USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 672 GLN : amide:sc= -2.42! K(o=-3.7!,f=0.01) USER MOD Set 1.2: A 679 THR OG1 : rot 140:sc= -1.32 USER MOD Set 2.1: A 602 THR OG1 : rot 100:sc= -0.708 USER MOD Set 2.2: A 651 HIS : no HD1:sc= -6.1! C(o=-7.4!,f=-9.3!) USER MOD Set 2.3: A 652 SER OG : rot 180:sc= -0.594 USER MOD Single : A 573 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 577 HIS : no HD1:sc= -0.0159 X(o=-0.016,f=-0.36) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 584 LYS NZ :NH3+ 156:sc= 1.27 (180deg=1.13) USER MOD Single : A 586 GLN : amide:sc= -0.811 K(o=-0.81,f=0) USER MOD Single : A 587 TYR OH : rot 146:sc= 0.738 USER MOD Single : A 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 SER OG : rot 3:sc= 0.669 USER MOD Single : A 598 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0508) USER MOD Single : A 607 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 608 SER OG : rot 40:sc= 0.131 USER MOD Single : A 610 GLN : amide:sc= -4.15! K(o=-4.2!,f=-0.038) USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : no HD1:sc= -0.0866 X(o=-0.087,f=0) USER MOD Single : A 617 SER OG : rot -130:sc= -0.0526 USER MOD Single : A 624 LYS NZ :NH3+ -141:sc= 1.16 (180deg=-1.51) USER MOD Single : A 626 GLN : amide:sc= -0.904 K(o=-0.9,f=0) USER MOD Single : A 628 GLN : amide:sc= -1.09 K(o=-1.1,f=-5.7!) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -1.56! C(o=-1.6!,f=-3.6!) USER MOD Single : A 640 ASN : amide:sc= -1.25! K(o=-1.3!,f=-0.22) USER MOD Single : A 642 LYS NZ :NH3+ 176:sc= 1.26 (180deg=1.16) USER MOD Single : A 644 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 THR OG1 : rot 48:sc= 0.314 USER MOD Single : A 646 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 649 TYR OH : rot -65:sc= 0.734 USER MOD Single : A 657 TYR OH : rot 5:sc= -0.0344 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= 0.975 K(o=0.97,f=-0.016) USER MOD Single : A 665 MET CE :methyl -133:sc= -0.264 (180deg=-3.09) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -3.27! K(o=-3.3!,f=-1.7) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 24.263 -10.954 0.601 1.00 0.00 N ATOM 85 CA GLU A 568 23.098 -10.525 1.316 1.00 0.00 C ATOM 86 C GLU A 568 22.897 -9.057 1.005 1.00 0.00 C ATOM 87 O GLU A 568 23.865 -8.286 0.941 1.00 0.00 O ATOM 88 CB GLU A 568 23.261 -10.761 2.820 1.00 0.00 C ATOM 89 CG GLU A 568 23.390 -12.236 3.179 1.00 0.00 C ATOM 90 CD GLU A 568 23.699 -12.491 4.637 1.00 0.00 C ATOM 91 OE1 GLU A 568 22.762 -12.643 5.447 1.00 0.00 O ATOM 92 OE2 GLU A 568 24.898 -12.578 4.997 1.00 0.00 O ATOM 0 HA GLU A 568 22.224 -11.098 1.007 1.00 0.00 H new ATOM 0 HB2 GLU A 568 24.144 -10.228 3.172 1.00 0.00 H new ATOM 0 HB3 GLU A 568 22.404 -10.339 3.344 1.00 0.00 H new ATOM 0 HG2 GLU A 568 22.461 -12.744 2.921 1.00 0.00 H new ATOM 0 HG3 GLU A 568 24.176 -12.680 2.569 1.00 0.00 H new ATOM 99 N CYS A 569 21.687 -8.694 0.800 1.00 0.00 N ATOM 100 CA CYS A 569 21.313 -7.369 0.376 1.00 0.00 C ATOM 101 C CYS A 569 21.576 -6.315 1.422 1.00 0.00 C ATOM 102 O CYS A 569 21.484 -6.566 2.611 1.00 0.00 O ATOM 103 CB CYS A 569 19.842 -7.358 0.013 1.00 0.00 C ATOM 104 SG CYS A 569 19.429 -8.315 -1.463 1.00 0.00 S ATOM 0 H CYS A 569 20.892 -9.321 0.923 1.00 0.00 H new ATOM 0 HA CYS A 569 21.932 -7.123 -0.487 1.00 0.00 H new ATOM 0 HB2 CYS A 569 19.270 -7.747 0.855 1.00 0.00 H new ATOM 0 HB3 CYS A 569 19.525 -6.326 -0.138 1.00 0.00 H new ATOM 109 N GLU A 570 21.916 -5.154 0.965 1.00 0.00 N ATOM 110 CA GLU A 570 22.070 -4.003 1.800 1.00 0.00 C ATOM 111 C GLU A 570 21.026 -3.013 1.301 1.00 0.00 C ATOM 112 O GLU A 570 20.670 -3.057 0.116 1.00 0.00 O ATOM 113 CB GLU A 570 23.485 -3.420 1.624 1.00 0.00 C ATOM 114 CG GLU A 570 23.791 -2.208 2.497 1.00 0.00 C ATOM 115 CD GLU A 570 25.187 -1.669 2.284 1.00 0.00 C ATOM 116 OE1 GLU A 570 26.143 -2.224 2.854 1.00 0.00 O ATOM 117 OE2 GLU A 570 25.355 -0.668 1.539 1.00 0.00 O ATOM 0 H GLU A 570 22.099 -4.973 -0.022 1.00 0.00 H new ATOM 0 HA GLU A 570 21.941 -4.234 2.857 1.00 0.00 H new ATOM 0 HB2 GLU A 570 24.214 -4.201 1.842 1.00 0.00 H new ATOM 0 HB3 GLU A 570 23.620 -3.141 0.579 1.00 0.00 H new ATOM 0 HG2 GLU A 570 23.067 -1.421 2.285 1.00 0.00 H new ATOM 0 HG3 GLU A 570 23.668 -2.481 3.545 1.00 0.00 H new ATOM 124 N LEU A 571 20.510 -2.189 2.167 1.00 0.00 N ATOM 125 CA LEU A 571 19.519 -1.200 1.801 1.00 0.00 C ATOM 126 C LEU A 571 20.233 -0.022 1.108 1.00 0.00 C ATOM 127 O LEU A 571 21.016 0.692 1.737 1.00 0.00 O ATOM 128 CB LEU A 571 18.763 -0.769 3.082 1.00 0.00 C ATOM 129 CG LEU A 571 17.433 0.005 2.933 1.00 0.00 C ATOM 130 CD1 LEU A 571 17.627 1.474 2.652 1.00 0.00 C ATOM 131 CD2 LEU A 571 16.561 -0.611 1.863 1.00 0.00 C ATOM 0 H LEU A 571 20.762 -2.179 3.155 1.00 0.00 H new ATOM 0 HA LEU A 571 18.786 -1.599 1.100 1.00 0.00 H new ATOM 0 HB2 LEU A 571 18.559 -1.668 3.664 1.00 0.00 H new ATOM 0 HB3 LEU A 571 19.440 -0.153 3.674 1.00 0.00 H new ATOM 0 HG LEU A 571 16.934 -0.075 3.899 1.00 0.00 H new ATOM 0 HD11 LEU A 571 16.655 1.958 2.559 1.00 0.00 H new ATOM 0 HD12 LEU A 571 18.183 1.931 3.471 1.00 0.00 H new ATOM 0 HD13 LEU A 571 18.184 1.596 1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 571 15.633 -0.046 1.780 1.00 0.00 H new ATOM 0 HD22 LEU A 571 17.086 -0.588 0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 571 16.335 -1.644 2.128 1.00 0.00 H new ATOM 143 N PRO A 572 20.004 0.165 -0.205 1.00 0.00 N ATOM 144 CA PRO A 572 20.667 1.207 -0.991 1.00 0.00 C ATOM 145 C PRO A 572 20.067 2.575 -0.725 1.00 0.00 C ATOM 146 O PRO A 572 19.256 2.740 0.194 1.00 0.00 O ATOM 147 CB PRO A 572 20.372 0.783 -2.427 1.00 0.00 C ATOM 148 CG PRO A 572 19.055 0.127 -2.333 1.00 0.00 C ATOM 149 CD PRO A 572 19.062 -0.604 -1.032 1.00 0.00 C ATOM 0 HA PRO A 572 21.728 1.297 -0.758 1.00 0.00 H new ATOM 0 HB2 PRO A 572 20.346 1.640 -3.100 1.00 0.00 H new ATOM 0 HB3 PRO A 572 21.133 0.102 -2.808 1.00 0.00 H new ATOM 0 HG2 PRO A 572 18.249 0.860 -2.366 1.00 0.00 H new ATOM 0 HG3 PRO A 572 18.898 -0.558 -3.166 1.00 0.00 H new ATOM 0 HD2 PRO A 572 18.069 -0.634 -0.584 1.00 0.00 H new ATOM 0 HD3 PRO A 572 19.388 -1.637 -1.155 1.00 0.00 H new ATOM 157 N LYS A 573 20.442 3.547 -1.516 1.00 0.00 N ATOM 158 CA LYS A 573 19.921 4.872 -1.352 1.00 0.00 C ATOM 159 C LYS A 573 18.498 4.935 -1.850 1.00 0.00 C ATOM 160 O LYS A 573 18.235 4.929 -3.058 1.00 0.00 O ATOM 161 CB LYS A 573 20.794 5.912 -2.055 1.00 0.00 C ATOM 162 CG LYS A 573 22.231 5.921 -1.575 1.00 0.00 C ATOM 163 CD LYS A 573 22.334 6.214 -0.091 1.00 0.00 C ATOM 164 CE LYS A 573 23.772 6.137 0.364 1.00 0.00 C ATOM 165 NZ LYS A 573 23.922 6.406 1.801 1.00 0.00 N ATOM 0 H LYS A 573 21.108 3.442 -2.281 1.00 0.00 H new ATOM 0 HA LYS A 573 19.931 5.110 -0.288 1.00 0.00 H new ATOM 0 HB2 LYS A 573 20.779 5.721 -3.128 1.00 0.00 H new ATOM 0 HB3 LYS A 573 20.362 6.901 -1.901 1.00 0.00 H new ATOM 0 HG2 LYS A 573 22.689 4.955 -1.786 1.00 0.00 H new ATOM 0 HG3 LYS A 573 22.794 6.670 -2.132 1.00 0.00 H new ATOM 0 HD2 LYS A 573 21.932 7.205 0.119 1.00 0.00 H new ATOM 0 HD3 LYS A 573 21.730 5.500 0.470 1.00 0.00 H new ATOM 0 HE2 LYS A 573 24.168 5.147 0.140 1.00 0.00 H new ATOM 0 HE3 LYS A 573 24.368 6.854 -0.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 24.926 6.341 2.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 23.569 7.361 2.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 23.377 5.706 2.344 1.00 0.00 H new ATOM 179 N ILE A 574 17.596 4.923 -0.919 1.00 0.00 N ATOM 180 CA ILE A 574 16.186 5.036 -1.196 1.00 0.00 C ATOM 181 C ILE A 574 15.838 6.501 -1.339 1.00 0.00 C ATOM 182 O ILE A 574 16.732 7.350 -1.472 1.00 0.00 O ATOM 183 CB ILE A 574 15.339 4.444 -0.048 1.00 0.00 C ATOM 184 CG1 ILE A 574 15.764 5.069 1.292 1.00 0.00 C ATOM 185 CG2 ILE A 574 15.474 2.924 -0.015 1.00 0.00 C ATOM 186 CD1 ILE A 574 14.911 4.679 2.466 1.00 0.00 C ATOM 0 H ILE A 574 17.815 4.833 0.073 1.00 0.00 H new ATOM 0 HA ILE A 574 15.969 4.485 -2.111 1.00 0.00 H new ATOM 0 HB ILE A 574 14.289 4.681 -0.220 1.00 0.00 H new ATOM 0 HG12 ILE A 574 16.795 4.784 1.499 1.00 0.00 H new ATOM 0 HG13 ILE A 574 15.747 6.154 1.193 1.00 0.00 H new ATOM 0 HG21 ILE A 574 14.871 2.523 0.800 1.00 0.00 H new ATOM 0 HG22 ILE A 574 15.129 2.507 -0.961 1.00 0.00 H new ATOM 0 HG23 ILE A 574 16.519 2.655 0.140 1.00 0.00 H new ATOM 0 HD11 ILE A 574 15.286 5.167 3.366 1.00 0.00 H new ATOM 0 HD12 ILE A 574 13.882 4.989 2.287 1.00 0.00 H new ATOM 0 HD13 ILE A 574 14.946 3.598 2.598 1.00 0.00 H new ATOM 193 N ASP A 575 14.573 6.814 -1.324 1.00 0.00 N ATOM 194 CA ASP A 575 14.182 8.191 -1.355 1.00 0.00 C ATOM 195 C ASP A 575 14.400 8.748 0.021 1.00 0.00 C ATOM 196 O ASP A 575 14.208 8.049 1.024 1.00 0.00 O ATOM 197 CB ASP A 575 12.720 8.369 -1.715 1.00 0.00 C ATOM 198 CG ASP A 575 12.373 9.815 -2.021 1.00 0.00 C ATOM 199 OD1 ASP A 575 12.081 10.575 -1.081 1.00 0.00 O ATOM 200 OD2 ASP A 575 12.398 10.218 -3.201 1.00 0.00 O ATOM 0 H ASP A 575 13.805 6.143 -1.291 1.00 0.00 H new ATOM 0 HA ASP A 575 14.773 8.703 -2.114 1.00 0.00 H new ATOM 0 HB2 ASP A 575 12.483 7.750 -2.581 1.00 0.00 H new ATOM 0 HB3 ASP A 575 12.100 8.015 -0.891 1.00 0.00 H new ATOM 205 N VAL A 576 14.807 9.958 0.072 1.00 0.00 N ATOM 206 CA VAL A 576 15.041 10.684 1.304 1.00 0.00 C ATOM 207 C VAL A 576 13.777 10.721 2.204 1.00 0.00 C ATOM 208 O VAL A 576 13.872 10.803 3.418 1.00 0.00 O ATOM 209 CB VAL A 576 15.533 12.117 0.988 1.00 0.00 C ATOM 210 CG1 VAL A 576 14.503 12.856 0.146 1.00 0.00 C ATOM 211 CG2 VAL A 576 15.872 12.894 2.258 1.00 0.00 C ATOM 0 H VAL A 576 15.000 10.510 -0.764 1.00 0.00 H new ATOM 0 HA VAL A 576 15.815 10.156 1.862 1.00 0.00 H new ATOM 0 HB VAL A 576 16.455 12.035 0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 576 14.863 13.862 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 576 14.346 12.320 -0.790 1.00 0.00 H new ATOM 0 HG13 VAL A 576 13.562 12.916 0.692 1.00 0.00 H new ATOM 0 HG21 VAL A 576 16.213 13.895 1.992 1.00 0.00 H new ATOM 0 HG22 VAL A 576 14.985 12.968 2.887 1.00 0.00 H new ATOM 0 HG23 VAL A 576 16.660 12.375 2.803 1.00 0.00 H new ATOM 215 N HIS A 577 12.610 10.631 1.609 1.00 0.00 N ATOM 216 CA HIS A 577 11.385 10.640 2.368 1.00 0.00 C ATOM 217 C HIS A 577 10.789 9.274 2.479 1.00 0.00 C ATOM 218 O HIS A 577 9.668 9.127 2.939 1.00 0.00 O ATOM 219 CB HIS A 577 10.384 11.627 1.790 1.00 0.00 C ATOM 220 CG HIS A 577 10.738 13.039 2.104 1.00 0.00 C ATOM 221 ND1 HIS A 577 11.130 13.943 1.160 1.00 0.00 N ATOM 222 CD2 HIS A 577 10.754 13.699 3.281 1.00 0.00 C ATOM 223 CE1 HIS A 577 11.377 15.095 1.732 1.00 0.00 C ATOM 224 NE2 HIS A 577 11.155 14.976 3.020 1.00 0.00 N ATOM 0 H HIS A 577 12.485 10.551 0.600 1.00 0.00 H new ATOM 0 HA HIS A 577 11.636 10.968 3.377 1.00 0.00 H new ATOM 0 HB2 HIS A 577 10.334 11.499 0.709 1.00 0.00 H new ATOM 0 HB3 HIS A 577 9.392 11.407 2.184 1.00 0.00 H new ATOM 0 HD2 HIS A 577 10.497 13.292 4.248 1.00 0.00 H new ATOM 0 HE1 HIS A 577 11.708 15.992 1.229 1.00 0.00 H new ATOM 0 HE2 HIS A 577 11.264 15.717 3.712 1.00 0.00 H new ATOM 233 N LEU A 578 11.542 8.287 2.093 1.00 0.00 N ATOM 234 CA LEU A 578 11.099 6.928 2.161 1.00 0.00 C ATOM 235 C LEU A 578 11.615 6.330 3.444 1.00 0.00 C ATOM 236 O LEU A 578 12.636 6.779 3.980 1.00 0.00 O ATOM 237 CB LEU A 578 11.677 6.142 1.017 1.00 0.00 C ATOM 238 CG LEU A 578 10.935 4.875 0.659 1.00 0.00 C ATOM 239 CD1 LEU A 578 9.786 5.151 -0.274 1.00 0.00 C ATOM 240 CD2 LEU A 578 11.853 3.908 0.075 1.00 0.00 C ATOM 0 H LEU A 578 12.484 8.403 1.721 1.00 0.00 H new ATOM 0 HA LEU A 578 10.010 6.896 2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 578 11.710 6.784 0.137 1.00 0.00 H new ATOM 0 HB3 LEU A 578 12.707 5.883 1.261 1.00 0.00 H new ATOM 0 HG LEU A 578 10.516 4.458 1.575 1.00 0.00 H new ATOM 0 HD11 LEU A 578 9.276 4.217 -0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 578 9.086 5.836 0.204 1.00 0.00 H new ATOM 0 HD13 LEU A 578 10.163 5.600 -1.193 1.00 0.00 H new ATOM 0 HD21 LEU A 578 11.309 2.998 -0.180 1.00 0.00 H new ATOM 0 HD22 LEU A 578 12.299 4.328 -0.826 1.00 0.00 H new ATOM 0 HD23 LEU A 578 12.638 3.672 0.793 1.00 0.00 H new ATOM 252 N VAL A 579 10.928 5.364 3.942 1.00 0.00 N ATOM 253 CA VAL A 579 11.322 4.661 5.114 1.00 0.00 C ATOM 254 C VAL A 579 10.930 3.182 4.973 1.00 0.00 C ATOM 255 O VAL A 579 9.768 2.849 4.707 1.00 0.00 O ATOM 256 CB VAL A 579 10.739 5.316 6.413 1.00 0.00 C ATOM 257 CG1 VAL A 579 9.216 5.407 6.389 1.00 0.00 C ATOM 258 CG2 VAL A 579 11.224 4.592 7.656 1.00 0.00 C ATOM 0 H VAL A 579 10.053 5.031 3.536 1.00 0.00 H new ATOM 0 HA VAL A 579 12.405 4.721 5.218 1.00 0.00 H new ATOM 0 HB VAL A 579 11.114 6.339 6.445 1.00 0.00 H new ATOM 0 HG11 VAL A 579 8.864 5.868 7.312 1.00 0.00 H new ATOM 0 HG12 VAL A 579 8.901 6.011 5.538 1.00 0.00 H new ATOM 0 HG13 VAL A 579 8.793 4.406 6.299 1.00 0.00 H new ATOM 0 HG21 VAL A 579 10.804 5.068 8.542 1.00 0.00 H new ATOM 0 HG22 VAL A 579 10.905 3.550 7.618 1.00 0.00 H new ATOM 0 HG23 VAL A 579 12.312 4.637 7.702 1.00 0.00 H new ATOM 262 N PRO A 580 11.914 2.296 5.031 1.00 0.00 N ATOM 263 CA PRO A 580 11.675 0.865 4.944 1.00 0.00 C ATOM 264 C PRO A 580 11.077 0.300 6.240 1.00 0.00 C ATOM 265 O PRO A 580 11.499 0.676 7.347 1.00 0.00 O ATOM 266 CB PRO A 580 13.073 0.291 4.707 1.00 0.00 C ATOM 267 CG PRO A 580 14.009 1.285 5.299 1.00 0.00 C ATOM 268 CD PRO A 580 13.347 2.621 5.160 1.00 0.00 C ATOM 0 HA PRO A 580 10.957 0.614 4.163 1.00 0.00 H new ATOM 0 HB2 PRO A 580 13.184 -0.685 5.181 1.00 0.00 H new ATOM 0 HB3 PRO A 580 13.267 0.153 3.643 1.00 0.00 H new ATOM 0 HG2 PRO A 580 14.207 1.057 6.346 1.00 0.00 H new ATOM 0 HG3 PRO A 580 14.969 1.271 4.782 1.00 0.00 H new ATOM 0 HD2 PRO A 580 13.537 3.253 6.028 1.00 0.00 H new ATOM 0 HD3 PRO A 580 13.715 3.160 4.287 1.00 0.00 H new ATOM 276 N ASP A 581 10.088 -0.578 6.100 1.00 0.00 N ATOM 277 CA ASP A 581 9.482 -1.246 7.250 1.00 0.00 C ATOM 278 C ASP A 581 10.474 -2.230 7.808 1.00 0.00 C ATOM 279 O ASP A 581 10.648 -2.339 9.015 1.00 0.00 O ATOM 280 CB ASP A 581 8.184 -1.965 6.873 1.00 0.00 C ATOM 281 CG ASP A 581 7.547 -2.667 8.051 1.00 0.00 C ATOM 282 OD1 ASP A 581 6.780 -2.014 8.809 1.00 0.00 O ATOM 283 OD2 ASP A 581 7.793 -3.878 8.244 1.00 0.00 O ATOM 0 H ASP A 581 9.688 -0.845 5.200 1.00 0.00 H new ATOM 0 HA ASP A 581 9.227 -0.494 7.997 1.00 0.00 H new ATOM 0 HB2 ASP A 581 7.479 -1.243 6.460 1.00 0.00 H new ATOM 0 HB3 ASP A 581 8.391 -2.693 6.089 1.00 0.00 H new ATOM 288 N ARG A 582 11.137 -2.940 6.917 1.00 0.00 N ATOM 289 CA ARG A 582 12.221 -3.778 7.327 1.00 0.00 C ATOM 290 C ARG A 582 13.422 -2.920 7.442 1.00 0.00 C ATOM 291 O ARG A 582 13.786 -2.238 6.489 1.00 0.00 O ATOM 292 CB ARG A 582 12.504 -4.930 6.363 1.00 0.00 C ATOM 293 CG ARG A 582 11.506 -6.071 6.379 1.00 0.00 C ATOM 294 CD ARG A 582 11.264 -6.591 7.792 1.00 0.00 C ATOM 295 NE ARG A 582 10.187 -5.855 8.492 1.00 0.00 N ATOM 296 CZ ARG A 582 9.908 -5.939 9.805 1.00 0.00 C ATOM 297 NH1 ARG A 582 10.593 -6.757 10.591 1.00 0.00 N ATOM 298 NH2 ARG A 582 8.926 -5.211 10.306 1.00 0.00 N ATOM 0 H ARG A 582 10.939 -2.947 5.916 1.00 0.00 H new ATOM 0 HA ARG A 582 11.952 -4.243 8.275 1.00 0.00 H new ATOM 0 HB2 ARG A 582 12.549 -4.528 5.351 1.00 0.00 H new ATOM 0 HB3 ARG A 582 13.491 -5.334 6.590 1.00 0.00 H new ATOM 0 HG2 ARG A 582 10.563 -5.735 5.949 1.00 0.00 H new ATOM 0 HG3 ARG A 582 11.872 -6.883 5.750 1.00 0.00 H new ATOM 0 HD2 ARG A 582 11.006 -7.649 7.747 1.00 0.00 H new ATOM 0 HD3 ARG A 582 12.186 -6.512 8.367 1.00 0.00 H new ATOM 0 HE ARG A 582 9.607 -5.231 7.931 1.00 0.00 H new ATOM 0 HH11 ARG A 582 11.341 -7.331 10.202 1.00 0.00 H new ATOM 0 HH12 ARG A 582 10.373 -6.812 11.585 1.00 0.00 H new ATOM 0 HH21 ARG A 582 8.388 -4.593 9.698 1.00 0.00 H new ATOM 0 HH22 ARG A 582 8.706 -5.267 11.300 1.00 0.00 H new ATOM 312 N LYS A 583 14.015 -2.928 8.581 1.00 0.00 N ATOM 313 CA LYS A 583 15.134 -2.102 8.827 1.00 0.00 C ATOM 314 C LYS A 583 16.163 -2.917 9.576 1.00 0.00 C ATOM 315 O LYS A 583 16.121 -3.039 10.807 1.00 0.00 O ATOM 316 CB LYS A 583 14.692 -0.858 9.609 1.00 0.00 C ATOM 317 CG LYS A 583 15.671 0.308 9.597 1.00 0.00 C ATOM 318 CD LYS A 583 15.102 1.507 10.359 1.00 0.00 C ATOM 319 CE LYS A 583 13.737 1.934 9.804 1.00 0.00 C ATOM 320 NZ LYS A 583 13.154 3.068 10.557 1.00 0.00 N ATOM 0 H LYS A 583 13.735 -3.511 9.370 1.00 0.00 H new ATOM 0 HA LYS A 583 15.581 -1.751 7.897 1.00 0.00 H new ATOM 0 HB2 LYS A 583 13.741 -0.515 9.203 1.00 0.00 H new ATOM 0 HB3 LYS A 583 14.511 -1.147 10.644 1.00 0.00 H new ATOM 0 HG2 LYS A 583 16.615 0.000 10.048 1.00 0.00 H new ATOM 0 HG3 LYS A 583 15.888 0.595 8.568 1.00 0.00 H new ATOM 0 HD2 LYS A 583 15.003 1.254 11.415 1.00 0.00 H new ATOM 0 HD3 LYS A 583 15.799 2.343 10.295 1.00 0.00 H new ATOM 0 HE2 LYS A 583 13.845 2.214 8.756 1.00 0.00 H new ATOM 0 HE3 LYS A 583 13.052 1.087 9.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 12.233 3.321 10.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 13.026 2.794 11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 13.794 3.886 10.503 1.00 0.00 H new ATOM 334 N LYS A 584 17.029 -3.523 8.824 1.00 0.00 N ATOM 335 CA LYS A 584 18.070 -4.372 9.348 1.00 0.00 C ATOM 336 C LYS A 584 19.360 -4.101 8.615 1.00 0.00 C ATOM 337 O LYS A 584 19.364 -3.350 7.638 1.00 0.00 O ATOM 338 CB LYS A 584 17.667 -5.864 9.280 1.00 0.00 C ATOM 339 CG LYS A 584 17.173 -6.350 7.917 1.00 0.00 C ATOM 340 CD LYS A 584 16.588 -7.746 7.982 1.00 0.00 C ATOM 341 CE LYS A 584 15.140 -7.692 8.439 1.00 0.00 C ATOM 342 NZ LYS A 584 14.622 -9.016 8.826 1.00 0.00 N ATOM 0 H LYS A 584 17.038 -3.444 7.807 1.00 0.00 H new ATOM 0 HA LYS A 584 18.220 -4.141 10.403 1.00 0.00 H new ATOM 0 HB2 LYS A 584 18.526 -6.468 9.572 1.00 0.00 H new ATOM 0 HB3 LYS A 584 16.884 -6.045 10.017 1.00 0.00 H new ATOM 0 HG2 LYS A 584 16.419 -5.660 7.539 1.00 0.00 H new ATOM 0 HG3 LYS A 584 18.000 -6.338 7.208 1.00 0.00 H new ATOM 0 HD2 LYS A 584 16.649 -8.219 7.002 1.00 0.00 H new ATOM 0 HD3 LYS A 584 17.170 -8.360 8.669 1.00 0.00 H new ATOM 0 HE2 LYS A 584 15.054 -7.010 9.285 1.00 0.00 H new ATOM 0 HE3 LYS A 584 14.524 -7.284 7.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 13.827 -8.898 9.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 14.296 -9.523 7.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 15.377 -9.563 9.287 1.00 0.00 H new ATOM 356 N ASP A 585 20.443 -4.688 9.074 1.00 0.00 N ATOM 357 CA ASP A 585 21.752 -4.443 8.478 1.00 0.00 C ATOM 358 C ASP A 585 21.845 -5.034 7.099 1.00 0.00 C ATOM 359 O ASP A 585 22.247 -4.359 6.152 1.00 0.00 O ATOM 360 CB ASP A 585 22.907 -4.945 9.367 1.00 0.00 C ATOM 361 CG ASP A 585 23.063 -4.147 10.642 1.00 0.00 C ATOM 362 OD1 ASP A 585 23.617 -3.036 10.596 1.00 0.00 O ATOM 363 OD2 ASP A 585 22.617 -4.615 11.720 1.00 0.00 O ATOM 0 H ASP A 585 20.451 -5.340 9.858 1.00 0.00 H new ATOM 0 HA ASP A 585 21.857 -3.361 8.395 1.00 0.00 H new ATOM 0 HB2 ASP A 585 22.735 -5.992 9.619 1.00 0.00 H new ATOM 0 HB3 ASP A 585 23.838 -4.902 8.802 1.00 0.00 H new ATOM 368 N GLN A 586 21.479 -6.282 6.978 1.00 0.00 N ATOM 369 CA GLN A 586 21.490 -6.961 5.712 1.00 0.00 C ATOM 370 C GLN A 586 20.199 -7.676 5.511 1.00 0.00 C ATOM 371 O GLN A 586 19.516 -8.052 6.467 1.00 0.00 O ATOM 372 CB GLN A 586 22.678 -7.906 5.573 1.00 0.00 C ATOM 373 CG GLN A 586 23.986 -7.175 5.547 1.00 0.00 C ATOM 374 CD GLN A 586 24.934 -7.724 6.551 1.00 0.00 C ATOM 375 OE1 GLN A 586 25.771 -8.584 6.253 1.00 0.00 O ATOM 376 NE2 GLN A 586 24.719 -7.349 7.775 1.00 0.00 N ATOM 0 H GLN A 586 21.164 -6.858 7.759 1.00 0.00 H new ATOM 0 HA GLN A 586 21.604 -6.211 4.929 1.00 0.00 H new ATOM 0 HB2 GLN A 586 22.676 -8.613 6.402 1.00 0.00 H new ATOM 0 HB3 GLN A 586 22.571 -8.488 4.658 1.00 0.00 H new ATOM 0 HG2 GLN A 586 24.425 -7.247 4.552 1.00 0.00 H new ATOM 0 HG3 GLN A 586 23.817 -6.116 5.745 1.00 0.00 H new ATOM 0 HE21 GLN A 586 24.018 -6.635 7.974 1.00 0.00 H new ATOM 0 HE22 GLN A 586 25.251 -7.768 8.538 1.00 0.00 H new ATOM 385 N TYR A 587 19.863 -7.843 4.297 1.00 0.00 N ATOM 386 CA TYR A 587 18.633 -8.421 3.914 1.00 0.00 C ATOM 387 C TYR A 587 18.896 -9.702 3.219 1.00 0.00 C ATOM 388 O TYR A 587 19.614 -9.752 2.233 1.00 0.00 O ATOM 389 CB TYR A 587 17.800 -7.443 3.062 1.00 0.00 C ATOM 390 CG TYR A 587 17.464 -6.175 3.821 1.00 0.00 C ATOM 391 CD1 TYR A 587 18.374 -5.127 3.879 1.00 0.00 C ATOM 392 CD2 TYR A 587 16.266 -6.045 4.523 1.00 0.00 C ATOM 393 CE1 TYR A 587 18.117 -3.995 4.611 1.00 0.00 C ATOM 394 CE2 TYR A 587 15.996 -4.899 5.247 1.00 0.00 C ATOM 395 CZ TYR A 587 16.932 -3.882 5.293 1.00 0.00 C ATOM 396 OH TYR A 587 16.686 -2.762 6.040 1.00 0.00 O ATOM 0 H TYR A 587 20.454 -7.573 3.510 1.00 0.00 H new ATOM 0 HA TYR A 587 18.033 -8.632 4.800 1.00 0.00 H new ATOM 0 HB2 TYR A 587 18.352 -7.189 2.157 1.00 0.00 H new ATOM 0 HB3 TYR A 587 16.878 -7.932 2.746 1.00 0.00 H new ATOM 0 HD1 TYR A 587 19.304 -5.205 3.336 1.00 0.00 H new ATOM 0 HD2 TYR A 587 15.543 -6.847 4.501 1.00 0.00 H new ATOM 0 HE1 TYR A 587 18.844 -3.197 4.650 1.00 0.00 H new ATOM 0 HE2 TYR A 587 15.059 -4.798 5.774 1.00 0.00 H new ATOM 0 HH TYR A 587 15.730 -2.550 6.007 1.00 0.00 H new ATOM 406 N LYS A 588 18.377 -10.729 3.782 1.00 0.00 N ATOM 407 CA LYS A 588 18.525 -12.059 3.276 1.00 0.00 C ATOM 408 C LYS A 588 17.731 -12.178 1.997 1.00 0.00 C ATOM 409 O LYS A 588 16.665 -11.578 1.880 1.00 0.00 O ATOM 410 CB LYS A 588 17.993 -13.021 4.327 1.00 0.00 C ATOM 411 CG LYS A 588 18.652 -12.822 5.687 1.00 0.00 C ATOM 412 CD LYS A 588 17.976 -13.619 6.780 1.00 0.00 C ATOM 413 CE LYS A 588 18.040 -15.105 6.523 1.00 0.00 C ATOM 414 NZ LYS A 588 17.384 -15.856 7.601 1.00 0.00 N ATOM 0 H LYS A 588 17.819 -10.675 4.634 1.00 0.00 H new ATOM 0 HA LYS A 588 19.569 -12.292 3.065 1.00 0.00 H new ATOM 0 HB2 LYS A 588 16.916 -12.887 4.426 1.00 0.00 H new ATOM 0 HB3 LYS A 588 18.157 -14.046 3.994 1.00 0.00 H new ATOM 0 HG2 LYS A 588 19.701 -13.113 5.625 1.00 0.00 H new ATOM 0 HG3 LYS A 588 18.630 -11.764 5.947 1.00 0.00 H new ATOM 0 HD2 LYS A 588 18.450 -13.396 7.736 1.00 0.00 H new ATOM 0 HD3 LYS A 588 16.934 -13.310 6.861 1.00 0.00 H new ATOM 0 HE2 LYS A 588 17.560 -15.334 5.572 1.00 0.00 H new ATOM 0 HE3 LYS A 588 19.081 -15.418 6.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 17.442 -16.875 7.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 17.859 -15.654 8.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 16.385 -15.572 7.664 1.00 0.00 H new ATOM 428 N VAL A 589 18.246 -12.892 1.042 1.00 0.00 N ATOM 429 CA VAL A 589 17.554 -13.072 -0.224 1.00 0.00 C ATOM 430 C VAL A 589 16.213 -13.767 -0.017 1.00 0.00 C ATOM 431 O VAL A 589 16.128 -14.922 0.412 1.00 0.00 O ATOM 432 CB VAL A 589 18.447 -13.741 -1.313 1.00 0.00 C ATOM 433 CG1 VAL A 589 19.186 -14.892 -0.739 1.00 0.00 C ATOM 434 CG2 VAL A 589 17.642 -14.184 -2.528 1.00 0.00 C ATOM 0 H VAL A 589 19.147 -13.366 1.104 1.00 0.00 H new ATOM 0 HA VAL A 589 17.334 -12.082 -0.625 1.00 0.00 H new ATOM 0 HB VAL A 589 19.159 -12.988 -1.653 1.00 0.00 H new ATOM 0 HG11 VAL A 589 19.805 -15.349 -1.511 1.00 0.00 H new ATOM 0 HG12 VAL A 589 19.820 -14.547 0.077 1.00 0.00 H new ATOM 0 HG13 VAL A 589 18.476 -15.628 -0.361 1.00 0.00 H new ATOM 0 HG21 VAL A 589 18.308 -14.644 -3.258 1.00 0.00 H new ATOM 0 HG22 VAL A 589 16.887 -14.907 -2.220 1.00 0.00 H new ATOM 0 HG23 VAL A 589 17.154 -13.319 -2.977 1.00 0.00 H new ATOM 438 N GLY A 590 15.177 -13.019 -0.273 1.00 0.00 N ATOM 439 CA GLY A 590 13.844 -13.452 -0.022 1.00 0.00 C ATOM 440 C GLY A 590 13.153 -12.511 0.930 1.00 0.00 C ATOM 441 O GLY A 590 11.924 -12.545 1.061 1.00 0.00 O ATOM 0 H GLY A 590 15.242 -12.080 -0.667 1.00 0.00 H new ATOM 0 HA2 GLY A 590 13.289 -13.502 -0.959 1.00 0.00 H new ATOM 0 HA3 GLY A 590 13.855 -14.458 0.396 1.00 0.00 H new ATOM 445 N GLU A 591 13.935 -11.658 1.608 1.00 0.00 N ATOM 446 CA GLU A 591 13.375 -10.649 2.458 1.00 0.00 C ATOM 447 C GLU A 591 12.767 -9.619 1.599 1.00 0.00 C ATOM 448 O GLU A 591 13.412 -9.108 0.675 1.00 0.00 O ATOM 449 CB GLU A 591 14.426 -10.000 3.362 1.00 0.00 C ATOM 450 CG GLU A 591 14.877 -10.862 4.516 1.00 0.00 C ATOM 451 CD GLU A 591 13.805 -11.046 5.562 1.00 0.00 C ATOM 452 OE1 GLU A 591 12.884 -11.866 5.364 1.00 0.00 O ATOM 453 OE2 GLU A 591 13.876 -10.378 6.617 1.00 0.00 O ATOM 0 H GLU A 591 14.954 -11.663 1.571 1.00 0.00 H new ATOM 0 HA GLU A 591 12.636 -11.115 3.109 1.00 0.00 H new ATOM 0 HB2 GLU A 591 15.295 -9.739 2.758 1.00 0.00 H new ATOM 0 HB3 GLU A 591 14.021 -9.068 3.757 1.00 0.00 H new ATOM 0 HG2 GLU A 591 15.180 -11.838 4.138 1.00 0.00 H new ATOM 0 HG3 GLU A 591 15.756 -10.412 4.978 1.00 0.00 H new ATOM 460 N VAL A 592 11.554 -9.341 1.839 1.00 0.00 N ATOM 461 CA VAL A 592 10.900 -8.362 1.096 1.00 0.00 C ATOM 462 C VAL A 592 10.785 -7.103 1.907 1.00 0.00 C ATOM 463 O VAL A 592 10.195 -7.068 3.003 1.00 0.00 O ATOM 464 CB VAL A 592 9.569 -8.832 0.514 1.00 0.00 C ATOM 465 CG1 VAL A 592 8.613 -9.335 1.559 1.00 0.00 C ATOM 466 CG2 VAL A 592 8.983 -7.750 -0.307 1.00 0.00 C ATOM 0 H VAL A 592 10.987 -9.789 2.559 1.00 0.00 H new ATOM 0 HA VAL A 592 11.507 -8.143 0.218 1.00 0.00 H new ATOM 0 HB VAL A 592 9.765 -9.694 -0.124 1.00 0.00 H new ATOM 0 HG11 VAL A 592 7.687 -9.654 1.081 1.00 0.00 H new ATOM 0 HG12 VAL A 592 9.060 -10.179 2.085 1.00 0.00 H new ATOM 0 HG13 VAL A 592 8.399 -8.537 2.270 1.00 0.00 H new ATOM 0 HG21 VAL A 592 8.033 -8.083 -0.724 1.00 0.00 H new ATOM 0 HG22 VAL A 592 8.818 -6.870 0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 592 9.666 -7.498 -1.118 1.00 0.00 H new ATOM 470 N LEU A 593 11.379 -6.095 1.403 1.00 0.00 N ATOM 471 CA LEU A 593 11.449 -4.862 2.072 1.00 0.00 C ATOM 472 C LEU A 593 10.288 -4.027 1.671 1.00 0.00 C ATOM 473 O LEU A 593 10.243 -3.474 0.574 1.00 0.00 O ATOM 474 CB LEU A 593 12.772 -4.132 1.813 1.00 0.00 C ATOM 475 CG LEU A 593 14.052 -4.746 2.349 1.00 0.00 C ATOM 476 CD1 LEU A 593 14.358 -6.092 1.724 1.00 0.00 C ATOM 477 CD2 LEU A 593 15.179 -3.788 2.110 1.00 0.00 C ATOM 0 H LEU A 593 11.840 -6.105 0.493 1.00 0.00 H new ATOM 0 HA LEU A 593 11.412 -5.050 3.145 1.00 0.00 H new ATOM 0 HB2 LEU A 593 12.884 -4.020 0.735 1.00 0.00 H new ATOM 0 HB3 LEU A 593 12.685 -3.129 2.230 1.00 0.00 H new ATOM 0 HG LEU A 593 13.924 -4.926 3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 593 15.284 -6.486 2.143 1.00 0.00 H new ATOM 0 HD12 LEU A 593 13.542 -6.784 1.933 1.00 0.00 H new ATOM 0 HD13 LEU A 593 14.469 -5.976 0.646 1.00 0.00 H new ATOM 0 HD21 LEU A 593 16.107 -4.216 2.490 1.00 0.00 H new ATOM 0 HD22 LEU A 593 15.277 -3.601 1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 593 14.974 -2.849 2.625 1.00 0.00 H new ATOM 489 N LYS A 594 9.312 -4.045 2.512 1.00 0.00 N ATOM 490 CA LYS A 594 8.150 -3.252 2.347 1.00 0.00 C ATOM 491 C LYS A 594 8.494 -1.849 2.771 1.00 0.00 C ATOM 492 O LYS A 594 8.953 -1.631 3.880 1.00 0.00 O ATOM 493 CB LYS A 594 7.028 -3.828 3.195 1.00 0.00 C ATOM 494 CG LYS A 594 6.698 -5.265 2.837 1.00 0.00 C ATOM 495 CD LYS A 594 5.631 -5.823 3.737 1.00 0.00 C ATOM 496 CE LYS A 594 5.319 -7.266 3.395 1.00 0.00 C ATOM 497 NZ LYS A 594 4.323 -7.849 4.312 1.00 0.00 N ATOM 0 H LYS A 594 9.302 -4.625 3.351 1.00 0.00 H new ATOM 0 HA LYS A 594 7.813 -3.244 1.310 1.00 0.00 H new ATOM 0 HB2 LYS A 594 7.310 -3.776 4.247 1.00 0.00 H new ATOM 0 HB3 LYS A 594 6.135 -3.214 3.074 1.00 0.00 H new ATOM 0 HG2 LYS A 594 6.365 -5.316 1.800 1.00 0.00 H new ATOM 0 HG3 LYS A 594 7.597 -5.876 2.914 1.00 0.00 H new ATOM 0 HD2 LYS A 594 5.956 -5.756 4.775 1.00 0.00 H new ATOM 0 HD3 LYS A 594 4.726 -5.222 3.647 1.00 0.00 H new ATOM 0 HE2 LYS A 594 4.947 -7.324 2.372 1.00 0.00 H new ATOM 0 HE3 LYS A 594 6.236 -7.854 3.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 4.139 -8.836 4.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 4.688 -7.818 5.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 3.439 -7.304 4.256 1.00 0.00 H new ATOM 511 N PHE A 595 8.385 -0.944 1.872 1.00 0.00 N ATOM 512 CA PHE A 595 8.683 0.426 2.139 1.00 0.00 C ATOM 513 C PHE A 595 7.418 1.191 2.432 1.00 0.00 C ATOM 514 O PHE A 595 6.308 0.632 2.397 1.00 0.00 O ATOM 515 CB PHE A 595 9.400 1.073 0.951 1.00 0.00 C ATOM 516 CG PHE A 595 10.703 0.441 0.588 1.00 0.00 C ATOM 517 CD1 PHE A 595 11.785 0.527 1.437 1.00 0.00 C ATOM 518 CD2 PHE A 595 10.849 -0.228 -0.607 1.00 0.00 C ATOM 519 CE1 PHE A 595 12.990 -0.043 1.103 1.00 0.00 C ATOM 520 CE2 PHE A 595 12.051 -0.797 -0.949 1.00 0.00 C ATOM 521 CZ PHE A 595 13.125 -0.706 -0.091 1.00 0.00 C ATOM 0 H PHE A 595 8.083 -1.128 0.915 1.00 0.00 H new ATOM 0 HA PHE A 595 9.339 0.460 3.009 1.00 0.00 H new ATOM 0 HB2 PHE A 595 8.741 1.038 0.084 1.00 0.00 H new ATOM 0 HB3 PHE A 595 9.573 2.125 1.178 1.00 0.00 H new ATOM 0 HD1 PHE A 595 11.685 1.049 2.377 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.010 -0.306 -1.282 1.00 0.00 H new ATOM 0 HE1 PHE A 595 13.829 0.031 1.779 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.154 -1.316 -1.891 1.00 0.00 H new ATOM 0 HZ PHE A 595 14.070 -1.155 -0.357 1.00 0.00 H new ATOM 531 N SER A 596 7.598 2.443 2.696 1.00 0.00 N ATOM 532 CA SER A 596 6.592 3.390 2.969 1.00 0.00 C ATOM 533 C SER A 596 7.309 4.713 2.920 1.00 0.00 C ATOM 534 O SER A 596 8.534 4.720 2.936 1.00 0.00 O ATOM 535 CB SER A 596 5.994 3.116 4.367 1.00 0.00 C ATOM 536 OG SER A 596 7.028 2.896 5.334 1.00 0.00 O ATOM 0 H SER A 596 8.531 2.853 2.726 1.00 0.00 H new ATOM 0 HA SER A 596 5.759 3.360 2.266 1.00 0.00 H new ATOM 0 HB2 SER A 596 5.377 3.961 4.675 1.00 0.00 H new ATOM 0 HB3 SER A 596 5.341 2.244 4.323 1.00 0.00 H new ATOM 0 HG SER A 596 7.903 3.015 4.910 1.00 0.00 H new ATOM 542 N CYS A 597 6.625 5.770 2.781 1.00 0.00 N ATOM 543 CA CYS A 597 7.253 7.063 2.845 1.00 0.00 C ATOM 544 C CYS A 597 6.922 7.709 4.177 1.00 0.00 C ATOM 545 O CYS A 597 6.316 7.073 5.058 1.00 0.00 O ATOM 546 CB CYS A 597 6.787 7.962 1.691 1.00 0.00 C ATOM 547 SG CYS A 597 7.348 7.443 0.043 1.00 0.00 S ATOM 0 H CYS A 597 5.618 5.789 2.620 1.00 0.00 H new ATOM 0 HA CYS A 597 8.332 6.936 2.753 1.00 0.00 H new ATOM 0 HB2 CYS A 597 5.698 7.997 1.694 1.00 0.00 H new ATOM 0 HB3 CYS A 597 7.139 8.977 1.876 1.00 0.00 H new ATOM 552 N LYS A 598 7.361 8.930 4.347 1.00 0.00 N ATOM 553 CA LYS A 598 7.052 9.720 5.497 1.00 0.00 C ATOM 554 C LYS A 598 5.548 10.002 5.599 1.00 0.00 C ATOM 555 O LYS A 598 4.836 9.871 4.607 1.00 0.00 O ATOM 556 CB LYS A 598 7.861 11.010 5.474 1.00 0.00 C ATOM 557 CG LYS A 598 9.315 10.815 5.821 1.00 0.00 C ATOM 558 CD LYS A 598 9.474 10.148 7.186 1.00 0.00 C ATOM 559 CE LYS A 598 10.932 9.940 7.572 1.00 0.00 C ATOM 560 NZ LYS A 598 11.667 11.214 7.732 1.00 0.00 N ATOM 0 H LYS A 598 7.956 9.408 3.670 1.00 0.00 H new ATOM 0 HA LYS A 598 7.328 9.155 6.387 1.00 0.00 H new ATOM 0 HB2 LYS A 598 7.789 11.457 4.482 1.00 0.00 H new ATOM 0 HB3 LYS A 598 7.420 11.718 6.175 1.00 0.00 H new ATOM 0 HG2 LYS A 598 9.795 10.204 5.057 1.00 0.00 H new ATOM 0 HG3 LYS A 598 9.823 11.779 5.823 1.00 0.00 H new ATOM 0 HD2 LYS A 598 8.986 10.760 7.944 1.00 0.00 H new ATOM 0 HD3 LYS A 598 8.964 9.185 7.177 1.00 0.00 H new ATOM 0 HE2 LYS A 598 10.980 9.378 8.505 1.00 0.00 H new ATOM 0 HE3 LYS A 598 11.423 9.335 6.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 12.617 11.022 8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 11.749 11.686 6.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 11.152 11.832 8.391 1.00 0.00 H new ATOM 574 N PRO A 599 5.073 10.418 6.797 1.00 0.00 N ATOM 575 CA PRO A 599 3.638 10.639 7.101 1.00 0.00 C ATOM 576 C PRO A 599 2.850 11.422 6.035 1.00 0.00 C ATOM 577 O PRO A 599 1.698 11.086 5.732 1.00 0.00 O ATOM 578 CB PRO A 599 3.675 11.438 8.398 1.00 0.00 C ATOM 579 CG PRO A 599 4.929 11.018 9.070 1.00 0.00 C ATOM 580 CD PRO A 599 5.914 10.702 7.979 1.00 0.00 C ATOM 0 HA PRO A 599 3.119 9.682 7.151 1.00 0.00 H new ATOM 0 HB2 PRO A 599 3.672 12.510 8.202 1.00 0.00 H new ATOM 0 HB3 PRO A 599 2.804 11.225 9.018 1.00 0.00 H new ATOM 0 HG2 PRO A 599 5.307 11.810 9.716 1.00 0.00 H new ATOM 0 HG3 PRO A 599 4.757 10.146 9.702 1.00 0.00 H new ATOM 0 HD2 PRO A 599 6.587 11.540 7.796 1.00 0.00 H new ATOM 0 HD3 PRO A 599 6.535 9.845 8.240 1.00 0.00 H new ATOM 588 N GLY A 600 3.463 12.441 5.471 1.00 0.00 N ATOM 589 CA GLY A 600 2.776 13.268 4.507 1.00 0.00 C ATOM 590 C GLY A 600 3.079 12.873 3.084 1.00 0.00 C ATOM 591 O GLY A 600 2.600 13.510 2.132 1.00 0.00 O ATOM 0 H GLY A 600 4.427 12.714 5.662 1.00 0.00 H new ATOM 0 HA2 GLY A 600 1.701 13.202 4.678 1.00 0.00 H new ATOM 0 HA3 GLY A 600 3.060 14.309 4.659 1.00 0.00 H new ATOM 595 N PHE A 601 3.838 11.820 2.922 1.00 0.00 N ATOM 596 CA PHE A 601 4.273 11.393 1.633 1.00 0.00 C ATOM 597 C PHE A 601 3.606 10.135 1.167 1.00 0.00 C ATOM 598 O PHE A 601 3.167 9.293 1.954 1.00 0.00 O ATOM 599 CB PHE A 601 5.778 11.235 1.582 1.00 0.00 C ATOM 600 CG PHE A 601 6.497 12.515 1.424 1.00 0.00 C ATOM 601 CD1 PHE A 601 6.774 13.322 2.505 1.00 0.00 C ATOM 602 CD2 PHE A 601 6.888 12.911 0.174 1.00 0.00 C ATOM 603 CE1 PHE A 601 7.435 14.514 2.335 1.00 0.00 C ATOM 604 CE2 PHE A 601 7.549 14.096 -0.015 1.00 0.00 C ATOM 605 CZ PHE A 601 7.826 14.906 1.068 1.00 0.00 C ATOM 0 H PHE A 601 4.169 11.237 3.690 1.00 0.00 H new ATOM 0 HA PHE A 601 3.974 12.185 0.946 1.00 0.00 H new ATOM 0 HB2 PHE A 601 6.116 10.747 2.496 1.00 0.00 H new ATOM 0 HB3 PHE A 601 6.039 10.576 0.754 1.00 0.00 H new ATOM 0 HD1 PHE A 601 6.469 13.015 3.495 1.00 0.00 H new ATOM 0 HD2 PHE A 601 6.672 12.280 -0.676 1.00 0.00 H new ATOM 0 HE1 PHE A 601 7.648 15.142 3.187 1.00 0.00 H new ATOM 0 HE2 PHE A 601 7.852 14.395 -1.007 1.00 0.00 H new ATOM 0 HZ PHE A 601 8.346 15.842 0.926 1.00 0.00 H new ATOM 615 N THR A 602 3.516 10.049 -0.100 1.00 0.00 N ATOM 616 CA THR A 602 2.988 8.949 -0.804 1.00 0.00 C ATOM 617 C THR A 602 4.089 8.117 -1.415 1.00 0.00 C ATOM 618 O THR A 602 4.909 8.620 -2.170 1.00 0.00 O ATOM 619 CB THR A 602 2.072 9.481 -1.905 1.00 0.00 C ATOM 620 OG1 THR A 602 0.818 9.856 -1.364 1.00 0.00 O ATOM 621 CG2 THR A 602 1.916 8.542 -3.088 1.00 0.00 C ATOM 0 H THR A 602 3.831 10.797 -0.718 1.00 0.00 H new ATOM 0 HA THR A 602 2.432 8.313 -0.115 1.00 0.00 H new ATOM 0 HB THR A 602 2.562 10.365 -2.313 1.00 0.00 H new ATOM 0 HG1 THR A 602 0.793 10.828 -1.239 1.00 0.00 H new ATOM 0 HG21 THR A 602 1.251 8.993 -3.825 1.00 0.00 H new ATOM 0 HG22 THR A 602 2.891 8.362 -3.541 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.494 7.596 -2.749 1.00 0.00 H new ATOM 629 N ILE A 603 4.100 6.878 -1.082 1.00 0.00 N ATOM 630 CA ILE A 603 5.008 5.952 -1.684 1.00 0.00 C ATOM 631 C ILE A 603 4.479 5.563 -3.073 1.00 0.00 C ATOM 632 O ILE A 603 3.330 5.122 -3.222 1.00 0.00 O ATOM 633 CB ILE A 603 5.221 4.700 -0.791 1.00 0.00 C ATOM 634 CG1 ILE A 603 6.160 3.709 -1.490 1.00 0.00 C ATOM 635 CG2 ILE A 603 3.886 4.065 -0.395 1.00 0.00 C ATOM 636 CD1 ILE A 603 6.363 2.398 -0.754 1.00 0.00 C ATOM 0 H ILE A 603 3.480 6.469 -0.383 1.00 0.00 H new ATOM 0 HA ILE A 603 5.982 6.429 -1.791 1.00 0.00 H new ATOM 0 HB ILE A 603 5.700 5.007 0.139 1.00 0.00 H new ATOM 0 HG12 ILE A 603 5.765 3.495 -2.483 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.130 4.186 -1.629 1.00 0.00 H new ATOM 0 HG21 ILE A 603 4.070 3.191 0.230 1.00 0.00 H new ATOM 0 HG22 ILE A 603 3.289 4.789 0.160 1.00 0.00 H new ATOM 0 HG23 ILE A 603 3.347 3.762 -1.293 1.00 0.00 H new ATOM 0 HD11 ILE A 603 7.041 1.762 -1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 603 6.790 2.595 0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 603 5.404 1.893 -0.638 1.00 0.00 H new ATOM 643 N VAL A 604 5.272 5.789 -4.082 1.00 0.00 N ATOM 644 CA VAL A 604 4.869 5.496 -5.440 1.00 0.00 C ATOM 645 C VAL A 604 5.734 4.415 -6.027 1.00 0.00 C ATOM 646 O VAL A 604 6.963 4.565 -6.098 1.00 0.00 O ATOM 647 CB VAL A 604 4.940 6.742 -6.353 1.00 0.00 C ATOM 648 CG1 VAL A 604 4.466 6.432 -7.769 1.00 0.00 C ATOM 649 CG2 VAL A 604 4.141 7.868 -5.771 1.00 0.00 C ATOM 0 H VAL A 604 6.211 6.179 -3.994 1.00 0.00 H new ATOM 0 HA VAL A 604 3.832 5.162 -5.392 1.00 0.00 H new ATOM 0 HB VAL A 604 5.985 7.045 -6.412 1.00 0.00 H new ATOM 0 HG11 VAL A 604 4.531 7.332 -8.380 1.00 0.00 H new ATOM 0 HG12 VAL A 604 5.095 5.654 -8.201 1.00 0.00 H new ATOM 0 HG13 VAL A 604 3.432 6.087 -7.739 1.00 0.00 H new ATOM 0 HG21 VAL A 604 4.203 8.736 -6.428 1.00 0.00 H new ATOM 0 HG22 VAL A 604 3.100 7.562 -5.672 1.00 0.00 H new ATOM 0 HG23 VAL A 604 4.538 8.127 -4.789 1.00 0.00 H new ATOM 653 N GLY A 605 5.108 3.341 -6.426 1.00 0.00 N ATOM 654 CA GLY A 605 5.816 2.277 -7.062 1.00 0.00 C ATOM 655 C GLY A 605 5.702 0.984 -6.299 1.00 0.00 C ATOM 656 O GLY A 605 4.681 0.746 -5.631 1.00 0.00 O ATOM 0 H GLY A 605 4.106 3.185 -6.319 1.00 0.00 H new ATOM 0 HA2 GLY A 605 5.429 2.137 -8.071 1.00 0.00 H new ATOM 0 HA3 GLY A 605 6.867 2.549 -7.159 1.00 0.00 H new ATOM 660 N PRO A 606 6.709 0.116 -6.402 1.00 0.00 N ATOM 661 CA PRO A 606 6.740 -1.156 -5.687 1.00 0.00 C ATOM 662 C PRO A 606 7.018 -0.948 -4.204 1.00 0.00 C ATOM 663 O PRO A 606 8.084 -0.464 -3.821 1.00 0.00 O ATOM 664 CB PRO A 606 7.908 -1.902 -6.346 1.00 0.00 C ATOM 665 CG PRO A 606 8.807 -0.821 -6.851 1.00 0.00 C ATOM 666 CD PRO A 606 7.911 0.305 -7.249 1.00 0.00 C ATOM 0 HA PRO A 606 5.793 -1.692 -5.743 1.00 0.00 H new ATOM 0 HB2 PRO A 606 8.423 -2.544 -5.631 1.00 0.00 H new ATOM 0 HB3 PRO A 606 7.562 -2.542 -7.158 1.00 0.00 H new ATOM 0 HG2 PRO A 606 9.510 -0.506 -6.080 1.00 0.00 H new ATOM 0 HG3 PRO A 606 9.397 -1.169 -7.699 1.00 0.00 H new ATOM 0 HD2 PRO A 606 8.380 1.272 -7.068 1.00 0.00 H new ATOM 0 HD3 PRO A 606 7.664 0.264 -8.310 1.00 0.00 H new ATOM 674 N ASN A 607 6.068 -1.286 -3.372 1.00 0.00 N ATOM 675 CA ASN A 607 6.255 -1.094 -1.950 1.00 0.00 C ATOM 676 C ASN A 607 7.041 -2.240 -1.380 1.00 0.00 C ATOM 677 O ASN A 607 7.715 -2.089 -0.402 1.00 0.00 O ATOM 678 CB ASN A 607 4.911 -0.943 -1.207 1.00 0.00 C ATOM 679 CG ASN A 607 4.380 -2.216 -0.544 1.00 0.00 C ATOM 680 OD1 ASN A 607 3.714 -3.035 -1.176 1.00 0.00 O ATOM 681 ND2 ASN A 607 4.616 -2.352 0.743 1.00 0.00 N ATOM 0 H ASN A 607 5.171 -1.689 -3.643 1.00 0.00 H new ATOM 0 HA ASN A 607 6.810 -0.166 -1.808 1.00 0.00 H new ATOM 0 HB2 ASN A 607 5.023 -0.175 -0.442 1.00 0.00 H new ATOM 0 HB3 ASN A 607 4.163 -0.583 -1.914 1.00 0.00 H new ATOM 0 HD21 ASN A 607 4.243 -3.156 1.248 1.00 0.00 H new ATOM 0 HD22 ASN A 607 5.172 -1.654 1.236 1.00 0.00 H new ATOM 688 N SER A 608 6.968 -3.368 -2.014 1.00 0.00 N ATOM 689 CA SER A 608 7.608 -4.528 -1.516 1.00 0.00 C ATOM 690 C SER A 608 8.582 -5.110 -2.541 1.00 0.00 C ATOM 691 O SER A 608 8.189 -5.774 -3.508 1.00 0.00 O ATOM 692 CB SER A 608 6.532 -5.517 -1.030 1.00 0.00 C ATOM 693 OG SER A 608 5.602 -5.851 -2.052 1.00 0.00 O ATOM 0 H SER A 608 6.462 -3.503 -2.889 1.00 0.00 H new ATOM 0 HA SER A 608 8.232 -4.281 -0.657 1.00 0.00 H new ATOM 0 HB2 SER A 608 7.014 -6.426 -0.670 1.00 0.00 H new ATOM 0 HB3 SER A 608 5.998 -5.083 -0.185 1.00 0.00 H new ATOM 0 HG SER A 608 6.075 -5.951 -2.904 1.00 0.00 H new ATOM 699 N VAL A 609 9.846 -4.790 -2.367 1.00 0.00 N ATOM 700 CA VAL A 609 10.885 -5.302 -3.233 1.00 0.00 C ATOM 701 C VAL A 609 11.584 -6.445 -2.513 1.00 0.00 C ATOM 702 O VAL A 609 11.749 -6.407 -1.289 1.00 0.00 O ATOM 703 CB VAL A 609 11.921 -4.200 -3.651 1.00 0.00 C ATOM 704 CG1 VAL A 609 11.223 -3.005 -4.289 1.00 0.00 C ATOM 705 CG2 VAL A 609 12.798 -3.753 -2.485 1.00 0.00 C ATOM 0 H VAL A 609 10.180 -4.172 -1.627 1.00 0.00 H new ATOM 0 HA VAL A 609 10.425 -5.652 -4.157 1.00 0.00 H new ATOM 0 HB VAL A 609 12.579 -4.654 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL A 609 11.965 -2.257 -4.569 1.00 0.00 H new ATOM 0 HG12 VAL A 609 10.683 -3.331 -5.178 1.00 0.00 H new ATOM 0 HG13 VAL A 609 10.521 -2.571 -3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 609 13.497 -2.990 -2.827 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.170 -3.342 -1.694 1.00 0.00 H new ATOM 0 HG23 VAL A 609 13.354 -4.608 -2.099 1.00 0.00 H new ATOM 709 N GLN A 610 11.956 -7.464 -3.224 1.00 0.00 N ATOM 710 CA GLN A 610 12.591 -8.590 -2.583 1.00 0.00 C ATOM 711 C GLN A 610 14.064 -8.486 -2.676 1.00 0.00 C ATOM 712 O GLN A 610 14.607 -7.867 -3.595 1.00 0.00 O ATOM 713 CB GLN A 610 12.203 -9.964 -3.170 1.00 0.00 C ATOM 714 CG GLN A 610 10.997 -10.679 -2.584 1.00 0.00 C ATOM 715 CD GLN A 610 9.624 -10.198 -3.057 1.00 0.00 C ATOM 716 OE1 GLN A 610 8.685 -10.991 -3.127 1.00 0.00 O ATOM 717 NE2 GLN A 610 9.483 -8.948 -3.379 1.00 0.00 N ATOM 0 H GLN A 610 11.837 -7.547 -4.234 1.00 0.00 H new ATOM 0 HA GLN A 610 12.238 -8.544 -1.553 1.00 0.00 H new ATOM 0 HB2 GLN A 610 12.026 -9.832 -4.237 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.064 -10.625 -3.069 1.00 0.00 H new ATOM 0 HG2 GLN A 610 11.085 -11.741 -2.814 1.00 0.00 H new ATOM 0 HG3 GLN A 610 11.037 -10.583 -1.499 1.00 0.00 H new ATOM 0 HE21 GLN A 610 10.277 -8.311 -3.312 1.00 0.00 H new ATOM 0 HE22 GLN A 610 8.578 -8.603 -3.699 1.00 0.00 H new ATOM 726 N CYS A 611 14.705 -9.042 -1.716 1.00 0.00 N ATOM 727 CA CYS A 611 16.124 -9.252 -1.846 1.00 0.00 C ATOM 728 C CYS A 611 16.332 -10.405 -2.773 1.00 0.00 C ATOM 729 O CYS A 611 15.742 -11.472 -2.579 1.00 0.00 O ATOM 730 CB CYS A 611 16.825 -9.564 -0.531 1.00 0.00 C ATOM 731 SG CYS A 611 18.584 -10.002 -0.722 1.00 0.00 S ATOM 0 H CYS A 611 14.291 -9.360 -0.840 1.00 0.00 H new ATOM 0 HA CYS A 611 16.555 -8.323 -2.219 1.00 0.00 H new ATOM 0 HB2 CYS A 611 16.745 -8.699 0.127 1.00 0.00 H new ATOM 0 HB3 CYS A 611 16.306 -10.387 -0.040 1.00 0.00 H new ATOM 736 N TYR A 612 17.081 -10.197 -3.785 1.00 0.00 N ATOM 737 CA TYR A 612 17.444 -11.237 -4.673 1.00 0.00 C ATOM 738 C TYR A 612 18.940 -11.390 -4.572 1.00 0.00 C ATOM 739 O TYR A 612 19.603 -10.496 -4.075 1.00 0.00 O ATOM 740 CB TYR A 612 17.024 -10.898 -6.099 1.00 0.00 C ATOM 741 CG TYR A 612 15.516 -10.853 -6.282 1.00 0.00 C ATOM 742 CD1 TYR A 612 14.780 -12.022 -6.407 1.00 0.00 C ATOM 743 CD2 TYR A 612 14.832 -9.653 -6.316 1.00 0.00 C ATOM 744 CE1 TYR A 612 13.402 -11.991 -6.553 1.00 0.00 C ATOM 745 CE2 TYR A 612 13.460 -9.613 -6.467 1.00 0.00 C ATOM 746 CZ TYR A 612 12.750 -10.780 -6.583 1.00 0.00 C ATOM 747 OH TYR A 612 11.371 -10.740 -6.709 1.00 0.00 O ATOM 0 H TYR A 612 17.468 -9.285 -4.027 1.00 0.00 H new ATOM 0 HA TYR A 612 16.943 -12.169 -4.411 1.00 0.00 H new ATOM 0 HB2 TYR A 612 17.446 -9.932 -6.376 1.00 0.00 H new ATOM 0 HB3 TYR A 612 17.445 -11.637 -6.781 1.00 0.00 H new ATOM 0 HD1 TYR A 612 15.290 -12.974 -6.390 1.00 0.00 H new ATOM 0 HD2 TYR A 612 15.381 -8.728 -6.223 1.00 0.00 H new ATOM 0 HE1 TYR A 612 12.844 -12.911 -6.643 1.00 0.00 H new ATOM 0 HE2 TYR A 612 12.947 -8.663 -6.494 1.00 0.00 H new ATOM 0 HH TYR A 612 11.070 -9.807 -6.712 1.00 0.00 H new ATOM 757 N HIS A 613 19.492 -12.473 -5.065 1.00 0.00 N ATOM 758 CA HIS A 613 20.945 -12.694 -4.943 1.00 0.00 C ATOM 759 C HIS A 613 21.792 -11.790 -5.835 1.00 0.00 C ATOM 760 O HIS A 613 23.013 -11.900 -5.876 1.00 0.00 O ATOM 761 CB HIS A 613 21.363 -14.171 -5.047 1.00 0.00 C ATOM 762 CG HIS A 613 20.934 -14.943 -6.264 1.00 0.00 C ATOM 763 ND1 HIS A 613 20.888 -16.311 -6.270 1.00 0.00 N ATOM 764 CD2 HIS A 613 20.550 -14.554 -7.502 1.00 0.00 C ATOM 765 CE1 HIS A 613 20.491 -16.736 -7.449 1.00 0.00 C ATOM 766 NE2 HIS A 613 20.278 -15.689 -8.216 1.00 0.00 N ATOM 0 H HIS A 613 18.983 -13.213 -5.549 1.00 0.00 H new ATOM 0 HA HIS A 613 21.166 -12.390 -3.920 1.00 0.00 H new ATOM 0 HB2 HIS A 613 22.451 -14.215 -4.990 1.00 0.00 H new ATOM 0 HB3 HIS A 613 20.977 -14.690 -4.170 1.00 0.00 H new ATOM 0 HD2 HIS A 613 20.473 -13.538 -7.859 1.00 0.00 H new ATOM 0 HE1 HIS A 613 20.362 -17.768 -7.738 1.00 0.00 H new ATOM 0 HE2 HIS A 613 19.962 -15.718 -9.185 1.00 0.00 H new ATOM 775 N PHE A 614 21.138 -10.911 -6.536 1.00 0.00 N ATOM 776 CA PHE A 614 21.801 -9.905 -7.311 1.00 0.00 C ATOM 777 C PHE A 614 21.571 -8.527 -6.702 1.00 0.00 C ATOM 778 O PHE A 614 22.155 -7.525 -7.135 1.00 0.00 O ATOM 779 CB PHE A 614 21.418 -9.976 -8.791 1.00 0.00 C ATOM 780 CG PHE A 614 19.962 -10.132 -9.072 1.00 0.00 C ATOM 781 CD1 PHE A 614 19.139 -9.038 -9.167 1.00 0.00 C ATOM 782 CD2 PHE A 614 19.427 -11.391 -9.262 1.00 0.00 C ATOM 783 CE1 PHE A 614 17.805 -9.193 -9.452 1.00 0.00 C ATOM 784 CE2 PHE A 614 18.099 -11.557 -9.541 1.00 0.00 C ATOM 785 CZ PHE A 614 17.277 -10.455 -9.638 1.00 0.00 C ATOM 0 H PHE A 614 20.120 -10.872 -6.586 1.00 0.00 H new ATOM 0 HA PHE A 614 22.873 -10.098 -7.278 1.00 0.00 H new ATOM 0 HB2 PHE A 614 21.770 -9.069 -9.283 1.00 0.00 H new ATOM 0 HB3 PHE A 614 21.949 -10.812 -9.246 1.00 0.00 H new ATOM 0 HD1 PHE A 614 19.544 -8.048 -9.016 1.00 0.00 H new ATOM 0 HD2 PHE A 614 20.067 -12.258 -9.189 1.00 0.00 H new ATOM 0 HE1 PHE A 614 17.167 -8.325 -9.531 1.00 0.00 H new ATOM 0 HE2 PHE A 614 17.695 -12.548 -9.685 1.00 0.00 H new ATOM 0 HZ PHE A 614 16.227 -10.578 -9.858 1.00 0.00 H new ATOM 795 N GLY A 615 20.750 -8.495 -5.667 1.00 0.00 N ATOM 796 CA GLY A 615 20.467 -7.280 -4.967 1.00 0.00 C ATOM 797 C GLY A 615 18.996 -7.088 -4.740 1.00 0.00 C ATOM 798 O GLY A 615 18.192 -7.958 -5.091 1.00 0.00 O ATOM 0 H GLY A 615 20.268 -9.315 -5.298 1.00 0.00 H new ATOM 0 HA2 GLY A 615 20.984 -7.287 -4.007 1.00 0.00 H new ATOM 0 HA3 GLY A 615 20.859 -6.436 -5.534 1.00 0.00 H new ATOM 802 N LEU A 616 18.645 -5.978 -4.128 1.00 0.00 N ATOM 803 CA LEU A 616 17.254 -5.631 -3.908 1.00 0.00 C ATOM 804 C LEU A 616 16.612 -5.259 -5.235 1.00 0.00 C ATOM 805 O LEU A 616 17.070 -4.315 -5.905 1.00 0.00 O ATOM 806 CB LEU A 616 17.124 -4.432 -2.953 1.00 0.00 C ATOM 807 CG LEU A 616 17.483 -4.649 -1.480 1.00 0.00 C ATOM 808 CD1 LEU A 616 17.195 -3.396 -0.714 1.00 0.00 C ATOM 809 CD2 LEU A 616 16.692 -5.805 -0.922 1.00 0.00 C ATOM 0 H LEU A 616 19.310 -5.293 -3.770 1.00 0.00 H new ATOM 0 HA LEU A 616 16.757 -6.494 -3.464 1.00 0.00 H new ATOM 0 HB2 LEU A 616 17.754 -3.629 -3.336 1.00 0.00 H new ATOM 0 HB3 LEU A 616 16.094 -4.078 -2.998 1.00 0.00 H new ATOM 0 HG LEU A 616 18.543 -4.886 -1.391 1.00 0.00 H new ATOM 0 HD11 LEU A 616 17.449 -3.545 0.336 1.00 0.00 H new ATOM 0 HD12 LEU A 616 17.790 -2.577 -1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 616 16.136 -3.152 -0.800 1.00 0.00 H new ATOM 0 HD21 LEU A 616 16.953 -5.953 0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 616 15.627 -5.590 -1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 616 16.924 -6.709 -1.484 1.00 0.00 H new ATOM 821 N SER A 617 15.595 -5.973 -5.622 1.00 0.00 N ATOM 822 CA SER A 617 14.924 -5.710 -6.868 1.00 0.00 C ATOM 823 C SER A 617 13.402 -5.821 -6.698 1.00 0.00 C ATOM 824 O SER A 617 12.916 -6.608 -5.867 1.00 0.00 O ATOM 825 CB SER A 617 15.437 -6.654 -7.959 1.00 0.00 C ATOM 826 OG SER A 617 16.838 -6.489 -8.154 1.00 0.00 O ATOM 0 H SER A 617 15.207 -6.751 -5.088 1.00 0.00 H new ATOM 0 HA SER A 617 15.147 -4.689 -7.177 1.00 0.00 H new ATOM 0 HB2 SER A 617 15.223 -7.686 -7.683 1.00 0.00 H new ATOM 0 HB3 SER A 617 14.910 -6.458 -8.893 1.00 0.00 H new ATOM 0 HG SER A 617 17.024 -6.375 -9.109 1.00 0.00 H new ATOM 832 N PRO A 618 12.619 -5.000 -7.433 1.00 0.00 N ATOM 833 CA PRO A 618 13.143 -3.978 -8.362 1.00 0.00 C ATOM 834 C PRO A 618 13.708 -2.751 -7.619 1.00 0.00 C ATOM 835 O PRO A 618 13.900 -2.793 -6.402 1.00 0.00 O ATOM 836 CB PRO A 618 11.906 -3.598 -9.180 1.00 0.00 C ATOM 837 CG PRO A 618 10.762 -3.845 -8.269 1.00 0.00 C ATOM 838 CD PRO A 618 11.151 -5.018 -7.415 1.00 0.00 C ATOM 0 HA PRO A 618 13.974 -4.346 -8.964 1.00 0.00 H new ATOM 0 HB2 PRO A 618 11.944 -2.555 -9.494 1.00 0.00 H new ATOM 0 HB3 PRO A 618 11.829 -4.201 -10.085 1.00 0.00 H new ATOM 0 HG2 PRO A 618 10.557 -2.968 -7.655 1.00 0.00 H new ATOM 0 HG3 PRO A 618 9.854 -4.059 -8.833 1.00 0.00 H new ATOM 0 HD2 PRO A 618 10.763 -4.919 -6.401 1.00 0.00 H new ATOM 0 HD3 PRO A 618 10.758 -5.952 -7.817 1.00 0.00 H new ATOM 846 N ASP A 619 14.002 -1.680 -8.349 1.00 0.00 N ATOM 847 CA ASP A 619 14.544 -0.475 -7.722 1.00 0.00 C ATOM 848 C ASP A 619 13.524 0.177 -6.802 1.00 0.00 C ATOM 849 O ASP A 619 12.329 -0.164 -6.825 1.00 0.00 O ATOM 850 CB ASP A 619 15.132 0.535 -8.733 1.00 0.00 C ATOM 851 CG ASP A 619 14.127 1.254 -9.595 1.00 0.00 C ATOM 852 OD1 ASP A 619 13.508 0.624 -10.482 1.00 0.00 O ATOM 853 OD2 ASP A 619 13.963 2.481 -9.437 1.00 0.00 O ATOM 0 H ASP A 619 13.878 -1.619 -9.360 1.00 0.00 H new ATOM 0 HA ASP A 619 15.386 -0.804 -7.113 1.00 0.00 H new ATOM 0 HB2 ASP A 619 15.709 1.278 -8.183 1.00 0.00 H new ATOM 0 HB3 ASP A 619 15.829 0.007 -9.383 1.00 0.00 H new ATOM 858 N LEU A 620 13.978 1.126 -6.046 1.00 0.00 N ATOM 859 CA LEU A 620 13.213 1.683 -4.955 1.00 0.00 C ATOM 860 C LEU A 620 12.083 2.594 -5.442 1.00 0.00 C ATOM 861 O LEU A 620 12.209 3.275 -6.471 1.00 0.00 O ATOM 862 CB LEU A 620 14.126 2.452 -3.958 1.00 0.00 C ATOM 863 CG LEU A 620 15.365 1.720 -3.371 1.00 0.00 C ATOM 864 CD1 LEU A 620 15.026 0.333 -2.861 1.00 0.00 C ATOM 865 CD2 LEU A 620 16.543 1.697 -4.344 1.00 0.00 C ATOM 0 H LEU A 620 14.900 1.547 -6.163 1.00 0.00 H new ATOM 0 HA LEU A 620 12.759 0.839 -4.436 1.00 0.00 H new ATOM 0 HB2 LEU A 620 14.480 3.353 -4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 620 13.506 2.776 -3.122 1.00 0.00 H new ATOM 0 HG LEU A 620 15.683 2.304 -2.508 1.00 0.00 H new ATOM 0 HD11 LEU A 620 15.924 -0.137 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU A 620 14.275 0.408 -2.075 1.00 0.00 H new ATOM 0 HD13 LEU A 620 14.635 -0.270 -3.680 1.00 0.00 H new ATOM 0 HD21 LEU A 620 17.383 1.174 -3.886 1.00 0.00 H new ATOM 0 HD22 LEU A 620 16.250 1.181 -5.258 1.00 0.00 H new ATOM 0 HD23 LEU A 620 16.838 2.719 -4.583 1.00 0.00 H new ATOM 877 N PRO A 621 10.953 2.595 -4.718 1.00 0.00 N ATOM 878 CA PRO A 621 9.824 3.474 -5.000 1.00 0.00 C ATOM 879 C PRO A 621 10.165 4.930 -4.636 1.00 0.00 C ATOM 880 O PRO A 621 11.208 5.201 -4.008 1.00 0.00 O ATOM 881 CB PRO A 621 8.730 2.944 -4.065 1.00 0.00 C ATOM 882 CG PRO A 621 9.468 2.320 -2.949 1.00 0.00 C ATOM 883 CD PRO A 621 10.683 1.716 -3.567 1.00 0.00 C ATOM 0 HA PRO A 621 9.538 3.476 -6.052 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.084 3.749 -3.713 1.00 0.00 H new ATOM 0 HB3 PRO A 621 8.091 2.221 -4.572 1.00 0.00 H new ATOM 0 HG2 PRO A 621 9.737 3.059 -2.194 1.00 0.00 H new ATOM 0 HG3 PRO A 621 8.862 1.562 -2.452 1.00 0.00 H new ATOM 0 HD2 PRO A 621 11.521 1.697 -2.870 1.00 0.00 H new ATOM 0 HD3 PRO A 621 10.506 0.687 -3.880 1.00 0.00 H new ATOM 891 N ILE A 622 9.314 5.850 -5.013 1.00 0.00 N ATOM 892 CA ILE A 622 9.551 7.259 -4.727 1.00 0.00 C ATOM 893 C ILE A 622 8.514 7.777 -3.744 1.00 0.00 C ATOM 894 O ILE A 622 7.626 7.029 -3.328 1.00 0.00 O ATOM 895 CB ILE A 622 9.515 8.142 -5.998 1.00 0.00 C ATOM 896 CG1 ILE A 622 8.122 8.118 -6.645 1.00 0.00 C ATOM 897 CG2 ILE A 622 10.589 7.696 -6.988 1.00 0.00 C ATOM 898 CD1 ILE A 622 7.957 9.109 -7.764 1.00 0.00 C ATOM 0 H ILE A 622 8.449 5.658 -5.519 1.00 0.00 H new ATOM 0 HA ILE A 622 10.552 7.323 -4.300 1.00 0.00 H new ATOM 0 HB ILE A 622 9.726 9.171 -5.707 1.00 0.00 H new ATOM 0 HG12 ILE A 622 7.926 7.116 -7.027 1.00 0.00 H new ATOM 0 HG13 ILE A 622 7.372 8.320 -5.880 1.00 0.00 H new ATOM 0 HG21 ILE A 622 10.550 8.327 -7.876 1.00 0.00 H new ATOM 0 HG22 ILE A 622 11.571 7.784 -6.523 1.00 0.00 H new ATOM 0 HG23 ILE A 622 10.413 6.658 -7.272 1.00 0.00 H new ATOM 0 HD11 ILE A 622 6.949 9.033 -8.171 1.00 0.00 H new ATOM 0 HD12 ILE A 622 8.120 10.117 -7.384 1.00 0.00 H new ATOM 0 HD13 ILE A 622 8.682 8.895 -8.549 1.00 0.00 H new ATOM 905 N CYS A 623 8.599 9.046 -3.423 1.00 0.00 N ATOM 906 CA CYS A 623 7.713 9.666 -2.467 1.00 0.00 C ATOM 907 C CYS A 623 7.084 10.943 -3.018 1.00 0.00 C ATOM 908 O CYS A 623 7.758 11.955 -3.192 1.00 0.00 O ATOM 909 CB CYS A 623 8.465 9.985 -1.187 1.00 0.00 C ATOM 910 SG CYS A 623 9.040 8.524 -0.272 1.00 0.00 S ATOM 0 H CYS A 623 9.290 9.682 -3.821 1.00 0.00 H new ATOM 0 HA CYS A 623 6.912 8.957 -2.260 1.00 0.00 H new ATOM 0 HB2 CYS A 623 9.325 10.608 -1.431 1.00 0.00 H new ATOM 0 HB3 CYS A 623 7.818 10.575 -0.537 1.00 0.00 H new ATOM 915 N LYS A 624 5.810 10.888 -3.301 1.00 0.00 N ATOM 916 CA LYS A 624 5.073 12.049 -3.750 1.00 0.00 C ATOM 917 C LYS A 624 4.346 12.666 -2.595 1.00 0.00 C ATOM 918 O LYS A 624 3.648 11.995 -1.884 1.00 0.00 O ATOM 919 CB LYS A 624 4.078 11.712 -4.874 1.00 0.00 C ATOM 920 CG LYS A 624 4.746 11.347 -6.186 1.00 0.00 C ATOM 921 CD LYS A 624 4.024 11.941 -7.389 1.00 0.00 C ATOM 922 CE LYS A 624 2.531 11.583 -7.486 1.00 0.00 C ATOM 923 NZ LYS A 624 2.280 10.156 -7.800 1.00 0.00 N ATOM 0 H LYS A 624 5.250 10.039 -3.228 1.00 0.00 H new ATOM 0 HA LYS A 624 5.795 12.756 -4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 624 3.448 10.882 -4.553 1.00 0.00 H new ATOM 0 HB3 LYS A 624 3.422 12.567 -5.035 1.00 0.00 H new ATOM 0 HG2 LYS A 624 5.778 11.698 -6.175 1.00 0.00 H new ATOM 0 HG3 LYS A 624 4.779 10.262 -6.285 1.00 0.00 H new ATOM 0 HD2 LYS A 624 4.122 13.026 -7.354 1.00 0.00 H new ATOM 0 HD3 LYS A 624 4.524 11.605 -8.297 1.00 0.00 H new ATOM 0 HE2 LYS A 624 2.045 11.829 -6.542 1.00 0.00 H new ATOM 0 HE3 LYS A 624 2.067 12.202 -8.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 1.478 10.081 -8.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 3.128 9.743 -8.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 2.058 9.642 -6.924 1.00 0.00 H new ATOM 937 N GLU A 625 4.534 13.922 -2.390 1.00 0.00 N ATOM 938 CA GLU A 625 3.835 14.620 -1.344 1.00 0.00 C ATOM 939 C GLU A 625 2.479 15.006 -1.885 1.00 0.00 C ATOM 940 O GLU A 625 1.466 14.961 -1.186 1.00 0.00 O ATOM 941 CB GLU A 625 4.666 15.826 -0.884 1.00 0.00 C ATOM 942 CG GLU A 625 4.093 16.629 0.274 1.00 0.00 C ATOM 943 CD GLU A 625 3.209 17.776 -0.160 1.00 0.00 C ATOM 944 OE1 GLU A 625 3.752 18.833 -0.536 1.00 0.00 O ATOM 945 OE2 GLU A 625 1.970 17.652 -0.115 1.00 0.00 O ATOM 0 H GLU A 625 5.172 14.502 -2.935 1.00 0.00 H new ATOM 0 HA GLU A 625 3.690 13.996 -0.462 1.00 0.00 H new ATOM 0 HB2 GLU A 625 5.657 15.472 -0.599 1.00 0.00 H new ATOM 0 HB3 GLU A 625 4.799 16.496 -1.734 1.00 0.00 H new ATOM 0 HG2 GLU A 625 3.519 15.963 0.917 1.00 0.00 H new ATOM 0 HG3 GLU A 625 4.914 17.022 0.874 1.00 0.00 H new ATOM 952 N GLN A 626 2.468 15.308 -3.153 1.00 0.00 N ATOM 953 CA GLN A 626 1.263 15.649 -3.837 1.00 0.00 C ATOM 954 C GLN A 626 0.833 14.483 -4.686 1.00 0.00 C ATOM 955 O GLN A 626 1.471 14.143 -5.682 1.00 0.00 O ATOM 956 CB GLN A 626 1.431 16.903 -4.676 1.00 0.00 C ATOM 957 CG GLN A 626 1.829 18.124 -3.870 1.00 0.00 C ATOM 958 CD GLN A 626 1.873 19.389 -4.693 1.00 0.00 C ATOM 959 OE1 GLN A 626 1.650 20.483 -4.176 1.00 0.00 O ATOM 960 NE2 GLN A 626 2.123 19.260 -5.961 1.00 0.00 N ATOM 0 H GLN A 626 3.302 15.323 -3.740 1.00 0.00 H new ATOM 0 HA GLN A 626 0.489 15.866 -3.100 1.00 0.00 H new ATOM 0 HB2 GLN A 626 2.187 16.720 -5.440 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.496 17.110 -5.196 1.00 0.00 H new ATOM 0 HG2 GLN A 626 1.124 18.256 -3.050 1.00 0.00 H new ATOM 0 HG3 GLN A 626 2.809 17.954 -3.424 1.00 0.00 H new ATOM 0 HE21 GLN A 626 2.303 18.336 -6.354 1.00 0.00 H new ATOM 0 HE22 GLN A 626 2.139 20.083 -6.564 1.00 0.00 H new ATOM 969 N VAL A 627 -0.200 13.844 -4.251 1.00 0.00 N ATOM 970 CA VAL A 627 -0.754 12.701 -4.912 1.00 0.00 C ATOM 971 C VAL A 627 -2.249 13.018 -5.159 1.00 0.00 C ATOM 972 O VAL A 627 -2.724 14.058 -4.699 1.00 0.00 O ATOM 973 CB VAL A 627 -0.580 11.442 -4.002 1.00 0.00 C ATOM 974 CG1 VAL A 627 -1.423 11.534 -2.762 1.00 0.00 C ATOM 975 CG2 VAL A 627 -0.850 10.178 -4.743 1.00 0.00 C ATOM 0 H VAL A 627 -0.700 14.107 -3.402 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.254 12.490 -5.857 1.00 0.00 H new ATOM 0 HB VAL A 627 0.464 11.420 -3.691 1.00 0.00 H new ATOM 0 HG11 VAL A 627 -1.275 10.641 -2.155 1.00 0.00 H new ATOM 0 HG12 VAL A 627 -1.133 12.415 -2.189 1.00 0.00 H new ATOM 0 HG13 VAL A 627 -2.474 11.613 -3.041 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -0.718 9.328 -4.073 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -1.873 10.188 -5.119 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -0.157 10.092 -5.580 1.00 0.00 H new ATOM 979 N GLN A 628 -2.973 12.165 -5.858 1.00 0.00 N ATOM 980 CA GLN A 628 -4.362 12.405 -6.112 1.00 0.00 C ATOM 981 C GLN A 628 -5.170 11.844 -4.999 1.00 0.00 C ATOM 982 O GLN A 628 -4.870 10.752 -4.481 1.00 0.00 O ATOM 983 CB GLN A 628 -4.826 11.735 -7.389 1.00 0.00 C ATOM 984 CG GLN A 628 -4.165 12.209 -8.664 1.00 0.00 C ATOM 985 CD GLN A 628 -4.440 13.666 -9.015 1.00 0.00 C ATOM 986 OE1 GLN A 628 -4.617 14.529 -8.148 1.00 0.00 O ATOM 987 NE2 GLN A 628 -4.498 13.943 -10.282 1.00 0.00 N ATOM 0 H GLN A 628 -2.611 11.299 -6.257 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.493 13.483 -6.203 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -4.660 10.662 -7.294 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -5.902 11.884 -7.484 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -3.088 12.067 -8.574 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -4.502 11.580 -9.488 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -4.347 13.207 -10.972 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -4.694 14.896 -10.587 1.00 0.00 H new ATOM 996 N SER A 629 -6.155 12.554 -4.619 1.00 0.00 N ATOM 997 CA SER A 629 -7.068 12.062 -3.663 1.00 0.00 C ATOM 998 C SER A 629 -8.224 11.430 -4.423 1.00 0.00 C ATOM 999 O SER A 629 -9.031 12.128 -5.028 1.00 0.00 O ATOM 1000 CB SER A 629 -7.550 13.173 -2.744 1.00 0.00 C ATOM 1001 OG SER A 629 -6.458 13.879 -2.164 1.00 0.00 O ATOM 0 H SER A 629 -6.355 13.494 -4.960 1.00 0.00 H new ATOM 0 HA SER A 629 -6.588 11.321 -3.024 1.00 0.00 H new ATOM 0 HB2 SER A 629 -8.176 13.866 -3.306 1.00 0.00 H new ATOM 0 HB3 SER A 629 -8.172 12.750 -1.955 1.00 0.00 H new ATOM 0 HG SER A 629 -6.800 14.588 -1.580 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.238 10.108 -4.444 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.254 9.266 -5.149 1.00 0.00 C ATOM 1009 C CYS A 630 -10.725 9.441 -4.671 1.00 0.00 C ATOM 1010 O CYS A 630 -11.570 8.563 -4.926 1.00 0.00 O ATOM 1011 CB CYS A 630 -8.853 7.812 -5.004 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.152 7.456 -5.542 1.00 0.00 S ATOM 0 H CYS A 630 -7.531 9.551 -3.963 1.00 0.00 H new ATOM 0 HA CYS A 630 -9.253 9.603 -6.186 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -8.962 7.518 -3.960 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -9.542 7.196 -5.582 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.022 10.570 -4.047 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.352 10.878 -3.563 1.00 0.00 C ATOM 1019 C GLY A 631 -12.904 9.815 -2.647 1.00 0.00 C ATOM 1020 O GLY A 631 -12.171 9.303 -1.786 1.00 0.00 O ATOM 0 H GLY A 631 -10.338 11.303 -3.862 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -12.329 11.830 -3.034 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -13.023 11.002 -4.413 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.188 9.486 -2.787 1.00 0.00 N ATOM 1025 CA PRO A 632 -14.811 8.417 -2.042 1.00 0.00 C ATOM 1026 C PRO A 632 -14.482 7.049 -2.670 1.00 0.00 C ATOM 1027 O PRO A 632 -14.159 6.951 -3.873 1.00 0.00 O ATOM 1028 CB PRO A 632 -16.309 8.727 -2.164 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.446 9.427 -3.466 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.151 10.158 -3.694 1.00 0.00 C ATOM 0 HA PRO A 632 -14.470 8.361 -1.008 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -16.905 7.815 -2.141 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -16.652 9.353 -1.340 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.638 8.717 -4.270 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.286 10.122 -3.447 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -14.833 10.089 -4.734 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.246 11.218 -3.459 1.00 0.00 H new ATOM 1038 N PRO A 633 -14.521 5.990 -1.872 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.248 4.641 -2.343 1.00 0.00 C ATOM 1040 C PRO A 633 -15.395 4.055 -3.172 1.00 0.00 C ATOM 1041 O PRO A 633 -16.560 4.512 -3.076 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.088 3.847 -1.052 1.00 0.00 C ATOM 1043 CG PRO A 633 -14.900 4.581 -0.058 1.00 0.00 C ATOM 1044 CD PRO A 633 -14.804 6.021 -0.429 1.00 0.00 C ATOM 0 HA PRO A 633 -13.379 4.616 -3.001 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.439 2.822 -1.171 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.043 3.793 -0.747 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -15.936 4.242 -0.074 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -14.526 4.413 0.952 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -15.731 6.553 -0.214 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -14.011 6.525 0.124 1.00 0.00 H new ATOM 1052 N PRO A 634 -15.081 3.058 -4.011 1.00 0.00 N ATOM 1053 CA PRO A 634 -16.071 2.328 -4.803 1.00 0.00 C ATOM 1054 C PRO A 634 -16.949 1.425 -3.906 1.00 0.00 C ATOM 1055 O PRO A 634 -16.934 1.542 -2.664 1.00 0.00 O ATOM 1056 CB PRO A 634 -15.203 1.466 -5.738 1.00 0.00 C ATOM 1057 CG PRO A 634 -13.915 1.306 -5.026 1.00 0.00 C ATOM 1058 CD PRO A 634 -13.709 2.574 -4.265 1.00 0.00 C ATOM 0 HA PRO A 634 -16.760 2.988 -5.330 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -15.670 0.500 -5.931 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -15.062 1.951 -6.704 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -13.944 0.448 -4.355 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -13.099 1.135 -5.728 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.168 2.399 -3.335 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -13.130 3.296 -4.840 1.00 0.00 H new ATOM 1066 N GLU A 635 -17.729 0.563 -4.498 1.00 0.00 N ATOM 1067 CA GLU A 635 -18.539 -0.329 -3.713 1.00 0.00 C ATOM 1068 C GLU A 635 -18.027 -1.746 -3.818 1.00 0.00 C ATOM 1069 O GLU A 635 -17.395 -2.112 -4.811 1.00 0.00 O ATOM 1070 CB GLU A 635 -20.001 -0.268 -4.133 1.00 0.00 C ATOM 1071 CG GLU A 635 -20.303 -0.878 -5.484 1.00 0.00 C ATOM 1072 CD GLU A 635 -21.743 -0.737 -5.848 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -22.607 -1.334 -5.173 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -22.037 -0.020 -6.811 1.00 0.00 O ATOM 0 H GLU A 635 -17.821 0.459 -5.508 1.00 0.00 H new ATOM 0 HA GLU A 635 -18.471 -0.005 -2.674 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -20.602 -0.776 -3.379 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -20.318 0.775 -4.143 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -19.687 -0.398 -6.245 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -20.033 -1.934 -5.474 1.00 0.00 H new ATOM 1081 N LEU A 636 -18.281 -2.527 -2.799 1.00 0.00 N ATOM 1082 CA LEU A 636 -17.928 -3.919 -2.810 1.00 0.00 C ATOM 1083 C LEU A 636 -19.023 -4.640 -3.602 1.00 0.00 C ATOM 1084 O LEU A 636 -20.187 -4.271 -3.473 1.00 0.00 O ATOM 1085 CB LEU A 636 -17.886 -4.441 -1.360 1.00 0.00 C ATOM 1086 CG LEU A 636 -17.400 -5.871 -1.150 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.104 -6.106 -1.891 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -17.174 -6.111 0.317 1.00 0.00 C ATOM 0 H LEU A 636 -18.737 -2.215 -1.942 1.00 0.00 H new ATOM 0 HA LEU A 636 -16.950 -4.087 -3.262 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -17.245 -3.777 -0.780 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -18.889 -4.360 -0.942 1.00 0.00 H new ATOM 0 HG LEU A 636 -18.157 -6.555 -1.532 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -15.773 -7.132 -1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.259 -5.939 -2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -15.344 -5.417 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -16.827 -7.133 0.469 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -16.423 -5.413 0.688 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -18.108 -5.961 0.858 1.00 0.00 H new ATOM 1100 N LEU A 637 -18.652 -5.620 -4.440 1.00 0.00 N ATOM 1101 CA LEU A 637 -19.630 -6.364 -5.280 1.00 0.00 C ATOM 1102 C LEU A 637 -20.885 -6.835 -4.554 1.00 0.00 C ATOM 1103 O LEU A 637 -21.998 -6.646 -5.041 1.00 0.00 O ATOM 1104 CB LEU A 637 -18.989 -7.512 -6.115 1.00 0.00 C ATOM 1105 CG LEU A 637 -17.702 -8.200 -5.588 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -17.908 -8.907 -4.269 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -17.153 -9.163 -6.625 1.00 0.00 C ATOM 0 H LEU A 637 -17.685 -5.923 -4.561 1.00 0.00 H new ATOM 0 HA LEU A 637 -19.972 -5.604 -5.982 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -19.746 -8.286 -6.245 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -18.767 -7.114 -7.105 1.00 0.00 H new ATOM 0 HG LEU A 637 -16.976 -7.408 -5.408 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -16.972 -9.368 -3.953 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -18.230 -8.187 -3.517 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -18.671 -9.677 -4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -16.250 -9.637 -6.239 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -17.899 -9.927 -6.843 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -16.915 -8.617 -7.538 1.00 0.00 H new ATOM 1119 N ASN A 638 -20.724 -7.439 -3.414 1.00 0.00 N ATOM 1120 CA ASN A 638 -21.881 -7.895 -2.674 1.00 0.00 C ATOM 1121 C ASN A 638 -21.981 -7.177 -1.358 1.00 0.00 C ATOM 1122 O ASN A 638 -23.081 -6.958 -0.836 1.00 0.00 O ATOM 1123 CB ASN A 638 -21.852 -9.408 -2.452 1.00 0.00 C ATOM 1124 CG ASN A 638 -21.717 -10.189 -3.743 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -20.620 -10.533 -4.149 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -22.805 -10.441 -4.412 1.00 0.00 N ATOM 0 H ASN A 638 -19.823 -7.629 -2.975 1.00 0.00 H new ATOM 0 HA ASN A 638 -22.763 -7.665 -3.272 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -21.020 -9.658 -1.793 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -22.766 -9.713 -1.942 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -22.753 -10.939 -5.301 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -23.709 -10.141 -4.047 1.00 0.00 H new ATOM 1133 N GLY A 639 -20.837 -6.807 -0.827 1.00 0.00 N ATOM 1134 CA GLY A 639 -20.779 -6.130 0.435 1.00 0.00 C ATOM 1135 C GLY A 639 -20.822 -4.637 0.281 1.00 0.00 C ATOM 1136 O GLY A 639 -21.350 -4.118 -0.704 1.00 0.00 O ATOM 0 H GLY A 639 -19.928 -6.969 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -21.613 -6.453 1.057 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -19.864 -6.414 0.956 1.00 0.00 H new ATOM 1140 N ASN A 640 -20.237 -3.956 1.219 1.00 0.00 N ATOM 1141 CA ASN A 640 -20.152 -2.512 1.201 1.00 0.00 C ATOM 1142 C ASN A 640 -18.999 -2.045 2.025 1.00 0.00 C ATOM 1143 O ASN A 640 -18.210 -2.837 2.504 1.00 0.00 O ATOM 1144 CB ASN A 640 -21.440 -1.843 1.702 1.00 0.00 C ATOM 1145 CG ASN A 640 -22.342 -1.320 0.594 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -23.559 -1.310 0.738 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -21.761 -0.811 -0.475 1.00 0.00 N ATOM 0 H ASN A 640 -19.797 -4.385 2.033 1.00 0.00 H new ATOM 0 HA ASN A 640 -20.006 -2.221 0.161 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -21.999 -2.561 2.302 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -21.174 -1.016 2.360 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -22.328 -0.393 -1.213 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -20.745 -0.835 -0.564 1.00 0.00 H new ATOM 1154 N VAL A 641 -18.905 -0.770 2.155 1.00 0.00 N ATOM 1155 CA VAL A 641 -17.905 -0.121 2.943 1.00 0.00 C ATOM 1156 C VAL A 641 -18.470 0.109 4.360 1.00 0.00 C ATOM 1157 O VAL A 641 -19.637 0.502 4.519 1.00 0.00 O ATOM 1158 CB VAL A 641 -17.505 1.229 2.267 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -18.720 2.095 2.036 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -16.451 1.964 3.068 1.00 0.00 C ATOM 0 H VAL A 641 -19.545 -0.120 1.699 1.00 0.00 H new ATOM 0 HA VAL A 641 -17.010 -0.739 3.016 1.00 0.00 H new ATOM 0 HB VAL A 641 -17.067 0.995 1.296 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -18.416 3.030 1.564 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -19.422 1.572 1.386 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -19.201 2.310 2.990 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -16.198 2.898 2.566 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -16.836 2.180 4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -15.559 1.344 3.151 1.00 0.00 H new ATOM 1164 N LYS A 642 -17.688 -0.189 5.369 1.00 0.00 N ATOM 1165 CA LYS A 642 -18.132 -0.017 6.754 1.00 0.00 C ATOM 1166 C LYS A 642 -17.703 1.336 7.288 1.00 0.00 C ATOM 1167 O LYS A 642 -18.322 1.884 8.204 1.00 0.00 O ATOM 1168 CB LYS A 642 -17.588 -1.134 7.664 1.00 0.00 C ATOM 1169 CG LYS A 642 -16.099 -1.340 7.523 1.00 0.00 C ATOM 1170 CD LYS A 642 -15.499 -2.241 8.578 1.00 0.00 C ATOM 1171 CE LYS A 642 -15.506 -1.578 9.942 1.00 0.00 C ATOM 1172 NZ LYS A 642 -14.633 -2.295 10.881 1.00 0.00 N ATOM 0 H LYS A 642 -16.740 -0.552 5.270 1.00 0.00 H new ATOM 0 HA LYS A 642 -19.220 -0.074 6.757 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -17.819 -0.894 8.702 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -18.102 -2.067 7.431 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -15.893 -1.762 6.540 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -15.603 -0.370 7.564 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -16.060 -3.175 8.623 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -14.476 -2.497 8.301 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -15.174 -0.544 9.849 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -16.523 -1.553 10.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -14.602 -1.784 11.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -15.005 -3.254 11.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -13.673 -2.356 10.485 1.00 0.00 H new ATOM 1186 N GLU A 643 -16.661 1.870 6.707 1.00 0.00 N ATOM 1187 CA GLU A 643 -16.107 3.130 7.131 1.00 0.00 C ATOM 1188 C GLU A 643 -16.931 4.272 6.595 1.00 0.00 C ATOM 1189 O GLU A 643 -17.594 4.127 5.564 1.00 0.00 O ATOM 1190 CB GLU A 643 -14.675 3.254 6.636 1.00 0.00 C ATOM 1191 CG GLU A 643 -13.767 2.180 7.172 1.00 0.00 C ATOM 1192 CD GLU A 643 -13.629 2.229 8.667 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -12.750 2.949 9.162 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -14.395 1.556 9.381 1.00 0.00 O ATOM 0 H GLU A 643 -16.170 1.441 5.922 1.00 0.00 H new ATOM 0 HA GLU A 643 -16.119 3.170 8.220 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -14.669 3.215 5.547 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -14.282 4.229 6.922 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -14.153 1.204 6.879 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -12.782 2.283 6.717 1.00 0.00 H new ATOM 1201 N LYS A 644 -16.936 5.377 7.313 1.00 0.00 N ATOM 1202 CA LYS A 644 -17.597 6.584 6.867 1.00 0.00 C ATOM 1203 C LYS A 644 -16.926 7.092 5.613 1.00 0.00 C ATOM 1204 O LYS A 644 -15.779 7.561 5.655 1.00 0.00 O ATOM 1205 CB LYS A 644 -17.576 7.663 7.973 1.00 0.00 C ATOM 1206 CG LYS A 644 -17.983 9.080 7.520 1.00 0.00 C ATOM 1207 CD LYS A 644 -19.404 9.160 6.958 1.00 0.00 C ATOM 1208 CE LYS A 644 -20.457 8.753 7.973 1.00 0.00 C ATOM 1209 NZ LYS A 644 -21.827 8.939 7.451 1.00 0.00 N ATOM 0 H LYS A 644 -16.481 5.462 8.222 1.00 0.00 H new ATOM 0 HA LYS A 644 -18.640 6.356 6.646 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -18.244 7.350 8.775 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -16.572 7.709 8.394 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -17.897 9.761 8.366 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -17.281 9.425 6.761 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -19.602 10.178 6.623 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -19.481 8.516 6.082 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -20.312 7.708 8.247 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -20.332 9.342 8.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -22.516 8.650 8.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -21.975 9.941 7.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -21.955 8.358 6.598 1.00 0.00 H new ATOM 1223 N THR A 645 -17.630 6.965 4.514 1.00 0.00 N ATOM 1224 CA THR A 645 -17.147 7.379 3.246 1.00 0.00 C ATOM 1225 C THR A 645 -17.104 8.879 3.137 1.00 0.00 C ATOM 1226 O THR A 645 -18.140 9.534 2.933 1.00 0.00 O ATOM 1227 CB THR A 645 -18.023 6.815 2.128 1.00 0.00 C ATOM 1228 OG1 THR A 645 -19.410 7.027 2.465 1.00 0.00 O ATOM 1229 CG2 THR A 645 -17.754 5.341 1.916 1.00 0.00 C ATOM 0 H THR A 645 -18.567 6.563 4.490 1.00 0.00 H new ATOM 0 HA THR A 645 -16.133 6.994 3.143 1.00 0.00 H new ATOM 0 HB THR A 645 -17.786 7.331 1.198 1.00 0.00 H new ATOM 0 HG1 THR A 645 -19.537 7.953 2.758 1.00 0.00 H new ATOM 0 HG21 THR A 645 -18.391 4.966 1.115 1.00 0.00 H new ATOM 0 HG22 THR A 645 -16.708 5.197 1.645 1.00 0.00 H new ATOM 0 HG23 THR A 645 -17.969 4.796 2.835 1.00 0.00 H new ATOM 1237 N LYS A 646 -15.953 9.422 3.344 1.00 0.00 N ATOM 1238 CA LYS A 646 -15.758 10.806 3.116 1.00 0.00 C ATOM 1239 C LYS A 646 -15.530 11.012 1.635 1.00 0.00 C ATOM 1240 O LYS A 646 -15.147 10.077 0.925 1.00 0.00 O ATOM 1241 CB LYS A 646 -14.648 11.396 4.004 1.00 0.00 C ATOM 1242 CG LYS A 646 -13.333 10.661 4.025 1.00 0.00 C ATOM 1243 CD LYS A 646 -12.393 11.361 4.976 1.00 0.00 C ATOM 1244 CE LYS A 646 -11.121 10.588 5.207 1.00 0.00 C ATOM 1245 NZ LYS A 646 -10.236 11.298 6.161 1.00 0.00 N ATOM 0 H LYS A 646 -15.128 8.920 3.674 1.00 0.00 H new ATOM 0 HA LYS A 646 -16.649 11.361 3.409 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -14.460 12.419 3.678 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -15.023 11.450 5.026 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -13.484 9.628 4.338 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -12.902 10.631 3.024 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -12.148 12.346 4.579 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -12.897 11.518 5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -11.358 9.597 5.594 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -10.601 10.445 4.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -9.366 10.746 6.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -9.993 12.234 5.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -10.727 11.413 7.071 1.00 0.00 H new ATOM 1259 N GLU A 647 -15.763 12.193 1.161 1.00 0.00 N ATOM 1260 CA GLU A 647 -15.737 12.427 -0.271 1.00 0.00 C ATOM 1261 C GLU A 647 -14.359 12.769 -0.796 1.00 0.00 C ATOM 1262 O GLU A 647 -14.163 12.981 -1.997 1.00 0.00 O ATOM 1263 CB GLU A 647 -16.825 13.407 -0.674 1.00 0.00 C ATOM 1264 CG GLU A 647 -16.837 14.692 0.110 1.00 0.00 C ATOM 1265 CD GLU A 647 -18.186 15.335 0.064 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -19.033 14.990 0.925 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -18.446 16.157 -0.841 1.00 0.00 O ATOM 0 H GLU A 647 -15.973 13.014 1.729 1.00 0.00 H new ATOM 0 HA GLU A 647 -15.970 11.485 -0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -16.708 13.644 -1.732 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -17.794 12.920 -0.562 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -16.560 14.493 1.145 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -16.090 15.376 -0.294 1.00 0.00 H new ATOM 1274 N GLU A 648 -13.412 12.785 0.096 1.00 0.00 N ATOM 1275 CA GLU A 648 -12.040 12.952 -0.246 1.00 0.00 C ATOM 1276 C GLU A 648 -11.205 12.105 0.688 1.00 0.00 C ATOM 1277 O GLU A 648 -11.147 12.364 1.884 1.00 0.00 O ATOM 1278 CB GLU A 648 -11.607 14.424 -0.191 1.00 0.00 C ATOM 1279 CG GLU A 648 -10.131 14.625 -0.512 1.00 0.00 C ATOM 1280 CD GLU A 648 -9.732 16.070 -0.597 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -9.519 16.713 0.447 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -9.598 16.586 -1.718 1.00 0.00 O ATOM 0 H GLU A 648 -13.580 12.680 1.097 1.00 0.00 H new ATOM 0 HA GLU A 648 -11.891 12.628 -1.276 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -12.208 15.000 -0.895 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -11.814 14.821 0.803 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -9.530 14.134 0.253 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -9.903 14.136 -1.459 1.00 0.00 H new ATOM 1289 N TYR A 649 -10.646 11.043 0.170 1.00 0.00 N ATOM 1290 CA TYR A 649 -9.758 10.217 0.949 1.00 0.00 C ATOM 1291 C TYR A 649 -8.299 10.627 0.787 1.00 0.00 C ATOM 1292 O TYR A 649 -7.880 11.661 1.315 1.00 0.00 O ATOM 1293 CB TYR A 649 -9.974 8.725 0.689 1.00 0.00 C ATOM 1294 CG TYR A 649 -11.045 8.112 1.547 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -12.395 8.293 1.299 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -10.685 7.346 2.620 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -13.343 7.707 2.118 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -11.609 6.766 3.436 1.00 0.00 C ATOM 1299 CZ TYR A 649 -12.937 6.948 3.185 1.00 0.00 C ATOM 1300 OH TYR A 649 -13.862 6.351 3.987 1.00 0.00 O ATOM 0 H TYR A 649 -10.789 10.728 -0.790 1.00 0.00 H new ATOM 0 HA TYR A 649 -10.014 10.388 1.995 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -10.234 8.582 -0.360 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -9.037 8.196 0.860 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -12.710 8.896 0.460 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -9.636 7.196 2.827 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -14.395 7.846 1.918 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -11.292 6.166 4.276 1.00 0.00 H new ATOM 0 HH TYR A 649 -14.388 7.038 4.447 1.00 0.00 H new ATOM 1310 N GLY A 650 -7.546 9.862 0.041 1.00 0.00 N ATOM 1311 CA GLY A 650 -6.165 10.185 -0.156 1.00 0.00 C ATOM 1312 C GLY A 650 -5.346 8.953 -0.311 1.00 0.00 C ATOM 1313 O GLY A 650 -5.847 7.838 -0.091 1.00 0.00 O ATOM 0 H GLY A 650 -7.866 9.018 -0.435 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -6.057 10.811 -1.041 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -5.799 10.765 0.691 1.00 0.00 H new ATOM 1317 N HIS A 651 -4.116 9.115 -0.715 1.00 0.00 N ATOM 1318 CA HIS A 651 -3.227 7.982 -0.865 1.00 0.00 C ATOM 1319 C HIS A 651 -2.881 7.424 0.521 1.00 0.00 C ATOM 1320 O HIS A 651 -2.762 8.186 1.475 1.00 0.00 O ATOM 1321 CB HIS A 651 -1.966 8.390 -1.644 1.00 0.00 C ATOM 1322 CG HIS A 651 -1.023 7.267 -1.991 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -0.937 6.701 -3.243 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -0.126 6.613 -1.241 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.052 5.740 -3.229 1.00 0.00 C ATOM 1326 NE2 HIS A 651 0.457 5.662 -2.033 1.00 0.00 N ATOM 0 H HIS A 651 -3.701 10.017 -0.948 1.00 0.00 H new ATOM 0 HA HIS A 651 -3.722 7.198 -1.439 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -2.274 8.880 -2.568 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -1.421 9.129 -1.057 1.00 0.00 H new ATOM 0 HD2 HIS A 651 0.096 6.802 -0.201 1.00 0.00 H new ATOM 0 HE1 HIS A 651 0.213 5.115 -4.069 1.00 0.00 H new ATOM 0 HE2 HIS A 651 1.173 5.000 -1.735 1.00 0.00 H new ATOM 1335 N SER A 652 -2.785 6.092 0.615 1.00 0.00 N ATOM 1336 CA SER A 652 -2.481 5.355 1.870 1.00 0.00 C ATOM 1337 C SER A 652 -3.698 5.305 2.798 1.00 0.00 C ATOM 1338 O SER A 652 -3.652 4.704 3.874 1.00 0.00 O ATOM 1339 CB SER A 652 -1.256 5.925 2.616 1.00 0.00 C ATOM 1340 OG SER A 652 -0.125 6.013 1.758 1.00 0.00 O ATOM 0 H SER A 652 -2.917 5.476 -0.187 1.00 0.00 H new ATOM 0 HA SER A 652 -2.230 4.338 1.570 1.00 0.00 H new ATOM 0 HB2 SER A 652 -1.494 6.913 3.010 1.00 0.00 H new ATOM 0 HB3 SER A 652 -1.019 5.290 3.470 1.00 0.00 H new ATOM 0 HG SER A 652 0.636 6.379 2.256 1.00 0.00 H new ATOM 1346 N GLU A 653 -4.781 5.926 2.383 1.00 0.00 N ATOM 1347 CA GLU A 653 -5.977 5.910 3.156 1.00 0.00 C ATOM 1348 C GLU A 653 -6.826 4.771 2.665 1.00 0.00 C ATOM 1349 O GLU A 653 -7.238 4.744 1.493 1.00 0.00 O ATOM 1350 CB GLU A 653 -6.722 7.239 3.055 1.00 0.00 C ATOM 1351 CG GLU A 653 -7.739 7.437 4.164 1.00 0.00 C ATOM 1352 CD GLU A 653 -7.132 7.335 5.534 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -6.587 8.332 6.029 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -7.196 6.249 6.141 1.00 0.00 O ATOM 0 H GLU A 653 -4.845 6.447 1.509 1.00 0.00 H new ATOM 0 HA GLU A 653 -5.737 5.770 4.210 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -6.001 8.056 3.081 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -7.229 7.292 2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -8.208 8.415 4.051 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -8.528 6.692 4.065 1.00 0.00 H new ATOM 1361 N VAL A 654 -7.016 3.811 3.525 1.00 0.00 N ATOM 1362 CA VAL A 654 -7.765 2.640 3.202 1.00 0.00 C ATOM 1363 C VAL A 654 -9.198 2.769 3.544 1.00 0.00 C ATOM 1364 O VAL A 654 -9.601 3.623 4.341 1.00 0.00 O ATOM 1365 CB VAL A 654 -7.233 1.373 3.873 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -5.897 0.972 3.327 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -7.230 1.499 5.385 1.00 0.00 C ATOM 0 H VAL A 654 -6.650 3.824 4.477 1.00 0.00 H new ATOM 0 HA VAL A 654 -7.649 2.545 2.122 1.00 0.00 H new ATOM 0 HB VAL A 654 -7.920 0.563 3.630 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -5.555 0.068 3.830 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -5.983 0.781 2.257 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -5.179 1.775 3.496 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -6.846 0.579 5.826 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -6.596 2.335 5.679 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -8.247 1.673 5.738 1.00 0.00 H new ATOM 1371 N VAL A 655 -9.962 1.921 2.943 1.00 0.00 N ATOM 1372 CA VAL A 655 -11.348 1.857 3.187 1.00 0.00 C ATOM 1373 C VAL A 655 -11.760 0.448 3.541 1.00 0.00 C ATOM 1374 O VAL A 655 -11.660 -0.463 2.728 1.00 0.00 O ATOM 1375 CB VAL A 655 -12.185 2.416 2.001 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -11.933 3.868 1.838 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -11.841 1.724 0.699 1.00 0.00 C ATOM 0 H VAL A 655 -9.627 1.244 2.257 1.00 0.00 H new ATOM 0 HA VAL A 655 -11.559 2.501 4.041 1.00 0.00 H new ATOM 0 HB VAL A 655 -13.234 2.233 2.234 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -12.524 4.249 1.005 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -12.215 4.391 2.752 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -10.874 4.033 1.637 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -12.446 2.142 -0.106 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -10.785 1.875 0.475 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -12.044 0.657 0.789 1.00 0.00 H new ATOM 1381 N GLU A 656 -12.134 0.266 4.777 1.00 0.00 N ATOM 1382 CA GLU A 656 -12.625 -1.007 5.243 1.00 0.00 C ATOM 1383 C GLU A 656 -13.985 -1.323 4.667 1.00 0.00 C ATOM 1384 O GLU A 656 -14.950 -0.555 4.796 1.00 0.00 O ATOM 1385 CB GLU A 656 -12.677 -1.077 6.761 1.00 0.00 C ATOM 1386 CG GLU A 656 -11.413 -1.544 7.445 1.00 0.00 C ATOM 1387 CD GLU A 656 -11.532 -1.448 8.946 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -12.204 -2.306 9.572 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -10.953 -0.521 9.548 1.00 0.00 O ATOM 0 H GLU A 656 -12.108 0.993 5.491 1.00 0.00 H new ATOM 0 HA GLU A 656 -11.916 -1.757 4.892 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -12.929 -0.087 7.142 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -13.490 -1.745 7.047 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -11.203 -2.575 7.160 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -10.570 -0.942 7.106 1.00 0.00 H new ATOM 1396 N TYR A 657 -14.031 -2.410 4.015 1.00 0.00 N ATOM 1397 CA TYR A 657 -15.208 -2.966 3.475 1.00 0.00 C ATOM 1398 C TYR A 657 -15.665 -4.088 4.353 1.00 0.00 C ATOM 1399 O TYR A 657 -14.916 -4.567 5.221 1.00 0.00 O ATOM 1400 CB TYR A 657 -14.925 -3.530 2.091 1.00 0.00 C ATOM 1401 CG TYR A 657 -14.695 -2.500 1.032 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -15.762 -1.859 0.422 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -13.419 -2.168 0.639 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -15.551 -0.910 -0.552 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -13.203 -1.226 -0.326 1.00 0.00 C ATOM 1406 CZ TYR A 657 -14.264 -0.600 -0.919 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.031 0.337 -1.883 1.00 0.00 O ATOM 0 H TYR A 657 -13.201 -2.974 3.830 1.00 0.00 H new ATOM 0 HA TYR A 657 -15.972 -2.191 3.411 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -14.048 -4.174 2.149 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -15.763 -4.159 1.791 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -16.771 -2.107 0.715 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -12.575 -2.660 1.101 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -16.388 -0.415 -1.022 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -12.195 -0.976 -0.621 1.00 0.00 H new ATOM 0 HH TYR A 657 -14.879 0.750 -2.150 1.00 0.00 H new ATOM 1417 N TYR A 658 -16.857 -4.510 4.129 1.00 0.00 N ATOM 1418 CA TYR A 658 -17.411 -5.628 4.804 1.00 0.00 C ATOM 1419 C TYR A 658 -18.321 -6.296 3.834 1.00 0.00 C ATOM 1420 O TYR A 658 -18.999 -5.619 3.060 1.00 0.00 O ATOM 1421 CB TYR A 658 -18.175 -5.219 6.091 1.00 0.00 C ATOM 1422 CG TYR A 658 -19.500 -4.496 5.890 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -19.553 -3.174 5.479 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -20.698 -5.147 6.142 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -20.758 -2.518 5.332 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -21.907 -4.500 5.989 1.00 0.00 C ATOM 1427 CZ TYR A 658 -21.930 -3.185 5.587 1.00 0.00 C ATOM 1428 OH TYR A 658 -23.136 -2.530 5.462 1.00 0.00 O ATOM 0 H TYR A 658 -17.489 -4.078 3.456 1.00 0.00 H new ATOM 0 HA TYR A 658 -16.618 -6.298 5.135 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -18.362 -6.118 6.678 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -17.524 -4.579 6.687 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -18.634 -2.647 5.270 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -20.685 -6.178 6.463 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -20.779 -1.485 5.018 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -22.831 -5.024 6.184 1.00 0.00 H new ATOM 0 HH TYR A 658 -23.867 -3.146 5.678 1.00 0.00 H new ATOM 1438 N CYS A 659 -18.283 -7.570 3.775 1.00 0.00 N ATOM 1439 CA CYS A 659 -19.189 -8.244 2.914 1.00 0.00 C ATOM 1440 C CYS A 659 -20.301 -8.818 3.762 1.00 0.00 C ATOM 1441 O CYS A 659 -20.293 -8.661 4.992 1.00 0.00 O ATOM 1442 CB CYS A 659 -18.489 -9.316 2.076 1.00 0.00 C ATOM 1443 SG CYS A 659 -19.456 -9.852 0.614 1.00 0.00 S ATOM 0 H CYS A 659 -17.646 -8.167 4.302 1.00 0.00 H new ATOM 0 HA CYS A 659 -19.607 -7.540 2.194 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -17.525 -8.932 1.743 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -18.287 -10.183 2.705 1.00 0.00 H new ATOM 1448 N ASN A 660 -21.242 -9.460 3.141 1.00 0.00 N ATOM 1449 CA ASN A 660 -22.371 -10.000 3.852 1.00 0.00 C ATOM 1450 C ASN A 660 -21.955 -11.257 4.592 1.00 0.00 C ATOM 1451 O ASN A 660 -20.998 -11.925 4.176 1.00 0.00 O ATOM 1452 CB ASN A 660 -23.531 -10.312 2.895 1.00 0.00 C ATOM 1453 CG ASN A 660 -23.911 -9.141 2.040 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -24.672 -8.279 2.451 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -23.433 -9.128 0.832 1.00 0.00 N ATOM 0 H ASN A 660 -21.254 -9.626 2.135 1.00 0.00 H new ATOM 0 HA ASN A 660 -22.716 -9.253 4.567 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -23.252 -11.148 2.254 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -24.398 -10.630 3.474 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -23.691 -8.379 0.189 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -22.800 -9.867 0.526 1.00 0.00 H new ATOM 1462 N PRO A 661 -22.677 -11.625 5.679 1.00 0.00 N ATOM 1463 CA PRO A 661 -22.397 -12.841 6.505 1.00 0.00 C ATOM 1464 C PRO A 661 -22.711 -14.154 5.757 1.00 0.00 C ATOM 1465 O PRO A 661 -23.112 -15.162 6.344 1.00 0.00 O ATOM 1466 CB PRO A 661 -23.362 -12.680 7.685 1.00 0.00 C ATOM 1467 CG PRO A 661 -24.458 -11.820 7.176 1.00 0.00 C ATOM 1468 CD PRO A 661 -23.821 -10.865 6.223 1.00 0.00 C ATOM 0 HA PRO A 661 -21.345 -12.910 6.780 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -23.742 -13.646 8.018 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -22.866 -12.221 8.540 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -25.223 -12.416 6.678 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -24.948 -11.289 7.992 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -24.512 -10.564 5.436 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -23.494 -9.955 6.726 1.00 0.00 H new ATOM 1476 N ARG A 662 -22.493 -14.127 4.484 1.00 0.00 N ATOM 1477 CA ARG A 662 -22.783 -15.209 3.592 1.00 0.00 C ATOM 1478 C ARG A 662 -21.571 -15.409 2.700 1.00 0.00 C ATOM 1479 O ARG A 662 -21.600 -16.198 1.752 1.00 0.00 O ATOM 1480 CB ARG A 662 -23.948 -14.785 2.712 1.00 0.00 C ATOM 1481 CG ARG A 662 -25.173 -14.308 3.465 1.00 0.00 C ATOM 1482 CD ARG A 662 -25.831 -13.194 2.694 1.00 0.00 C ATOM 1483 NE ARG A 662 -27.014 -12.649 3.356 1.00 0.00 N ATOM 1484 CZ ARG A 662 -27.606 -11.486 3.024 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -27.243 -10.832 1.920 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -28.585 -11.020 3.771 1.00 0.00 N ATOM 0 H ARG A 662 -22.090 -13.317 4.013 1.00 0.00 H new ATOM 0 HA ARG A 662 -23.020 -16.121 4.141 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -23.613 -13.987 2.049 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -24.232 -15.626 2.080 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -25.873 -15.132 3.603 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -24.890 -13.960 4.459 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -25.108 -12.393 2.540 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -26.113 -13.562 1.708 1.00 0.00 H new ATOM 0 HE ARG A 662 -27.419 -13.186 4.122 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -26.512 -11.212 1.319 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -27.697 -9.952 1.676 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -28.890 -11.539 4.594 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -29.039 -10.140 3.526 1.00 0.00 H new ATOM 1500 N PHE A 663 -20.511 -14.655 2.979 1.00 0.00 N ATOM 1501 CA PHE A 663 -19.324 -14.670 2.142 1.00 0.00 C ATOM 1502 C PHE A 663 -18.061 -14.660 2.973 1.00 0.00 C ATOM 1503 O PHE A 663 -18.077 -14.308 4.150 1.00 0.00 O ATOM 1504 CB PHE A 663 -19.264 -13.435 1.228 1.00 0.00 C ATOM 1505 CG PHE A 663 -20.407 -13.245 0.284 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -21.573 -12.642 0.704 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -20.299 -13.638 -1.027 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -22.610 -12.446 -0.163 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -21.332 -13.449 -1.903 1.00 0.00 C ATOM 1510 CZ PHE A 663 -22.494 -12.850 -1.472 1.00 0.00 C ATOM 0 H PHE A 663 -20.454 -14.027 3.780 1.00 0.00 H new ATOM 0 HA PHE A 663 -19.388 -15.583 1.550 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -19.191 -12.548 1.858 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -18.345 -13.488 0.644 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -21.668 -12.321 1.731 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -19.387 -14.102 -1.371 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -23.519 -11.975 0.179 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -21.236 -13.769 -2.930 1.00 0.00 H new ATOM 0 HZ PHE A 663 -23.312 -12.698 -2.160 1.00 0.00 H new ATOM 1520 N LEU A 664 -16.987 -15.016 2.329 1.00 0.00 N ATOM 1521 CA LEU A 664 -15.656 -14.980 2.858 1.00 0.00 C ATOM 1522 C LEU A 664 -14.884 -13.936 2.063 1.00 0.00 C ATOM 1523 O LEU A 664 -15.155 -13.737 0.874 1.00 0.00 O ATOM 1524 CB LEU A 664 -14.993 -16.349 2.702 1.00 0.00 C ATOM 1525 CG LEU A 664 -15.692 -17.502 3.415 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -15.006 -18.816 3.103 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -15.718 -17.260 4.917 1.00 0.00 C ATOM 0 H LEU A 664 -17.019 -15.358 1.368 1.00 0.00 H new ATOM 0 HA LEU A 664 -15.668 -14.729 3.919 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -14.932 -16.585 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -13.970 -16.282 3.073 1.00 0.00 H new ATOM 0 HG LEU A 664 -16.719 -17.557 3.055 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -15.519 -19.626 3.621 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -15.036 -18.996 2.028 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -13.969 -18.773 3.435 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -16.220 -18.092 5.411 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -14.697 -17.179 5.290 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -16.255 -16.335 5.127 1.00 0.00 H new ATOM 1539 N MET A 665 -13.963 -13.277 2.690 1.00 0.00 N ATOM 1540 CA MET A 665 -13.222 -12.204 2.062 1.00 0.00 C ATOM 1541 C MET A 665 -11.835 -12.683 1.676 1.00 0.00 C ATOM 1542 O MET A 665 -11.050 -13.103 2.539 1.00 0.00 O ATOM 1543 CB MET A 665 -13.163 -11.011 3.014 1.00 0.00 C ATOM 1544 CG MET A 665 -13.671 -9.726 2.403 1.00 0.00 C ATOM 1545 SD MET A 665 -14.015 -8.458 3.617 1.00 0.00 S ATOM 1546 CE MET A 665 -14.789 -7.232 2.580 1.00 0.00 C ATOM 0 H MET A 665 -13.694 -13.460 3.657 1.00 0.00 H new ATOM 0 HA MET A 665 -13.724 -11.889 1.147 1.00 0.00 H new ATOM 0 HB2 MET A 665 -13.750 -11.237 3.904 1.00 0.00 H new ATOM 0 HB3 MET A 665 -12.133 -10.867 3.339 1.00 0.00 H new ATOM 0 HG2 MET A 665 -12.932 -9.351 1.694 1.00 0.00 H new ATOM 0 HG3 MET A 665 -14.579 -9.934 1.837 1.00 0.00 H new ATOM 0 HE1 MET A 665 -14.358 -6.253 2.790 1.00 0.00 H new ATOM 0 HE2 MET A 665 -14.623 -7.484 1.533 1.00 0.00 H new ATOM 0 HE3 MET A 665 -15.860 -7.208 2.782 1.00 0.00 H new ATOM 1556 N LYS A 666 -11.543 -12.640 0.384 1.00 0.00 N ATOM 1557 CA LYS A 666 -10.285 -13.155 -0.135 1.00 0.00 C ATOM 1558 C LYS A 666 -9.125 -12.178 0.049 1.00 0.00 C ATOM 1559 O LYS A 666 -8.111 -12.509 0.673 1.00 0.00 O ATOM 1560 CB LYS A 666 -10.415 -13.509 -1.618 1.00 0.00 C ATOM 1561 CG LYS A 666 -9.138 -14.096 -2.209 1.00 0.00 C ATOM 1562 CD LYS A 666 -9.224 -14.271 -3.713 1.00 0.00 C ATOM 1563 CE LYS A 666 -10.327 -15.225 -4.121 1.00 0.00 C ATOM 1564 NZ LYS A 666 -10.356 -15.402 -5.581 1.00 0.00 N ATOM 0 H LYS A 666 -12.163 -12.252 -0.326 1.00 0.00 H new ATOM 0 HA LYS A 666 -10.061 -14.051 0.444 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -11.228 -14.224 -1.744 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -10.688 -12.613 -2.176 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -8.297 -13.445 -1.969 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -8.936 -15.061 -1.745 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -9.395 -13.301 -4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -8.270 -14.641 -4.088 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -10.176 -16.190 -3.637 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -11.289 -14.843 -3.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -11.120 -16.060 -5.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -10.523 -14.483 -6.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -9.445 -15.788 -5.902 1.00 0.00 H new ATOM 1578 N GLY A 667 -9.261 -11.009 -0.519 1.00 0.00 N ATOM 1579 CA GLY A 667 -8.196 -10.046 -0.491 1.00 0.00 C ATOM 1580 C GLY A 667 -8.331 -9.048 0.632 1.00 0.00 C ATOM 1581 O GLY A 667 -9.069 -9.288 1.596 1.00 0.00 O ATOM 0 H GLY A 667 -10.102 -10.702 -1.008 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -7.244 -10.568 -0.393 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -8.171 -9.513 -1.442 1.00 0.00 H new ATOM 1585 N PRO A 668 -7.647 -7.909 0.522 1.00 0.00 N ATOM 1586 CA PRO A 668 -7.649 -6.879 1.552 1.00 0.00 C ATOM 1587 C PRO A 668 -9.006 -6.203 1.688 1.00 0.00 C ATOM 1588 O PRO A 668 -9.488 -5.563 0.758 1.00 0.00 O ATOM 1589 CB PRO A 668 -6.600 -5.868 1.063 1.00 0.00 C ATOM 1590 CG PRO A 668 -6.531 -6.071 -0.412 1.00 0.00 C ATOM 1591 CD PRO A 668 -6.818 -7.523 -0.642 1.00 0.00 C ATOM 0 HA PRO A 668 -7.431 -7.294 2.536 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -6.891 -4.847 1.308 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -5.632 -6.045 1.532 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -7.258 -5.443 -0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -5.548 -5.802 -0.797 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -7.348 -7.682 -1.581 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -5.900 -8.109 -0.691 1.00 0.00 H new ATOM 1599 N ASN A 669 -9.628 -6.361 2.852 1.00 0.00 N ATOM 1600 CA ASN A 669 -10.920 -5.726 3.151 1.00 0.00 C ATOM 1601 C ASN A 669 -10.820 -4.204 3.154 1.00 0.00 C ATOM 1602 O ASN A 669 -11.808 -3.532 3.184 1.00 0.00 O ATOM 1603 CB ASN A 669 -11.492 -6.217 4.499 1.00 0.00 C ATOM 1604 CG ASN A 669 -10.626 -5.883 5.698 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -9.694 -6.619 6.035 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -10.952 -4.822 6.379 1.00 0.00 N ATOM 0 H ASN A 669 -9.259 -6.928 3.615 1.00 0.00 H new ATOM 0 HA ASN A 669 -11.602 -6.021 2.353 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -12.479 -5.778 4.644 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -11.627 -7.298 4.452 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -10.431 -4.576 7.221 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -11.728 -4.237 6.071 1.00 0.00 H new ATOM 1613 N LYS A 670 -9.623 -3.693 3.138 1.00 0.00 N ATOM 1614 CA LYS A 670 -9.376 -2.278 3.111 1.00 0.00 C ATOM 1615 C LYS A 670 -8.326 -1.914 2.111 1.00 0.00 C ATOM 1616 O LYS A 670 -7.172 -2.314 2.226 1.00 0.00 O ATOM 1617 CB LYS A 670 -9.159 -1.695 4.509 1.00 0.00 C ATOM 1618 CG LYS A 670 -8.721 -2.683 5.560 1.00 0.00 C ATOM 1619 CD LYS A 670 -7.285 -3.100 5.426 1.00 0.00 C ATOM 1620 CE LYS A 670 -6.381 -1.907 5.570 1.00 0.00 C ATOM 1621 NZ LYS A 670 -4.953 -2.257 5.407 1.00 0.00 N ATOM 0 H LYS A 670 -8.774 -4.258 3.143 1.00 0.00 H new ATOM 0 HA LYS A 670 -10.284 -1.791 2.755 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -8.411 -0.905 4.443 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -10.087 -1.228 4.838 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -8.874 -2.244 6.546 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -9.355 -3.568 5.503 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -7.042 -3.843 6.186 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -7.125 -3.572 4.456 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -6.655 -1.156 4.829 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -6.532 -1.457 6.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -4.371 -1.402 5.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -4.682 -2.954 6.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -4.801 -2.662 4.461 1.00 0.00 H new ATOM 1635 N ILE A 671 -8.752 -1.170 1.115 1.00 0.00 N ATOM 1636 CA ILE A 671 -7.919 -0.819 -0.010 1.00 0.00 C ATOM 1637 C ILE A 671 -7.592 0.636 0.092 1.00 0.00 C ATOM 1638 O ILE A 671 -8.369 1.397 0.658 1.00 0.00 O ATOM 1639 CB ILE A 671 -8.641 -1.073 -1.373 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -9.846 -0.129 -1.539 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -9.088 -2.521 -1.455 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -10.565 -0.223 -2.866 1.00 0.00 C ATOM 0 H ILE A 671 -9.697 -0.788 1.064 1.00 0.00 H new ATOM 0 HA ILE A 671 -7.023 -1.439 0.016 1.00 0.00 H new ATOM 0 HB ILE A 671 -7.940 -0.870 -2.182 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -10.561 -0.336 -0.742 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -9.504 0.897 -1.402 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -9.591 -2.693 -2.407 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -8.219 -3.175 -1.380 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -9.776 -2.736 -0.637 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -11.396 0.482 -2.880 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -9.872 0.016 -3.673 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -10.945 -1.235 -3.003 1.00 0.00 H new ATOM 1649 N GLN A 672 -6.482 1.021 -0.424 1.00 0.00 N ATOM 1650 CA GLN A 672 -6.085 2.387 -0.365 1.00 0.00 C ATOM 1651 C GLN A 672 -6.008 2.994 -1.734 1.00 0.00 C ATOM 1652 O GLN A 672 -5.805 2.295 -2.735 1.00 0.00 O ATOM 1653 CB GLN A 672 -4.758 2.601 0.387 1.00 0.00 C ATOM 1654 CG GLN A 672 -3.528 1.917 -0.200 1.00 0.00 C ATOM 1655 CD GLN A 672 -3.505 0.408 -0.010 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -3.023 -0.092 1.003 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -3.965 -0.331 -0.988 1.00 0.00 N ATOM 0 H GLN A 672 -5.823 0.404 -0.898 1.00 0.00 H new ATOM 0 HA GLN A 672 -6.862 2.896 0.206 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -4.562 3.672 0.436 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -4.886 2.253 1.412 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -3.477 2.139 -1.266 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -2.635 2.343 0.258 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -4.360 0.110 -1.818 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -3.928 -1.348 -0.920 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.217 4.271 -1.773 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.077 5.053 -2.972 1.00 0.00 C ATOM 1668 C CYS A 673 -4.617 5.133 -3.339 1.00 0.00 C ATOM 1669 O CYS A 673 -3.782 5.570 -2.532 1.00 0.00 O ATOM 1670 CB CYS A 673 -6.646 6.450 -2.725 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.045 7.737 -3.870 1.00 0.00 S ATOM 0 H CYS A 673 -6.496 4.816 -0.958 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.623 4.590 -3.794 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -7.733 6.401 -2.794 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -6.405 6.750 -1.705 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.278 4.673 -4.514 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.940 4.728 -4.953 1.00 0.00 C ATOM 1678 C VAL A 674 -2.751 5.610 -6.170 1.00 0.00 C ATOM 1679 O VAL A 674 -2.946 5.202 -7.314 1.00 0.00 O ATOM 1680 CB VAL A 674 -2.264 3.344 -5.120 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -2.240 2.626 -3.806 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.939 2.489 -6.162 1.00 0.00 C ATOM 0 H VAL A 674 -4.929 4.255 -5.178 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.408 5.208 -4.131 1.00 0.00 H new ATOM 0 HB VAL A 674 -1.246 3.524 -5.465 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -1.763 1.654 -3.931 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -1.679 3.214 -3.080 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -3.260 2.486 -3.449 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -2.424 1.531 -6.237 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.978 2.321 -5.878 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -2.904 2.996 -7.126 1.00 0.00 H new ATOM 1686 N ASP A 675 -2.552 6.882 -5.880 1.00 0.00 N ATOM 1687 CA ASP A 675 -2.062 7.864 -6.857 1.00 0.00 C ATOM 1688 C ASP A 675 -3.100 8.299 -7.859 1.00 0.00 C ATOM 1689 O ASP A 675 -2.790 9.041 -8.790 1.00 0.00 O ATOM 1690 CB ASP A 675 -0.774 7.395 -7.572 1.00 0.00 C ATOM 1691 CG ASP A 675 0.418 7.225 -6.660 1.00 0.00 C ATOM 1692 OD1 ASP A 675 1.099 8.230 -6.380 1.00 0.00 O ATOM 1693 OD2 ASP A 675 0.684 6.074 -6.210 1.00 0.00 O ATOM 0 H ASP A 675 -2.724 7.276 -4.955 1.00 0.00 H new ATOM 0 HA ASP A 675 -1.818 8.744 -6.261 1.00 0.00 H new ATOM 0 HB2 ASP A 675 -0.974 6.446 -8.070 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -0.521 8.116 -8.350 1.00 0.00 H new ATOM 1698 N GLY A 676 -4.323 7.894 -7.651 1.00 0.00 N ATOM 1699 CA GLY A 676 -5.375 8.276 -8.547 1.00 0.00 C ATOM 1700 C GLY A 676 -6.368 7.167 -8.767 1.00 0.00 C ATOM 1701 O GLY A 676 -7.453 7.400 -9.313 1.00 0.00 O ATOM 0 H GLY A 676 -4.613 7.302 -6.872 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -5.891 9.149 -8.147 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -4.945 8.571 -9.504 1.00 0.00 H new ATOM 1705 N GLU A 677 -6.029 5.960 -8.332 1.00 0.00 N ATOM 1706 CA GLU A 677 -6.926 4.836 -8.464 1.00 0.00 C ATOM 1707 C GLU A 677 -6.864 4.046 -7.203 1.00 0.00 C ATOM 1708 O GLU A 677 -5.844 4.039 -6.538 1.00 0.00 O ATOM 1709 CB GLU A 677 -6.530 3.921 -9.625 1.00 0.00 C ATOM 1710 CG GLU A 677 -6.606 4.541 -11.001 1.00 0.00 C ATOM 1711 CD GLU A 677 -6.171 3.576 -12.062 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -6.993 2.735 -12.500 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -4.998 3.613 -12.475 1.00 0.00 O ATOM 0 H GLU A 677 -5.138 5.742 -7.886 1.00 0.00 H new ATOM 0 HA GLU A 677 -7.929 5.217 -8.659 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -5.510 3.574 -9.459 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -7.173 3.041 -9.606 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -7.628 4.865 -11.199 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -5.977 5.430 -11.036 1.00 0.00 H new ATOM 1720 N TRP A 678 -7.931 3.423 -6.853 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.949 2.559 -5.705 1.00 0.00 C ATOM 1722 C TRP A 678 -7.345 1.222 -6.088 1.00 0.00 C ATOM 1723 O TRP A 678 -7.271 0.887 -7.280 1.00 0.00 O ATOM 1724 CB TRP A 678 -9.375 2.361 -5.220 1.00 0.00 C ATOM 1725 CG TRP A 678 -10.004 3.593 -4.635 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.728 4.553 -5.281 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -9.962 3.977 -3.271 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -11.127 5.520 -4.386 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.666 5.183 -3.146 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.391 3.410 -2.146 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -10.808 5.833 -1.932 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -9.527 4.042 -0.944 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -10.231 5.244 -0.839 1.00 0.00 C ATOM 0 H TRP A 678 -8.821 3.491 -7.347 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.369 3.011 -4.900 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.986 2.016 -6.054 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.385 1.570 -4.470 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.954 4.554 -6.337 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.676 6.350 -4.612 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -8.845 2.481 -2.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.350 6.764 -1.851 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -9.084 3.606 -0.061 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -10.322 5.720 0.126 1.00 0.00 H new ATOM 1744 N THR A 679 -6.892 0.475 -5.126 1.00 0.00 N ATOM 1745 CA THR A 679 -6.355 -0.823 -5.398 1.00 0.00 C ATOM 1746 C THR A 679 -7.480 -1.847 -5.574 1.00 0.00 C ATOM 1747 O THR A 679 -8.673 -1.493 -5.501 1.00 0.00 O ATOM 1748 CB THR A 679 -5.368 -1.243 -4.305 1.00 0.00 C ATOM 1749 OG1 THR A 679 -5.938 -1.013 -3.007 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.078 -0.475 -4.438 1.00 0.00 C ATOM 0 H THR A 679 -6.884 0.744 -4.142 1.00 0.00 H new ATOM 0 HA THR A 679 -5.802 -0.781 -6.336 1.00 0.00 H new ATOM 0 HB THR A 679 -5.159 -2.307 -4.420 1.00 0.00 H new ATOM 0 HG1 THR A 679 -5.709 -1.758 -2.412 1.00 0.00 H new ATOM 0 HG21 THR A 679 -3.387 -0.785 -3.654 1.00 0.00 H new ATOM 0 HG22 THR A 679 -3.634 -0.676 -5.413 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.279 0.592 -4.344 1.00 0.00 H new ATOM 1758 N THR A 680 -7.121 -3.077 -5.828 1.00 0.00 N ATOM 1759 CA THR A 680 -8.081 -4.113 -6.057 1.00 0.00 C ATOM 1760 C THR A 680 -8.843 -4.436 -4.787 1.00 0.00 C ATOM 1761 O THR A 680 -8.238 -4.693 -3.731 1.00 0.00 O ATOM 1762 CB THR A 680 -7.386 -5.363 -6.595 1.00 0.00 C ATOM 1763 OG1 THR A 680 -6.571 -4.976 -7.721 1.00 0.00 O ATOM 1764 CG2 THR A 680 -8.413 -6.393 -7.054 1.00 0.00 C ATOM 0 H THR A 680 -6.150 -3.385 -5.881 1.00 0.00 H new ATOM 0 HA THR A 680 -8.797 -3.760 -6.799 1.00 0.00 H new ATOM 0 HB THR A 680 -6.777 -5.807 -5.807 1.00 0.00 H new ATOM 0 HG1 THR A 680 -6.114 -5.765 -8.081 1.00 0.00 H new ATOM 0 HG21 THR A 680 -7.898 -7.276 -7.434 1.00 0.00 H new ATOM 0 HG22 THR A 680 -9.046 -6.676 -6.213 1.00 0.00 H new ATOM 0 HG23 THR A 680 -9.030 -5.965 -7.844 1.00 0.00 H new ATOM 1772 N LEU A 681 -10.160 -4.390 -4.903 1.00 0.00 N ATOM 1773 CA LEU A 681 -11.062 -4.686 -3.819 1.00 0.00 C ATOM 1774 C LEU A 681 -10.866 -6.084 -3.246 1.00 0.00 C ATOM 1775 O LEU A 681 -10.314 -6.966 -3.913 1.00 0.00 O ATOM 1776 CB LEU A 681 -12.521 -4.484 -4.222 1.00 0.00 C ATOM 1777 CG LEU A 681 -13.067 -3.082 -4.068 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -12.663 -2.170 -5.202 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -14.545 -3.126 -3.861 1.00 0.00 C ATOM 0 H LEU A 681 -10.634 -4.141 -5.771 1.00 0.00 H new ATOM 0 HA LEU A 681 -10.815 -3.973 -3.032 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -12.633 -4.783 -5.264 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -13.137 -5.159 -3.628 1.00 0.00 H new ATOM 0 HG LEU A 681 -12.617 -2.643 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -13.083 -1.178 -5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -11.576 -2.101 -5.244 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -13.038 -2.572 -6.143 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -14.927 -2.111 -3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -15.019 -3.601 -4.720 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -14.769 -3.698 -2.960 1.00 0.00 H new ATOM 1791 N PRO A 682 -11.351 -6.313 -2.001 1.00 0.00 N ATOM 1792 CA PRO A 682 -11.178 -7.582 -1.298 1.00 0.00 C ATOM 1793 C PRO A 682 -11.733 -8.776 -2.065 1.00 0.00 C ATOM 1794 O PRO A 682 -11.077 -9.815 -2.149 1.00 0.00 O ATOM 1795 CB PRO A 682 -11.958 -7.391 0.013 1.00 0.00 C ATOM 1796 CG PRO A 682 -12.809 -6.187 -0.192 1.00 0.00 C ATOM 1797 CD PRO A 682 -12.099 -5.334 -1.181 1.00 0.00 C ATOM 0 HA PRO A 682 -10.120 -7.806 -1.157 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -12.567 -8.267 0.236 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -11.280 -7.251 0.855 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -13.796 -6.467 -0.559 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -12.958 -5.652 0.746 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -12.796 -4.753 -1.785 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -11.431 -4.624 -0.694 1.00 0.00 H new ATOM 1805 N VAL A 683 -12.912 -8.595 -2.661 1.00 0.00 N ATOM 1806 CA VAL A 683 -13.641 -9.658 -3.358 1.00 0.00 C ATOM 1807 C VAL A 683 -14.128 -10.720 -2.359 1.00 0.00 C ATOM 1808 O VAL A 683 -13.335 -11.409 -1.692 1.00 0.00 O ATOM 1809 CB VAL A 683 -12.819 -10.322 -4.521 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -13.612 -11.444 -5.185 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -12.422 -9.278 -5.561 1.00 0.00 C ATOM 0 H VAL A 683 -13.394 -7.696 -2.674 1.00 0.00 H new ATOM 0 HA VAL A 683 -14.502 -9.184 -3.829 1.00 0.00 H new ATOM 0 HB VAL A 683 -11.916 -10.751 -4.087 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -13.018 -11.885 -5.986 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -13.849 -12.209 -4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -14.536 -11.041 -5.599 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -11.854 -9.757 -6.358 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -13.319 -8.821 -5.979 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -11.809 -8.510 -5.090 1.00 0.00 H new ATOM 1815 N CYS A 684 -15.410 -10.814 -2.215 1.00 0.00 N ATOM 1816 CA CYS A 684 -15.976 -11.776 -1.327 1.00 0.00 C ATOM 1817 C CYS A 684 -16.709 -12.848 -2.089 1.00 0.00 C ATOM 1818 O CYS A 684 -17.392 -12.578 -3.077 1.00 0.00 O ATOM 1819 CB CYS A 684 -16.835 -11.112 -0.256 1.00 0.00 C ATOM 1820 SG CYS A 684 -18.081 -9.930 -0.877 1.00 0.00 S ATOM 0 H CYS A 684 -16.089 -10.232 -2.705 1.00 0.00 H new ATOM 0 HA CYS A 684 -15.163 -12.271 -0.796 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -17.347 -11.890 0.310 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -16.179 -10.590 0.441 1.00 0.00 H new ATOM 1825 N ILE A 685 -16.520 -14.045 -1.645 1.00 0.00 N ATOM 1826 CA ILE A 685 -17.063 -15.232 -2.252 1.00 0.00 C ATOM 1827 C ILE A 685 -17.824 -15.966 -1.237 1.00 0.00 C ATOM 1828 O ILE A 685 -17.500 -15.903 -0.072 1.00 0.00 O ATOM 1829 CB ILE A 685 -15.985 -16.146 -2.915 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -14.831 -16.510 -1.929 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -15.436 -15.487 -4.176 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -13.796 -15.418 -1.701 1.00 0.00 C ATOM 0 H ILE A 685 -15.961 -14.240 -0.815 1.00 0.00 H new ATOM 0 HA ILE A 685 -17.713 -14.922 -3.070 1.00 0.00 H new ATOM 0 HB ILE A 685 -16.473 -17.082 -3.189 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -15.269 -16.778 -0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -14.321 -17.397 -2.305 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -14.685 -16.135 -4.628 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -16.248 -15.324 -4.884 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -14.981 -14.530 -3.918 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -13.040 -15.774 -1.001 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -13.322 -15.163 -2.649 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -14.284 -14.534 -1.290 1.00 0.00 H new ATOM 1839 N VAL A 686 -18.833 -16.631 -1.677 1.00 0.00 N ATOM 1840 CA VAL A 686 -19.769 -17.236 -0.884 1.00 0.00 C ATOM 1841 C VAL A 686 -19.174 -18.240 0.124 1.00 0.00 C ATOM 1842 O VAL A 686 -18.236 -18.983 -0.176 1.00 0.00 O ATOM 1843 CB VAL A 686 -20.832 -17.876 -1.770 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -21.450 -16.894 -2.767 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -20.403 -19.177 -2.418 1.00 0.00 C ATOM 0 H VAL A 686 -19.012 -16.758 -2.673 1.00 0.00 H new ATOM 0 HA VAL A 686 -20.226 -16.466 -0.263 1.00 0.00 H new ATOM 0 HB VAL A 686 -21.629 -18.157 -1.081 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -22.199 -17.409 -3.368 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -21.921 -16.074 -2.225 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -20.671 -16.498 -3.419 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -21.217 -19.564 -3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -19.529 -19.000 -3.046 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -20.153 -19.904 -1.645 1.00 0.00 H new ATOM 1849 N GLU A 687 -19.694 -18.189 1.313 1.00 0.00 N ATOM 1850 CA GLU A 687 -19.287 -19.041 2.386 1.00 0.00 C ATOM 1851 C GLU A 687 -20.165 -20.271 2.341 1.00 0.00 C ATOM 1852 O GLU A 687 -19.698 -21.333 1.885 1.00 0.00 O ATOM 1853 CB GLU A 687 -19.418 -18.261 3.722 1.00 0.00 C ATOM 1854 CG GLU A 687 -18.914 -18.957 4.995 1.00 0.00 C ATOM 1855 CD GLU A 687 -19.910 -19.888 5.654 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -20.852 -19.390 6.316 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -19.746 -21.127 5.579 1.00 0.00 O ATOM 1858 OXT GLU A 687 -21.361 -20.159 2.669 1.00 0.00 O ATOM 0 H GLU A 687 -20.434 -17.535 1.569 1.00 0.00 H new ATOM 0 HA GLU A 687 -18.246 -19.353 2.298 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -18.880 -17.319 3.617 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -20.470 -18.013 3.867 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -18.017 -19.525 4.749 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -18.621 -18.194 5.716 1.00 0.00 H new