 -4.868 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -10.063 4.116 -2.795 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -11.063 5.710 -4.007 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.738 5.347 -2.725 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.622 3.519 -1.625 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -10.977 5.989 -1.515 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -9.854 4.144 -0.438 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -10.528 5.364 -0.383 1.00 0.00 C ATOM 0 H TRP A 678 -8.343 3.903 -6.395 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.392 2.925 -3.942 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.809 2.232 -5.626 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.565 1.675 -3.983 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.713 4.753 -5.942 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.561 6.558 -4.278 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -9.102 2.573 -1.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.493 6.937 -1.470 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -9.510 3.687 0.478 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -10.700 5.827 0.577 1.00 0.00 H new ATOM 1744 N THR A 679 -6.911 0.456 -4.247 1.00 0.00 N ATOM 1745 CA THR A 679 -6.388 -0.866 -4.466 1.00 0.00 C ATOM 1746 C THR A 679 -7.460 -1.839 -4.955 1.00 0.00 C ATOM 1747 O THR A 679 -8.651 -1.478 -5.063 1.00 0.00 O ATOM 1748 CB THR A 679 -5.732 -1.393 -3.192 1.00 0.00 C ATOM 1749 OG1 THR A 679 -6.604 -1.169 -2.069 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.429 -0.689 -2.966 1.00 0.00 C ATOM 0 H THR A 679 -6.922 0.747 -3.269 1.00 0.00 H new ATOM 0 HA THR A 679 -5.638 -0.792 -5.253 1.00 0.00 H new ATOM 0 HB THR A 679 -5.549 -2.462 -3.298 1.00 0.00 H new ATOM 0 HG1 THR A 679 -6.579 -1.948 -1.475 1.00 0.00 H new ATOM 0 HG21 THR A 679 -3.964 -1.068 -2.056 1.00 0.00 H new ATOM 0 HG22 THR A 679 -3.767 -0.868 -3.813 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.607 0.382 -2.864 1.00 0.00 H new ATOM 1758 N THR A 680 -7.035 -3.043 -5.264 1.00 0.00 N ATOM 1759 CA THR A 680 -7.907 -4.082 -5.732 1.00 0.00 C ATOM 1760 C THR A 680 -8.964 -4.388 -4.677 1.00 0.00 C ATOM 1761 O THR A 680 -8.639 -4.544 -3.488 1.00 0.00 O ATOM 1762 CB THR A 680 -7.083 -5.346 -5.987 1.00 0.00 C ATOM 1763 OG1 THR A 680 -5.823 -4.970 -6.576 1.00 0.00 O ATOM 1764 CG2 THR A 680 -7.813 -6.282 -6.936 1.00 0.00 C ATOM 0 H THR A 680 -6.058 -3.327 -5.194 1.00 0.00 H new ATOM 0 HA THR A 680 -8.395 -3.756 -6.650 1.00 0.00 H new ATOM 0 HB THR A 680 -6.925 -5.861 -5.039 1.00 0.00 H new ATOM 0 HG1 THR A 680 -5.287 -5.773 -6.742 1.00 0.00 H new ATOM 0 HG21 THR A 680 -7.209 -7.174 -7.103 1.00 0.00 H new ATOM 0 HG22 THR A 680 -8.770 -6.568 -6.500 1.00 0.00 H new ATOM 0 HG23 THR A 680 -7.984 -5.776 -7.886 1.00 0.00 H new ATOM 1772 N LEU A 681 -10.201 -4.413 -5.104 1.00 0.00 N ATOM 1773 CA LEU A 681 -11.307 -4.727 -4.248 1.00 0.00 C ATOM 1774 C LEU A 681 -11.249 -6.136 -3.699 1.00 0.00 C ATOM 1775 O LEU A 681 -10.670 -7.036 -4.314 1.00 0.00 O ATOM 1776 CB LEU A 681 -12.646 -4.440 -4.920 1.00 0.00 C ATOM 1777 CG LEU A 681 -13.277 -3.118 -4.512 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -12.404 -1.959 -4.890 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -14.646 -2.978 -5.088 1.00 0.00 C ATOM 0 H LEU A 681 -10.467 -4.213 -6.068 1.00 0.00 H new ATOM 0 HA LEU A 681 -11.221 -4.061 -3.390 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -12.506 -4.445 -6.001 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -13.339 -5.248 -4.685 1.00 0.00 H new ATOM 0 HG LEU A 681 -13.372 -3.115 -3.426 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -12.883 -1.028 -4.585 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -11.440 -2.052 -4.390 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -12.254 -1.953 -5.970 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -15.074 -2.024 -4.781 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -14.589 -3.016 -6.176 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -15.277 -3.791 -4.729 1.00 0.00 H new ATOM 1791 N PRO A 682 -11.844 -6.335 -2.519 1.00 0.00 N ATOM 1792 CA PRO A 682 -11.824 -7.613 -1.806 1.00 0.00 C ATOM 1793 C PRO A 682 -12.422 -8.782 -2.598 1.00 0.00 C ATOM 1794 O PRO A 682 -11.923 -9.893 -2.515 1.00 0.00 O ATOM 1795 CB PRO A 682 -12.657 -7.340 -0.557 1.00 0.00 C ATOM 1796 CG PRO A 682 -13.433 -6.107 -0.862 1.00 0.00 C ATOM 1797 CD PRO A 682 -12.570 -5.300 -1.753 1.00 0.00 C ATOM 0 HA PRO A 682 -10.799 -7.926 -1.606 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -13.320 -8.177 -0.336 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -12.021 -7.198 0.316 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -14.378 -6.350 -1.347 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -13.674 -5.560 0.050 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -13.154 -4.649 -2.403 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -11.890 -4.661 -1.190 1.00 0.00 H new ATOM 1805 N VAL A 683 -13.478 -8.503 -3.362 1.00 0.00 N ATOM 1806 CA VAL A 683 -14.189 -9.504 -4.182 1.00 0.00 C ATOM 1807 C VAL A 683 -14.972 -10.528 -3.330 1.00 0.00 C ATOM 1808 O VAL A 683 -14.405 -11.266 -2.508 1.00 0.00 O ATOM 1809 CB VAL A 683 -13.256 -10.240 -5.207 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -14.035 -11.269 -6.024 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -12.579 -9.239 -6.137 1.00 0.00 C ATOM 0 H VAL A 683 -13.874 -7.566 -3.435 1.00 0.00 H new ATOM 0 HA VAL A 683 -14.912 -8.927 -4.758 1.00 0.00 H new ATOM 0 HB VAL A 683 -12.489 -10.764 -4.636 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -13.362 -11.762 -6.725 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -14.469 -12.012 -5.355 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -14.831 -10.769 -6.576 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -11.937 -9.771 -6.839 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -13.338 -8.684 -6.688 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -11.977 -8.546 -5.549 1.00 0.00 H new ATOM 1815 N CYS A 684 -16.271 -10.526 -3.515 1.00 0.00 N ATOM 1816 CA CYS A 684 -17.160 -11.462 -2.848 1.00 0.00 C ATOM 1817 C CYS A 684 -17.448 -12.628 -3.770 1.00 0.00 C ATOM 1818 O CYS A 684 -17.730 -12.441 -4.962 1.00 0.00 O ATOM 1819 CB CYS A 684 -18.478 -10.791 -2.538 1.00 0.00 C ATOM 1820 SG CYS A 684 -18.338 -9.081 -1.949 1.00 0.00 S ATOM 0 H CYS A 684 -16.749 -9.873 -4.136 1.00 0.00 H new ATOM 0 HA CYS A 684 -16.680 -11.801 -1.930 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -19.096 -10.802 -3.436 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -19.001 -11.379 -1.784 1.00 0.00 H new ATOM 1825 N ILE A 685 -17.388 -13.800 -3.222 1.00 0.00 N ATOM 1826 CA ILE A 685 -17.663 -15.034 -3.932 1.00 0.00 C ATOM 1827 C ILE A 685 -18.490 -15.903 -3.074 1.00 0.00 C ATOM 1828 O ILE A 685 -18.343 -15.898 -1.871 1.00 0.00 O ATOM 1829 CB ILE A 685 -16.395 -15.802 -4.433 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -15.337 -15.993 -3.303 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -15.788 -15.140 -5.671 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -14.484 -14.777 -2.994 1.00 0.00 C ATOM 0 H ILE A 685 -17.141 -13.942 -2.243 1.00 0.00 H new ATOM 0 HA ILE A 685 -18.195 -14.757 -4.842 1.00 0.00 H new ATOM 0 HB ILE A 685 -16.725 -16.799 -4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -15.854 -16.293 -2.392 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -14.678 -16.816 -3.581 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -14.910 -15.701 -5.990 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -16.523 -15.129 -6.475 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -15.498 -14.117 -5.431 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -13.783 -15.018 -2.195 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -13.931 -14.484 -3.886 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -15.125 -13.954 -2.678 1.00 0.00 H new ATOM 1839 N VAL A 686 -19.374 -16.608 -3.692 1.00 0.00 N ATOM 1840 CA VAL A 686 -20.321 -17.395 -3.074 1.00 0.00 C ATOM 1841 C VAL A 686 -19.700 -18.472 -2.157 1.00 0.00 C ATOM 1842 O VAL A 686 -18.656 -19.062 -2.468 1.00 0.00 O ATOM 1843 CB VAL A 686 -21.217 -18.008 -4.154 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -21.838 -16.956 -5.072 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -20.579 -19.154 -4.932 1.00 0.00 C ATOM 0 H VAL A 686 -19.437 -16.634 -4.710 1.00 0.00 H new ATOM 0 HA VAL A 686 -20.919 -16.771 -2.410 1.00 0.00 H new ATOM 0 HB VAL A 686 -22.034 -18.469 -3.599 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -22.463 -17.447 -5.818 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -22.448 -16.272 -4.481 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -21.047 -16.397 -5.572 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -21.284 -19.527 -5.675 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -19.679 -18.797 -5.433 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -20.317 -19.959 -4.245 1.00 0.00 H new ATOM 1849 N GLU A 687 -20.318 -18.675 -1.017 1.00 0.00 N ATOM 1850 CA GLU A 687 -19.848 -19.637 -0.056 1.00 0.00 C ATOM 1851 C GLU A 687 -20.405 -21.016 -0.397 1.00 0.00 C ATOM 1852 O GLU A 687 -19.667 -21.851 -0.937 1.00 0.00 O ATOM 1853 CB GLU A 687 -20.244 -19.214 1.368 1.00 0.00 C ATOM 1854 CG GLU A 687 -19.787 -20.181 2.452 1.00 0.00 C ATOM 1855 CD GLU A 687 -20.191 -19.747 3.835 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -21.379 -19.878 4.191 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -19.331 -19.260 4.593 1.00 0.00 O ATOM 1858 OXT GLU A 687 -21.601 -21.269 -0.151 1.00 0.00 O ATOM 0 H GLU A 687 -21.161 -18.176 -0.732 1.00 0.00 H new ATOM 0 HA GLU A 687 -18.760 -19.683 -0.096 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -19.824 -18.229 1.573 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -21.328 -19.115 1.418 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -20.204 -21.168 2.250 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -18.702 -20.279 2.410 1.00 0.00 H new