USER MOD reduce.3.24.130724 H: found=0, std=0, add=856, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 858 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 728 HIS : no HE2:sc= -0.178 K(o=-0.72,f=0.55) USER MOD Set 1.2: A 739 THR OG1 : rot 171:sc= -0.027 USER MOD Set 1.3: A 740 GLN : amide:sc= -0.518 K(o=-0.72,f=0.55) USER MOD Set 2.1: A 640 ASN : amide:sc= -2.12 K(o=-1.6,f=-0.062) USER MOD Set 2.2: A 658 TYR OH : rot 64:sc= 0.528 USER MOD Single : A 629 SER OG : rot 28:sc= 0.00592 USER MOD Single : A 638 ASN : amide:sc= -0.711 K(o=-0.71,f=-0.1) USER MOD Single : A 642 LYS NZ :NH3+ -150:sc= 1.38 (180deg=1.08) USER MOD Single : A 644 LYS NZ :NH3+ -152:sc= 0.998 (180deg=0.404) USER MOD Single : A 645 THR OG1 : rot 33:sc= 0.0098 USER MOD Single : A 646 LYS NZ :NH3+ 170:sc= 1.27 (180deg=1.23) USER MOD Single : A 649 TYR OH : rot 180:sc= 0.0692 USER MOD Single : A 651 HIS : no HD1:sc= -0.156 K(o=-0.16,f=-1.5) USER MOD Single : A 652 SER OG : rot 15:sc= 0.899 USER MOD Single : A 657 TYR OH : rot -160:sc= 0.951 USER MOD Single : A 660 ASN : amide:sc= -1.67! C(o=-1.7!,f=-9!) USER MOD Single : A 665 MET CE :methyl -125:sc= -2.79! (180deg=-5.82!) USER MOD Single : A 666 LYS NZ :NH3+ -163:sc= -0.0697 (180deg=-0.397) USER MOD Single : A 669 ASN : amide:sc= -2.11 K(o=-2.1,f=-0.48) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 672 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.52) USER MOD Single : A 679 THR OG1 : rot -173:sc= 0.865 USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD Single : A 690 THR OG1 : rot -38:sc= 0.286 USER MOD Single : A 699 HIS : no HE2:sc= 0.458 K(o=0.46,f=-2.5!) USER MOD Single : A 703 GLN : amide:sc= -3.32! K(o=-3.3!,f=-1.3) USER MOD Single : A 705 SER OG : rot 43:sc= 0.0133 USER MOD Single : A 706 SER OG : rot 180:sc= 0 USER MOD Single : A 709 TYR OH : rot 30:sc= -0.204! USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 180:sc= -0.0176 USER MOD Single : A 714 SER OG : rot 180:sc= 0 USER MOD Single : A 718 ASN : amide:sc=-0.00481 X(o=-0.0048,f=0) USER MOD Single : A 720 SER OG : rot 89:sc= 0.391 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 724 THR OG1 : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl -114:sc= -2.95! (180deg=-3.35!) USER MOD Single : A 730 SER OG : rot 180:sc=1.69e-05 USER MOD Single : A 732 THR OG1 : rot 180:sc= 0 USER MOD Single : A 735 HIS : no HD1:sc= -1.16 K(o=-1.2,f=0) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 103 N SER A 629 26.981 -8.693 0.025 1.00 0.00 N ATOM 104 CA SER A 629 25.887 -9.151 0.863 1.00 0.00 C ATOM 105 C SER A 629 25.249 -8.047 1.695 1.00 0.00 C ATOM 106 O SER A 629 25.832 -7.538 2.657 1.00 0.00 O ATOM 107 CB SER A 629 26.249 -10.356 1.730 1.00 0.00 C ATOM 108 OG SER A 629 26.604 -11.500 0.933 1.00 0.00 O ATOM 0 HA SER A 629 25.131 -9.484 0.152 1.00 0.00 H new ATOM 0 HB2 SER A 629 27.081 -10.096 2.384 1.00 0.00 H new ATOM 0 HB3 SER A 629 25.405 -10.608 2.372 1.00 0.00 H new ATOM 0 HG SER A 629 26.973 -11.200 0.076 1.00 0.00 H new ATOM 114 N CYS A 630 24.067 -7.654 1.291 1.00 0.00 N ATOM 115 CA CYS A 630 23.278 -6.726 2.066 1.00 0.00 C ATOM 116 C CYS A 630 22.470 -7.516 3.088 1.00 0.00 C ATOM 117 O CYS A 630 22.193 -8.736 2.882 1.00 0.00 O ATOM 118 CB CYS A 630 22.311 -5.930 1.181 1.00 0.00 C ATOM 119 SG CYS A 630 23.070 -5.050 -0.217 1.00 0.00 S ATOM 0 H CYS A 630 23.627 -7.964 0.425 1.00 0.00 H new ATOM 0 HA CYS A 630 23.952 -6.021 2.552 1.00 0.00 H new ATOM 0 HB2 CYS A 630 21.557 -6.614 0.791 1.00 0.00 H new ATOM 0 HB3 CYS A 630 21.790 -5.204 1.805 1.00 0.00 H new ATOM 124 N GLY A 631 22.093 -6.866 4.156 1.00 0.00 N ATOM 125 CA GLY A 631 21.315 -7.478 5.156 1.00 0.00 C ATOM 126 C GLY A 631 19.933 -6.902 5.126 1.00 0.00 C ATOM 127 O GLY A 631 19.371 -6.740 4.045 1.00 0.00 O ATOM 0 H GLY A 631 22.327 -5.891 4.342 1.00 0.00 H new ATOM 0 HA2 GLY A 631 21.276 -8.555 4.995 1.00 0.00 H new ATOM 0 HA3 GLY A 631 21.768 -7.318 6.135 1.00 0.00 H new ATOM 131 N PRO A 632 19.368 -6.558 6.280 1.00 0.00 N ATOM 132 CA PRO A 632 18.026 -5.985 6.366 1.00 0.00 C ATOM 133 C PRO A 632 17.892 -4.688 5.553 1.00 0.00 C ATOM 134 O PRO A 632 18.837 -3.897 5.472 1.00 0.00 O ATOM 135 CB PRO A 632 17.852 -5.690 7.852 1.00 0.00 C ATOM 136 CG PRO A 632 18.863 -6.530 8.541 1.00 0.00 C ATOM 137 CD PRO A 632 20.002 -6.676 7.597 1.00 0.00 C ATOM 0 HA PRO A 632 17.274 -6.662 5.961 1.00 0.00 H new ATOM 0 HB2 PRO A 632 18.010 -4.632 8.064 1.00 0.00 H new ATOM 0 HB3 PRO A 632 16.844 -5.935 8.186 1.00 0.00 H new ATOM 0 HG2 PRO A 632 19.187 -6.063 9.471 1.00 0.00 H new ATOM 0 HG3 PRO A 632 18.447 -7.503 8.801 1.00 0.00 H new ATOM 0 HD2 PRO A 632 20.754 -5.902 7.752 1.00 0.00 H new ATOM 0 HD3 PRO A 632 20.503 -7.636 7.717 1.00 0.00 H new ATOM 145 N PRO A 633 16.729 -4.472 4.938 1.00 0.00 N ATOM 146 CA PRO A 633 16.474 -3.283 4.137 1.00 0.00 C ATOM 147 C PRO A 633 16.492 -1.989 4.972 1.00 0.00 C ATOM 148 O PRO A 633 16.196 -2.004 6.176 1.00 0.00 O ATOM 149 CB PRO A 633 15.069 -3.521 3.574 1.00 0.00 C ATOM 150 CG PRO A 633 14.452 -4.505 4.494 1.00 0.00 C ATOM 151 CD PRO A 633 15.570 -5.374 4.964 1.00 0.00 C ATOM 0 HA PRO A 633 17.241 -3.145 3.375 1.00 0.00 H new ATOM 0 HB2 PRO A 633 14.494 -2.595 3.542 1.00 0.00 H new ATOM 0 HB3 PRO A 633 15.111 -3.905 2.555 1.00 0.00 H new ATOM 0 HG2 PRO A 633 13.965 -4.006 5.332 1.00 0.00 H new ATOM 0 HG3 PRO A 633 13.688 -5.092 3.985 1.00 0.00 H new ATOM 0 HD2 PRO A 633 15.384 -5.763 5.965 1.00 0.00 H new ATOM 0 HD3 PRO A 633 15.714 -6.234 4.310 1.00 0.00 H new ATOM 159 N PRO A 634 16.869 -0.879 4.334 1.00 0.00 N ATOM 160 CA PRO A 634 16.892 0.449 4.954 1.00 0.00 C ATOM 161 C PRO A 634 15.477 1.002 5.242 1.00 0.00 C ATOM 162 O PRO A 634 14.472 0.294 5.071 1.00 0.00 O ATOM 163 CB PRO A 634 17.603 1.324 3.919 1.00 0.00 C ATOM 164 CG PRO A 634 17.560 0.573 2.637 1.00 0.00 C ATOM 165 CD PRO A 634 17.339 -0.861 2.951 1.00 0.00 C ATOM 0 HA PRO A 634 17.388 0.424 5.924 1.00 0.00 H new ATOM 0 HB2 PRO A 634 17.108 2.290 3.820 1.00 0.00 H new ATOM 0 HB3 PRO A 634 18.632 1.523 4.219 1.00 0.00 H new ATOM 0 HG2 PRO A 634 16.760 0.951 2.001 1.00 0.00 H new ATOM 0 HG3 PRO A 634 18.492 0.703 2.088 1.00 0.00 H new ATOM 0 HD2 PRO A 634 16.604 -1.303 2.279 1.00 0.00 H new ATOM 0 HD3 PRO A 634 18.259 -1.435 2.840 1.00 0.00 H new ATOM 173 N GLU A 635 15.398 2.252 5.670 1.00 0.00 N ATOM 174 CA GLU A 635 14.113 2.842 5.999 1.00 0.00 C ATOM 175 C GLU A 635 13.644 3.733 4.859 1.00 0.00 C ATOM 176 O GLU A 635 14.469 4.371 4.181 1.00 0.00 O ATOM 177 CB GLU A 635 14.191 3.664 7.298 1.00 0.00 C ATOM 178 CG GLU A 635 14.869 5.006 7.131 1.00 0.00 C ATOM 179 CD GLU A 635 15.106 5.722 8.427 1.00 0.00 C ATOM 180 OE1 GLU A 635 14.234 6.509 8.860 1.00 0.00 O ATOM 181 OE2 GLU A 635 16.181 5.552 9.030 1.00 0.00 O ATOM 0 H GLU A 635 16.199 2.871 5.796 1.00 0.00 H new ATOM 0 HA GLU A 635 13.400 2.031 6.149 1.00 0.00 H new ATOM 0 HB2 GLU A 635 13.182 3.822 7.678 1.00 0.00 H new ATOM 0 HB3 GLU A 635 14.728 3.087 8.051 1.00 0.00 H new ATOM 0 HG2 GLU A 635 15.824 4.861 6.625 1.00 0.00 H new ATOM 0 HG3 GLU A 635 14.258 5.635 6.484 1.00 0.00 H new ATOM 188 N LEU A 636 12.353 3.803 4.638 1.00 0.00 N ATOM 189 CA LEU A 636 11.856 4.672 3.602 1.00 0.00 C ATOM 190 C LEU A 636 11.653 6.062 4.220 1.00 0.00 C ATOM 191 O LEU A 636 11.279 6.163 5.387 1.00 0.00 O ATOM 192 CB LEU A 636 10.524 4.103 3.014 1.00 0.00 C ATOM 193 CG LEU A 636 9.994 4.668 1.660 1.00 0.00 C ATOM 194 CD1 LEU A 636 8.778 3.943 1.184 1.00 0.00 C ATOM 195 CD2 LEU A 636 9.727 6.129 1.664 1.00 0.00 C ATOM 0 H LEU A 636 11.642 3.281 5.150 1.00 0.00 H new ATOM 0 HA LEU A 636 12.564 4.740 2.776 1.00 0.00 H new ATOM 0 HB2 LEU A 636 10.650 3.027 2.895 1.00 0.00 H new ATOM 0 HB3 LEU A 636 9.744 4.252 3.761 1.00 0.00 H new ATOM 0 HG LEU A 636 10.817 4.497 0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 636 8.446 4.372 0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 636 9.016 2.889 1.041 1.00 0.00 H new ATOM 0 HD13 LEU A 636 7.984 4.039 1.925 1.00 0.00 H new ATOM 0 HD21 LEU A 636 9.362 6.435 0.683 1.00 0.00 H new ATOM 0 HD22 LEU A 636 8.975 6.359 2.419 1.00 0.00 H new ATOM 0 HD23 LEU A 636 10.647 6.666 1.893 1.00 0.00 H new ATOM 207 N LEU A 637 11.967 7.106 3.425 1.00 0.00 N ATOM 208 CA LEU A 637 11.741 8.540 3.742 1.00 0.00 C ATOM 209 C LEU A 637 10.471 8.701 4.580 1.00 0.00 C ATOM 210 O LEU A 637 10.535 8.986 5.766 1.00 0.00 O ATOM 211 CB LEU A 637 11.548 9.312 2.413 1.00 0.00 C ATOM 212 CG LEU A 637 11.599 10.874 2.405 1.00 0.00 C ATOM 213 CD1 LEU A 637 10.673 11.571 3.404 1.00 0.00 C ATOM 214 CD2 LEU A 637 13.018 11.385 2.479 1.00 0.00 C ATOM 0 H LEU A 637 12.400 6.974 2.511 1.00 0.00 H new ATOM 0 HA LEU A 637 12.595 8.925 4.299 1.00 0.00 H new ATOM 0 HB2 LEU A 637 12.310 8.959 1.719 1.00 0.00 H new ATOM 0 HB3 LEU A 637 10.582 9.017 2.003 1.00 0.00 H new ATOM 0 HG LEU A 637 11.185 11.156 1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 637 10.788 12.651 3.314 1.00 0.00 H new ATOM 0 HD12 LEU A 637 9.639 11.297 3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 637 10.931 11.262 4.417 1.00 0.00 H new ATOM 0 HD21 LEU A 637 13.013 12.475 2.471 1.00 0.00 H new ATOM 0 HD22 LEU A 637 13.485 11.031 3.398 1.00 0.00 H new ATOM 0 HD23 LEU A 637 13.582 11.019 1.621 1.00 0.00 H new ATOM 226 N ASN A 638 9.314 8.515 3.966 1.00 0.00 N ATOM 227 CA ASN A 638 8.112 8.640 4.729 1.00 0.00 C ATOM 228 C ASN A 638 7.182 7.479 4.432 1.00 0.00 C ATOM 229 O ASN A 638 5.950 7.605 4.270 1.00 0.00 O ATOM 230 CB ASN A 638 7.397 9.936 4.520 1.00 0.00 C ATOM 231 CG ASN A 638 6.652 10.279 5.794 1.00 0.00 C ATOM 232 OD1 ASN A 638 7.134 11.051 6.613 1.00 0.00 O ATOM 233 ND2 ASN A 638 5.553 9.627 6.016 1.00 0.00 N ATOM 0 H ASN A 638 9.195 8.286 2.979 1.00 0.00 H new ATOM 0 HA ASN A 638 8.414 8.623 5.776 1.00 0.00 H new ATOM 0 HB2 ASN A 638 8.106 10.725 4.271 1.00 0.00 H new ATOM 0 HB3 ASN A 638 6.702 9.856 3.684 1.00 0.00 H new ATOM 0 HD21 ASN A 638 5.057 9.748 6.899 1.00 0.00 H new ATOM 0 HD22 ASN A 638 5.184 8.993 5.307 1.00 0.00 H new ATOM 240 N GLY A 639 7.777 6.402 4.345 1.00 0.00 N ATOM 241 CA GLY A 639 7.140 5.168 4.125 1.00 0.00 C ATOM 242 C GLY A 639 7.685 4.167 5.084 1.00 0.00 C ATOM 243 O GLY A 639 8.113 4.546 6.173 1.00 0.00 O ATOM 0 H GLY A 639 8.791 6.324 4.427 1.00 0.00 H new ATOM 0 HA2 GLY A 639 6.063 5.270 4.258 1.00 0.00 H new ATOM 0 HA3 GLY A 639 7.304 4.836 3.100 1.00 0.00 H new ATOM 247 N ASN A 640 7.728 2.929 4.685 1.00 0.00 N ATOM 248 CA ASN A 640 8.233 1.856 5.522 1.00 0.00 C ATOM 249 C ASN A 640 8.310 0.603 4.663 1.00 0.00 C ATOM 250 O ASN A 640 7.897 0.611 3.494 1.00 0.00 O ATOM 251 CB ASN A 640 7.254 1.597 6.644 1.00 0.00 C ATOM 252 CG ASN A 640 7.722 0.685 7.777 1.00 0.00 C ATOM 253 OD1 ASN A 640 6.906 0.000 8.388 1.00 0.00 O ATOM 254 ND2 ASN A 640 9.000 0.646 8.054 1.00 0.00 N ATOM 0 H ASN A 640 7.413 2.623 3.764 1.00 0.00 H new ATOM 0 HA ASN A 640 9.207 2.120 5.933 1.00 0.00 H new ATOM 0 HB2 ASN A 640 6.973 2.557 7.076 1.00 0.00 H new ATOM 0 HB3 ASN A 640 6.351 1.165 6.213 1.00 0.00 H new ATOM 0 HD21 ASN A 640 9.343 0.035 8.795 1.00 0.00 H new ATOM 0 HD22 ASN A 640 9.654 1.227 7.529 1.00 0.00 H new ATOM 261 N VAL A 641 8.776 -0.454 5.245 1.00 0.00 N ATOM 262 CA VAL A 641 8.979 -1.711 4.588 1.00 0.00 C ATOM 263 C VAL A 641 7.847 -2.646 4.969 1.00 0.00 C ATOM 264 O VAL A 641 7.430 -2.668 6.125 1.00 0.00 O ATOM 265 CB VAL A 641 10.295 -2.307 5.091 1.00 0.00 C ATOM 266 CG1 VAL A 641 10.759 -3.461 4.264 1.00 0.00 C ATOM 267 CG2 VAL A 641 11.316 -1.250 5.178 1.00 0.00 C ATOM 0 H VAL A 641 9.037 -0.469 6.231 1.00 0.00 H new ATOM 0 HA VAL A 641 9.008 -1.577 3.507 1.00 0.00 H new ATOM 0 HB VAL A 641 10.121 -2.712 6.088 1.00 0.00 H new ATOM 0 HG11 VAL A 641 11.697 -3.844 4.667 1.00 0.00 H new ATOM 0 HG12 VAL A 641 10.007 -4.249 4.285 1.00 0.00 H new ATOM 0 HG13 VAL A 641 10.913 -3.133 3.236 1.00 0.00 H new ATOM 0 HG21 VAL A 641 12.252 -1.677 5.537 1.00 0.00 H new ATOM 0 HG22 VAL A 641 11.471 -0.812 4.192 1.00 0.00 H new ATOM 0 HG23 VAL A 641 10.981 -0.477 5.870 1.00 0.00 H new ATOM 277 N LYS A 642 7.332 -3.387 4.010 1.00 0.00 N ATOM 278 CA LYS A 642 6.248 -4.337 4.284 1.00 0.00 C ATOM 279 C LYS A 642 6.824 -5.739 4.397 1.00 0.00 C ATOM 280 O LYS A 642 6.158 -6.684 4.802 1.00 0.00 O ATOM 281 CB LYS A 642 5.218 -4.274 3.164 1.00 0.00 C ATOM 282 CG LYS A 642 5.724 -4.784 1.831 1.00 0.00 C ATOM 283 CD LYS A 642 4.838 -4.334 0.706 1.00 0.00 C ATOM 284 CE LYS A 642 5.007 -2.863 0.446 1.00 0.00 C ATOM 285 NZ LYS A 642 4.163 -2.423 -0.685 1.00 0.00 N ATOM 0 H LYS A 642 7.637 -3.358 3.037 1.00 0.00 H new ATOM 0 HA LYS A 642 5.759 -4.078 5.223 1.00 0.00 H new ATOM 0 HB2 LYS A 642 4.344 -4.856 3.456 1.00 0.00 H new ATOM 0 HB3 LYS A 642 4.889 -3.242 3.045 1.00 0.00 H new ATOM 0 HG2 LYS A 642 6.740 -4.426 1.663 1.00 0.00 H new ATOM 0 HG3 LYS A 642 5.769 -5.873 1.849 1.00 0.00 H new ATOM 0 HD2 LYS A 642 5.076 -4.897 -0.197 1.00 0.00 H new ATOM 0 HD3 LYS A 642 3.797 -4.547 0.950 1.00 0.00 H new ATOM 0 HE2 LYS A 642 4.744 -2.300 1.341 1.00 0.00 H new ATOM 0 HE3 LYS A 642 6.053 -2.647 0.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 4.620 -1.624 -1.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 4.042 -3.210 -1.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 3.232 -2.125 -0.329 1.00 0.00 H new ATOM 299 N GLU A 643 8.066 -5.837 4.023 1.00 0.00 N ATOM 300 CA GLU A 643 8.800 -7.064 4.038 1.00 0.00 C ATOM 301 C GLU A 643 9.533 -7.194 5.340 1.00 0.00 C ATOM 302 O GLU A 643 10.128 -6.221 5.820 1.00 0.00 O ATOM 303 CB GLU A 643 9.800 -7.068 2.881 1.00 0.00 C ATOM 304 CG GLU A 643 9.161 -7.198 1.517 1.00 0.00 C ATOM 305 CD GLU A 643 8.640 -8.591 1.278 1.00 0.00 C ATOM 306 OE1 GLU A 643 7.557 -8.950 1.797 1.00 0.00 O ATOM 307 OE2 GLU A 643 9.322 -9.362 0.576 1.00 0.00 O ATOM 0 H GLU A 643 8.610 -5.041 3.690 1.00 0.00 H new ATOM 0 HA GLU A 643 8.113 -7.903 3.928 1.00 0.00 H new ATOM 0 HB2 GLU A 643 10.380 -6.146 2.913 1.00 0.00 H new ATOM 0 HB3 GLU A 643 10.501 -7.891 3.023 1.00 0.00 H new ATOM 0 HG2 GLU A 643 8.343 -6.483 1.428 1.00 0.00 H new ATOM 0 HG3 GLU A 643 9.890 -6.945 0.748 1.00 0.00 H new ATOM 314 N LYS A 644 9.480 -8.356 5.928 1.00 0.00 N ATOM 315 CA LYS A 644 10.228 -8.582 7.124 1.00 0.00 C ATOM 316 C LYS A 644 11.677 -8.758 6.740 1.00 0.00 C ATOM 317 O LYS A 644 11.989 -9.223 5.618 1.00 0.00 O ATOM 318 CB LYS A 644 9.745 -9.804 7.919 1.00 0.00 C ATOM 319 CG LYS A 644 9.956 -11.143 7.230 1.00 0.00 C ATOM 320 CD LYS A 644 9.680 -12.302 8.175 1.00 0.00 C ATOM 321 CE LYS A 644 10.667 -12.345 9.358 1.00 0.00 C ATOM 322 NZ LYS A 644 12.079 -12.535 8.931 1.00 0.00 N ATOM 0 H LYS A 644 8.932 -9.151 5.600 1.00 0.00 H new ATOM 0 HA LYS A 644 10.089 -7.722 7.779 1.00 0.00 H new ATOM 0 HB2 LYS A 644 10.261 -9.821 8.879 1.00 0.00 H new ATOM 0 HB3 LYS A 644 8.682 -9.684 8.130 1.00 0.00 H new ATOM 0 HG2 LYS A 644 9.300 -11.215 6.362 1.00 0.00 H new ATOM 0 HG3 LYS A 644 10.980 -11.207 6.862 1.00 0.00 H new ATOM 0 HD2 LYS A 644 8.663 -12.221 8.557 1.00 0.00 H new ATOM 0 HD3 LYS A 644 9.739 -13.240 7.622 1.00 0.00 H new ATOM 0 HE2 LYS A 644 10.586 -11.418 9.925 1.00 0.00 H new ATOM 0 HE3 LYS A 644 10.384 -13.155 10.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 12.609 -13.015 9.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 12.106 -13.114 8.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 12.512 -11.609 8.740 1.00 0.00 H new ATOM 336 N THR A 645 12.537 -8.398 7.617 1.00 0.00 N ATOM 337 CA THR A 645 13.930 -8.476 7.375 1.00 0.00 C ATOM 338 C THR A 645 14.396 -9.935 7.372 1.00 0.00 C ATOM 339 O THR A 645 14.054 -10.710 8.264 1.00 0.00 O ATOM 340 CB THR A 645 14.681 -7.661 8.433 1.00 0.00 C ATOM 341 OG1 THR A 645 14.328 -8.133 9.742 1.00 0.00 O ATOM 342 CG2 THR A 645 14.300 -6.193 8.330 1.00 0.00 C ATOM 0 H THR A 645 12.291 -8.035 8.538 1.00 0.00 H new ATOM 0 HA THR A 645 14.147 -8.058 6.392 1.00 0.00 H new ATOM 0 HB THR A 645 15.752 -7.775 8.266 1.00 0.00 H new ATOM 0 HG1 THR A 645 14.158 -9.097 9.707 1.00 0.00 H new ATOM 0 HG21 THR A 645 14.840 -5.623 9.086 1.00 0.00 H new ATOM 0 HG22 THR A 645 14.560 -5.818 7.340 1.00 0.00 H new ATOM 0 HG23 THR A 645 13.227 -6.083 8.490 1.00 0.00 H new ATOM 350 N LYS A 646 15.088 -10.329 6.329 1.00 0.00 N ATOM 351 CA LYS A 646 15.646 -11.679 6.274 1.00 0.00 C ATOM 352 C LYS A 646 17.041 -11.657 6.857 1.00 0.00 C ATOM 353 O LYS A 646 17.588 -12.686 7.232 1.00 0.00 O ATOM 354 CB LYS A 646 15.687 -12.228 4.832 1.00 0.00 C ATOM 355 CG LYS A 646 14.354 -12.146 4.118 1.00 0.00 C ATOM 356 CD LYS A 646 14.341 -12.858 2.756 1.00 0.00 C ATOM 357 CE LYS A 646 15.398 -12.328 1.793 1.00 0.00 C ATOM 358 NZ LYS A 646 15.285 -12.943 0.447 1.00 0.00 N ATOM 0 H LYS A 646 15.282 -9.750 5.512 1.00 0.00 H new ATOM 0 HA LYS A 646 15.002 -12.340 6.854 1.00 0.00 H new ATOM 0 HB2 LYS A 646 16.431 -11.673 4.261 1.00 0.00 H new ATOM 0 HB3 LYS A 646 16.014 -13.267 4.856 1.00 0.00 H new ATOM 0 HG2 LYS A 646 13.583 -12.582 4.754 1.00 0.00 H new ATOM 0 HG3 LYS A 646 14.093 -11.098 3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 646 14.500 -13.925 2.909 1.00 0.00 H new ATOM 0 HD3 LYS A 646 13.356 -12.745 2.303 1.00 0.00 H new ATOM 0 HE2 LYS A 646 15.299 -11.246 1.706 1.00 0.00 H new ATOM 0 HE3 LYS A 646 16.390 -12.526 2.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 15.905 -12.438 -0.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 15.571 -13.942 0.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 14.300 -12.881 0.118 1.00 0.00 H new ATOM 372 N GLU A 647 17.630 -10.450 6.877 1.00 0.00 N ATOM 373 CA GLU A 647 18.987 -10.166 7.412 1.00 0.00 C ATOM 374 C GLU A 647 20.115 -10.758 6.562 1.00 0.00 C ATOM 375 O GLU A 647 21.256 -10.311 6.640 1.00 0.00 O ATOM 376 CB GLU A 647 19.119 -10.563 8.883 1.00 0.00 C ATOM 377 CG GLU A 647 18.135 -9.846 9.787 1.00 0.00 C ATOM 378 CD GLU A 647 18.359 -10.143 11.241 1.00 0.00 C ATOM 379 OE1 GLU A 647 19.250 -9.523 11.849 1.00 0.00 O ATOM 380 OE2 GLU A 647 17.643 -10.982 11.799 1.00 0.00 O ATOM 0 H GLU A 647 17.169 -9.616 6.513 1.00 0.00 H new ATOM 0 HA GLU A 647 19.104 -9.084 7.352 1.00 0.00 H new ATOM 0 HB2 GLU A 647 18.971 -11.639 8.977 1.00 0.00 H new ATOM 0 HB3 GLU A 647 20.133 -10.350 9.220 1.00 0.00 H new ATOM 0 HG2 GLU A 647 18.215 -8.771 9.624 1.00 0.00 H new ATOM 0 HG3 GLU A 647 17.120 -10.135 9.514 1.00 0.00 H new ATOM 387 N GLU A 648 19.802 -11.735 5.767 1.00 0.00 N ATOM 388 CA GLU A 648 20.750 -12.318 4.874 1.00 0.00 C ATOM 389 C GLU A 648 20.140 -12.309 3.497 1.00 0.00 C ATOM 390 O GLU A 648 19.314 -13.153 3.162 1.00 0.00 O ATOM 391 CB GLU A 648 21.123 -13.743 5.305 1.00 0.00 C ATOM 392 CG GLU A 648 22.227 -14.372 4.465 1.00 0.00 C ATOM 393 CD GLU A 648 23.524 -13.598 4.543 1.00 0.00 C ATOM 394 OE1 GLU A 648 24.332 -13.872 5.463 1.00 0.00 O ATOM 395 OE2 GLU A 648 23.763 -12.715 3.694 1.00 0.00 O ATOM 0 H GLU A 648 18.872 -12.152 5.721 1.00 0.00 H new ATOM 0 HA GLU A 648 21.676 -11.742 4.883 1.00 0.00 H new ATOM 0 HB2 GLU A 648 21.439 -13.726 6.348 1.00 0.00 H new ATOM 0 HB3 GLU A 648 20.235 -14.373 5.251 1.00 0.00 H new ATOM 0 HG2 GLU A 648 22.397 -15.395 4.801 1.00 0.00 H new ATOM 0 HG3 GLU A 648 21.902 -14.427 3.426 1.00 0.00 H new ATOM 402 N TYR A 649 20.456 -11.297 2.754 1.00 0.00 N ATOM 403 CA TYR A 649 19.940 -11.149 1.423 1.00 0.00 C ATOM 404 C TYR A 649 21.006 -11.531 0.433 1.00 0.00 C ATOM 405 O TYR A 649 20.870 -12.498 -0.308 1.00 0.00 O ATOM 406 CB TYR A 649 19.452 -9.708 1.194 1.00 0.00 C ATOM 407 CG TYR A 649 18.180 -9.358 1.946 1.00 0.00 C ATOM 408 CD1 TYR A 649 18.144 -9.317 3.330 1.00 0.00 C ATOM 409 CD2 TYR A 649 17.013 -9.069 1.262 1.00 0.00 C ATOM 410 CE1 TYR A 649 16.996 -9.008 4.000 1.00 0.00 C ATOM 411 CE2 TYR A 649 15.856 -8.752 1.933 1.00 0.00 C ATOM 412 CZ TYR A 649 15.857 -8.729 3.306 1.00 0.00 C ATOM 413 OH TYR A 649 14.711 -8.429 3.994 1.00 0.00 O ATOM 0 H TYR A 649 21.080 -10.546 3.050 1.00 0.00 H new ATOM 0 HA TYR A 649 19.084 -11.810 1.286 1.00 0.00 H new ATOM 0 HB2 TYR A 649 20.240 -9.017 1.493 1.00 0.00 H new ATOM 0 HB3 TYR A 649 19.284 -9.558 0.128 1.00 0.00 H new ATOM 0 HD1 TYR A 649 19.042 -9.534 3.890 1.00 0.00 H new ATOM 0 HD2 TYR A 649 17.011 -9.093 0.182 1.00 0.00 H new ATOM 0 HE1 TYR A 649 16.990 -8.985 5.080 1.00 0.00 H new ATOM 0 HE2 TYR A 649 14.954 -8.523 1.385 1.00 0.00 H new ATOM 0 HH TYR A 649 13.985 -8.253 3.360 1.00 0.00 H new ATOM 423 N GLY A 650 22.069 -10.796 0.442 1.00 0.00 N ATOM 424 CA GLY A 650 23.147 -11.091 -0.442 1.00 0.00 C ATOM 425 C GLY A 650 23.262 -10.061 -1.513 1.00 0.00 C ATOM 426 O GLY A 650 23.745 -8.974 -1.262 1.00 0.00 O ATOM 0 H GLY A 650 22.214 -9.990 1.049 1.00 0.00 H new ATOM 0 HA2 GLY A 650 24.079 -11.140 0.121 1.00 0.00 H new ATOM 0 HA3 GLY A 650 22.994 -12.072 -0.892 1.00 0.00 H new ATOM 430 N HIS A 651 22.795 -10.386 -2.677 1.00 0.00 N ATOM 431 CA HIS A 651 22.860 -9.508 -3.814 1.00 0.00 C ATOM 432 C HIS A 651 21.665 -9.772 -4.712 1.00 0.00 C ATOM 433 O HIS A 651 21.095 -10.846 -4.661 1.00 0.00 O ATOM 434 CB HIS A 651 24.187 -9.757 -4.560 1.00 0.00 C ATOM 435 CG HIS A 651 24.369 -9.009 -5.834 1.00 0.00 C ATOM 436 ND1 HIS A 651 24.596 -7.658 -5.891 1.00 0.00 N ATOM 437 CD2 HIS A 651 24.336 -9.440 -7.107 1.00 0.00 C ATOM 438 CE1 HIS A 651 24.690 -7.295 -7.159 1.00 0.00 C ATOM 439 NE2 HIS A 651 24.536 -8.355 -7.907 1.00 0.00 N ATOM 0 H HIS A 651 22.350 -11.283 -2.873 1.00 0.00 H new ATOM 0 HA HIS A 651 22.829 -8.465 -3.500 1.00 0.00 H new ATOM 0 HB2 HIS A 651 25.010 -9.503 -3.892 1.00 0.00 H new ATOM 0 HB3 HIS A 651 24.267 -10.823 -4.773 1.00 0.00 H new ATOM 0 HD2 HIS A 651 24.180 -10.457 -7.435 1.00 0.00 H new ATOM 0 HE1 HIS A 651 24.865 -6.291 -7.516 1.00 0.00 H new ATOM 0 HE2 HIS A 651 24.561 -8.368 -8.927 1.00 0.00 H new ATOM 448 N SER A 652 21.266 -8.761 -5.493 1.00 0.00 N ATOM 449 CA SER A 652 20.174 -8.828 -6.478 1.00 0.00 C ATOM 450 C SER A 652 18.797 -9.039 -5.823 1.00 0.00 C ATOM 451 O SER A 652 17.795 -9.293 -6.489 1.00 0.00 O ATOM 452 CB SER A 652 20.496 -9.815 -7.660 1.00 0.00 C ATOM 453 OG SER A 652 20.834 -11.142 -7.232 1.00 0.00 O ATOM 0 H SER A 652 21.708 -7.842 -5.457 1.00 0.00 H new ATOM 0 HA SER A 652 20.103 -7.846 -6.947 1.00 0.00 H new ATOM 0 HB2 SER A 652 19.633 -9.866 -8.323 1.00 0.00 H new ATOM 0 HB3 SER A 652 21.323 -9.410 -8.244 1.00 0.00 H new ATOM 0 HG SER A 652 20.576 -11.259 -6.294 1.00 0.00 H new ATOM 459 N GLU A 653 18.770 -8.784 -4.539 1.00 0.00 N ATOM 460 CA GLU A 653 17.614 -8.955 -3.692 1.00 0.00 C ATOM 461 C GLU A 653 16.788 -7.699 -3.694 1.00 0.00 C ATOM 462 O GLU A 653 17.345 -6.605 -3.661 1.00 0.00 O ATOM 463 CB GLU A 653 18.103 -9.256 -2.281 1.00 0.00 C ATOM 464 CG GLU A 653 18.712 -10.625 -2.134 1.00 0.00 C ATOM 465 CD GLU A 653 17.671 -11.708 -2.196 1.00 0.00 C ATOM 466 OE1 GLU A 653 17.186 -12.034 -3.296 1.00 0.00 O ATOM 467 OE2 GLU A 653 17.280 -12.221 -1.136 1.00 0.00 O ATOM 0 H GLU A 653 19.586 -8.437 -4.034 1.00 0.00 H new ATOM 0 HA GLU A 653 16.994 -9.774 -4.058 1.00 0.00 H new ATOM 0 HB2 GLU A 653 18.840 -8.507 -1.993 1.00 0.00 H new ATOM 0 HB3 GLU A 653 17.267 -9.163 -1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 653 19.448 -10.782 -2.923 1.00 0.00 H new ATOM 0 HG3 GLU A 653 19.244 -10.686 -1.185 1.00 0.00 H new ATOM 474 N VAL A 654 15.485 -7.848 -3.736 1.00 0.00 N ATOM 475 CA VAL A 654 14.578 -6.710 -3.763 1.00 0.00 C ATOM 476 C VAL A 654 13.656 -6.673 -2.558 1.00 0.00 C ATOM 477 O VAL A 654 13.241 -7.713 -2.025 1.00 0.00 O ATOM 478 CB VAL A 654 13.725 -6.626 -5.058 1.00 0.00 C ATOM 479 CG1 VAL A 654 14.554 -6.174 -6.244 1.00 0.00 C ATOM 480 CG2 VAL A 654 13.071 -7.952 -5.351 1.00 0.00 C ATOM 0 H VAL A 654 15.019 -8.755 -3.753 1.00 0.00 H new ATOM 0 HA VAL A 654 15.237 -5.842 -3.737 1.00 0.00 H new ATOM 0 HB VAL A 654 12.948 -5.880 -4.890 1.00 0.00 H new ATOM 0 HG11 VAL A 654 13.923 -6.127 -7.132 1.00 0.00 H new ATOM 0 HG12 VAL A 654 14.970 -5.187 -6.042 1.00 0.00 H new ATOM 0 HG13 VAL A 654 15.365 -6.882 -6.412 1.00 0.00 H new ATOM 0 HG21 VAL A 654 12.478 -7.872 -6.262 1.00 0.00 H new ATOM 0 HG22 VAL A 654 13.838 -8.715 -5.483 1.00 0.00 H new ATOM 0 HG23 VAL A 654 12.423 -8.230 -4.520 1.00 0.00 H new ATOM 490 N VAL A 655 13.352 -5.480 -2.131 1.00 0.00 N ATOM 491 CA VAL A 655 12.464 -5.248 -1.018 1.00 0.00 C ATOM 492 C VAL A 655 11.408 -4.260 -1.442 1.00 0.00 C ATOM 493 O VAL A 655 11.725 -3.259 -2.099 1.00 0.00 O ATOM 494 CB VAL A 655 13.233 -4.706 0.222 1.00 0.00 C ATOM 495 CG1 VAL A 655 12.277 -4.287 1.324 1.00 0.00 C ATOM 496 CG2 VAL A 655 14.183 -5.760 0.751 1.00 0.00 C ATOM 0 H VAL A 655 13.718 -4.625 -2.550 1.00 0.00 H new ATOM 0 HA VAL A 655 12.005 -6.194 -0.730 1.00 0.00 H new ATOM 0 HB VAL A 655 13.799 -3.830 -0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 655 12.845 -3.913 2.176 1.00 0.00 H new ATOM 0 HG12 VAL A 655 11.618 -3.501 0.955 1.00 0.00 H new ATOM 0 HG13 VAL A 655 11.681 -5.145 1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 655 14.715 -5.368 1.618 1.00 0.00 H new ATOM 0 HG22 VAL A 655 13.618 -6.646 1.041 1.00 0.00 H new ATOM 0 HG23 VAL A 655 14.901 -6.025 -0.025 1.00 0.00 H new ATOM 506 N GLU A 656 10.165 -4.540 -1.098 1.00 0.00 N ATOM 507 CA GLU A 656 9.099 -3.672 -1.457 1.00 0.00 C ATOM 508 C GLU A 656 8.693 -2.804 -0.269 1.00 0.00 C ATOM 509 O GLU A 656 8.532 -3.289 0.869 1.00 0.00 O ATOM 510 CB GLU A 656 7.903 -4.448 -1.988 1.00 0.00 C ATOM 511 CG GLU A 656 6.873 -3.517 -2.582 1.00 0.00 C ATOM 512 CD GLU A 656 5.704 -4.191 -3.229 1.00 0.00 C ATOM 513 OE1 GLU A 656 5.832 -4.652 -4.367 1.00 0.00 O ATOM 514 OE2 GLU A 656 4.622 -4.214 -2.616 1.00 0.00 O ATOM 0 H GLU A 656 9.885 -5.367 -0.570 1.00 0.00 H new ATOM 0 HA GLU A 656 9.454 -3.023 -2.258 1.00 0.00 H new ATOM 0 HB2 GLU A 656 8.234 -5.160 -2.744 1.00 0.00 H new ATOM 0 HB3 GLU A 656 7.453 -5.026 -1.181 1.00 0.00 H new ATOM 0 HG2 GLU A 656 6.503 -2.860 -1.795 1.00 0.00 H new ATOM 0 HG3 GLU A 656 7.362 -2.884 -3.322 1.00 0.00 H new ATOM 521 N TYR A 657 8.543 -1.548 -0.536 1.00 0.00 N ATOM 522 CA TYR A 657 8.178 -0.558 0.427 1.00 0.00 C ATOM 523 C TYR A 657 6.798 -0.044 0.158 1.00 0.00 C ATOM 524 O TYR A 657 6.249 -0.261 -0.920 1.00 0.00 O ATOM 525 CB TYR A 657 9.136 0.613 0.362 1.00 0.00 C ATOM 526 CG TYR A 657 10.493 0.332 0.907 1.00 0.00 C ATOM 527 CD1 TYR A 657 11.423 -0.391 0.194 1.00 0.00 C ATOM 528 CD2 TYR A 657 10.830 0.771 2.161 1.00 0.00 C ATOM 529 CE1 TYR A 657 12.651 -0.657 0.725 1.00 0.00 C ATOM 530 CE2 TYR A 657 12.054 0.510 2.693 1.00 0.00 C ATOM 531 CZ TYR A 657 12.965 -0.201 1.972 1.00 0.00 C ATOM 532 OH TYR A 657 14.190 -0.468 2.500 1.00 0.00 O ATOM 0 H TYR A 657 8.677 -1.166 -1.472 1.00 0.00 H new ATOM 0 HA TYR A 657 8.215 -1.023 1.412 1.00 0.00 H new ATOM 0 HB2 TYR A 657 9.234 0.929 -0.677 1.00 0.00 H new ATOM 0 HB3 TYR A 657 8.704 1.450 0.910 1.00 0.00 H new ATOM 0 HD1 TYR A 657 11.178 -0.751 -0.794 1.00 0.00 H new ATOM 0 HD2 TYR A 657 10.111 1.334 2.737 1.00 0.00 H new ATOM 0 HE1 TYR A 657 13.373 -1.227 0.160 1.00 0.00 H new ATOM 0 HE2 TYR A 657 12.303 0.865 3.682 1.00 0.00 H new ATOM 0 HH TYR A 657 14.157 -0.360 3.473 1.00 0.00 H new ATOM 542 N TYR A 658 6.245 0.611 1.138 1.00 0.00 N ATOM 543 CA TYR A 658 4.968 1.248 1.036 1.00 0.00 C ATOM 544 C TYR A 658 5.110 2.591 1.720 1.00 0.00 C ATOM 545 O TYR A 658 6.025 2.759 2.525 1.00 0.00 O ATOM 546 CB TYR A 658 3.845 0.406 1.705 1.00 0.00 C ATOM 547 CG TYR A 658 3.944 0.212 3.219 1.00 0.00 C ATOM 548 CD1 TYR A 658 4.687 -0.818 3.762 1.00 0.00 C ATOM 549 CD2 TYR A 658 3.270 1.057 4.093 1.00 0.00 C ATOM 550 CE1 TYR A 658 4.760 -1.003 5.129 1.00 0.00 C ATOM 551 CE2 TYR A 658 3.335 0.877 5.458 1.00 0.00 C ATOM 552 CZ TYR A 658 4.082 -0.155 5.971 1.00 0.00 C ATOM 553 OH TYR A 658 4.141 -0.348 7.337 1.00 0.00 O ATOM 0 H TYR A 658 6.683 0.718 2.053 1.00 0.00 H new ATOM 0 HA TYR A 658 4.678 1.357 -0.009 1.00 0.00 H new ATOM 0 HB2 TYR A 658 2.888 0.878 1.484 1.00 0.00 H new ATOM 0 HB3 TYR A 658 3.831 -0.578 1.236 1.00 0.00 H new ATOM 0 HD1 TYR A 658 5.220 -1.490 3.106 1.00 0.00 H new ATOM 0 HD2 TYR A 658 2.683 1.871 3.694 1.00 0.00 H new ATOM 0 HE1 TYR A 658 5.349 -1.812 5.535 1.00 0.00 H new ATOM 0 HE2 TYR A 658 2.802 1.543 6.120 1.00 0.00 H new ATOM 0 HH TYR A 658 5.063 -0.227 7.645 1.00 0.00 H new ATOM 563 N CYS A 659 4.275 3.524 1.410 1.00 0.00 N ATOM 564 CA CYS A 659 4.319 4.829 2.051 1.00 0.00 C ATOM 565 C CYS A 659 3.353 4.869 3.209 1.00 0.00 C ATOM 566 O CYS A 659 2.513 3.981 3.356 1.00 0.00 O ATOM 567 CB CYS A 659 3.966 5.942 1.052 1.00 0.00 C ATOM 568 SG CYS A 659 5.200 6.216 -0.229 1.00 0.00 S ATOM 0 H CYS A 659 3.540 3.422 0.711 1.00 0.00 H new ATOM 0 HA CYS A 659 5.333 4.994 2.415 1.00 0.00 H new ATOM 0 HB2 CYS A 659 3.016 5.698 0.577 1.00 0.00 H new ATOM 0 HB3 CYS A 659 3.818 6.872 1.601 1.00 0.00 H new ATOM 573 N ASN A 660 3.503 5.876 4.051 1.00 0.00 N ATOM 574 CA ASN A 660 2.574 6.116 5.153 1.00 0.00 C ATOM 575 C ASN A 660 1.181 6.334 4.542 1.00 0.00 C ATOM 576 O ASN A 660 1.087 6.809 3.427 1.00 0.00 O ATOM 577 CB ASN A 660 2.978 7.397 5.884 1.00 0.00 C ATOM 578 CG ASN A 660 3.195 7.243 7.382 1.00 0.00 C ATOM 579 OD1 ASN A 660 2.287 7.472 8.168 1.00 0.00 O ATOM 580 ND2 ASN A 660 4.380 6.873 7.781 1.00 0.00 N ATOM 0 H ASN A 660 4.266 6.550 3.995 1.00 0.00 H new ATOM 0 HA ASN A 660 2.581 5.276 5.847 1.00 0.00 H new ATOM 0 HB2 ASN A 660 3.896 7.778 5.437 1.00 0.00 H new ATOM 0 HB3 ASN A 660 2.207 8.150 5.720 1.00 0.00 H new ATOM 0 HD21 ASN A 660 4.573 6.766 8.777 1.00 0.00 H new ATOM 0 HD22 ASN A 660 5.114 6.690 7.097 1.00 0.00 H new ATOM 587 N PRO A 661 0.100 6.107 5.291 1.00 0.00 N ATOM 588 CA PRO A 661 -1.313 6.180 4.771 1.00 0.00 C ATOM 589 C PRO A 661 -1.790 7.612 4.508 1.00 0.00 C ATOM 590 O PRO A 661 -2.969 7.885 4.346 1.00 0.00 O ATOM 591 CB PRO A 661 -2.104 5.587 5.918 1.00 0.00 C ATOM 592 CG PRO A 661 -1.293 5.913 7.124 1.00 0.00 C ATOM 593 CD PRO A 661 0.131 5.786 6.710 1.00 0.00 C ATOM 0 HA PRO A 661 -1.420 5.671 3.813 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -3.102 6.020 5.980 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -2.230 4.511 5.801 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -1.508 6.922 7.477 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -1.523 5.232 7.944 1.00 0.00 H new ATOM 0 HD2 PRO A 661 0.773 6.472 7.263 1.00 0.00 H new ATOM 0 HD3 PRO A 661 0.512 4.780 6.886 1.00 0.00 H new ATOM 601 N ARG A 662 -0.854 8.485 4.482 1.00 0.00 N ATOM 602 CA ARG A 662 -1.058 9.879 4.268 1.00 0.00 C ATOM 603 C ARG A 662 -0.138 10.393 3.184 1.00 0.00 C ATOM 604 O ARG A 662 -0.237 11.522 2.745 1.00 0.00 O ATOM 605 CB ARG A 662 -0.872 10.611 5.582 1.00 0.00 C ATOM 606 CG ARG A 662 0.260 10.069 6.409 1.00 0.00 C ATOM 607 CD ARG A 662 0.217 10.648 7.763 1.00 0.00 C ATOM 608 NE ARG A 662 1.021 9.870 8.710 1.00 0.00 N ATOM 609 CZ ARG A 662 1.138 10.129 10.010 1.00 0.00 C ATOM 610 NH1 ARG A 662 0.612 11.241 10.521 1.00 0.00 N ATOM 611 NH2 ARG A 662 1.790 9.274 10.792 1.00 0.00 N ATOM 0 H ARG A 662 0.127 8.241 4.616 1.00 0.00 H new ATOM 0 HA ARG A 662 -2.075 10.060 3.919 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -0.692 11.667 5.380 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -1.795 10.550 6.158 1.00 0.00 H new ATOM 0 HG2 ARG A 662 0.191 8.983 6.467 1.00 0.00 H new ATOM 0 HG3 ARG A 662 1.213 10.303 5.934 1.00 0.00 H new ATOM 0 HD2 ARG A 662 0.583 11.674 7.732 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -0.816 10.688 8.109 1.00 0.00 H new ATOM 0 HE ARG A 662 1.531 9.066 8.343 1.00 0.00 H new ATOM 0 HH11 ARG A 662 0.118 11.897 9.915 1.00 0.00 H new ATOM 0 HH12 ARG A 662 0.703 11.437 11.518 1.00 0.00 H new ATOM 0 HH21 ARG A 662 2.196 8.427 10.394 1.00 0.00 H new ATOM 0 HH22 ARG A 662 1.884 9.465 11.789 1.00 0.00 H new ATOM 625 N PHE A 663 0.736 9.547 2.742 1.00 0.00 N ATOM 626 CA PHE A 663 1.650 9.877 1.689 1.00 0.00 C ATOM 627 C PHE A 663 1.482 8.901 0.582 1.00 0.00 C ATOM 628 O PHE A 663 1.140 7.736 0.799 1.00 0.00 O ATOM 629 CB PHE A 663 3.109 9.851 2.144 1.00 0.00 C ATOM 630 CG PHE A 663 3.534 10.965 3.049 1.00 0.00 C ATOM 631 CD1 PHE A 663 3.134 11.012 4.357 1.00 0.00 C ATOM 632 CD2 PHE A 663 4.359 11.952 2.573 1.00 0.00 C ATOM 633 CE1 PHE A 663 3.551 12.033 5.186 1.00 0.00 C ATOM 634 CE2 PHE A 663 4.781 12.977 3.378 1.00 0.00 C ATOM 635 CZ PHE A 663 4.379 13.021 4.694 1.00 0.00 C ATOM 0 H PHE A 663 0.839 8.599 3.103 1.00 0.00 H new ATOM 0 HA PHE A 663 1.421 10.893 1.366 1.00 0.00 H new ATOM 0 HB2 PHE A 663 3.293 8.905 2.654 1.00 0.00 H new ATOM 0 HB3 PHE A 663 3.745 9.866 1.259 1.00 0.00 H new ATOM 0 HD1 PHE A 663 2.485 10.241 4.745 1.00 0.00 H new ATOM 0 HD2 PHE A 663 4.682 11.920 1.543 1.00 0.00 H new ATOM 0 HE1 PHE A 663 3.230 12.059 6.217 1.00 0.00 H new ATOM 0 HE2 PHE A 663 5.426 13.747 2.982 1.00 0.00 H new ATOM 0 HZ PHE A 663 4.710 13.823 5.337 1.00 0.00 H new ATOM 645 N LEU A 664 1.737 9.345 -0.574 1.00 0.00 N ATOM 646 CA LEU A 664 1.614 8.520 -1.697 1.00 0.00 C ATOM 647 C LEU A 664 2.917 8.262 -2.379 1.00 0.00 C ATOM 648 O LEU A 664 3.794 9.149 -2.452 1.00 0.00 O ATOM 649 CB LEU A 664 0.416 8.855 -2.613 1.00 0.00 C ATOM 650 CG LEU A 664 0.019 10.321 -2.928 1.00 0.00 C ATOM 651 CD1 LEU A 664 -0.365 11.138 -1.707 1.00 0.00 C ATOM 652 CD2 LEU A 664 1.013 11.015 -3.784 1.00 0.00 C ATOM 0 H LEU A 664 2.040 10.299 -0.773 1.00 0.00 H new ATOM 0 HA LEU A 664 1.328 7.540 -1.315 1.00 0.00 H new ATOM 0 HB2 LEU A 664 0.602 8.365 -3.569 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -0.460 8.377 -2.175 1.00 0.00 H new ATOM 0 HG LEU A 664 -0.897 10.239 -3.514 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -0.629 12.150 -2.015 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -1.219 10.675 -1.213 1.00 0.00 H new ATOM 0 HD13 LEU A 664 0.477 11.177 -1.016 1.00 0.00 H new ATOM 0 HD21 LEU A 664 0.682 12.037 -3.971 1.00 0.00 H new ATOM 0 HD22 LEU A 664 1.979 11.033 -3.279 1.00 0.00 H new ATOM 0 HD23 LEU A 664 1.109 10.486 -4.732 1.00 0.00 H new ATOM 664 N MET A 665 3.081 7.014 -2.758 1.00 0.00 N ATOM 665 CA MET A 665 4.297 6.498 -3.339 1.00 0.00 C ATOM 666 C MET A 665 4.658 7.190 -4.638 1.00 0.00 C ATOM 667 O MET A 665 3.947 7.086 -5.639 1.00 0.00 O ATOM 668 CB MET A 665 4.198 4.982 -3.542 1.00 0.00 C ATOM 669 CG MET A 665 5.451 4.353 -4.142 1.00 0.00 C ATOM 670 SD MET A 665 6.925 4.546 -3.102 1.00 0.00 S ATOM 671 CE MET A 665 6.467 3.548 -1.674 1.00 0.00 C ATOM 0 H MET A 665 2.348 6.310 -2.667 1.00 0.00 H new ATOM 0 HA MET A 665 5.101 6.708 -2.634 1.00 0.00 H new ATOM 0 HB2 MET A 665 3.991 4.510 -2.581 1.00 0.00 H new ATOM 0 HB3 MET A 665 3.350 4.767 -4.192 1.00 0.00 H new ATOM 0 HG2 MET A 665 5.271 3.291 -4.310 1.00 0.00 H new ATOM 0 HG3 MET A 665 5.642 4.802 -5.117 1.00 0.00 H new ATOM 0 HE1 MET A 665 6.546 4.150 -0.769 1.00 0.00 H new ATOM 0 HE2 MET A 665 5.441 3.198 -1.788 1.00 0.00 H new ATOM 0 HE3 MET A 665 7.136 2.691 -1.599 1.00 0.00 H new ATOM 681 N LYS A 666 5.750 7.897 -4.607 1.00 0.00 N ATOM 682 CA LYS A 666 6.243 8.596 -5.760 1.00 0.00 C ATOM 683 C LYS A 666 7.408 7.815 -6.361 1.00 0.00 C ATOM 684 O LYS A 666 7.604 7.789 -7.580 1.00 0.00 O ATOM 685 CB LYS A 666 6.727 9.980 -5.348 1.00 0.00 C ATOM 686 CG LYS A 666 7.199 10.815 -6.506 1.00 0.00 C ATOM 687 CD LYS A 666 7.870 12.073 -6.043 1.00 0.00 C ATOM 688 CE LYS A 666 8.335 12.896 -7.228 1.00 0.00 C ATOM 689 NZ LYS A 666 9.291 12.162 -8.082 1.00 0.00 N ATOM 0 H LYS A 666 6.329 8.006 -3.774 1.00 0.00 H new ATOM 0 HA LYS A 666 5.445 8.693 -6.496 1.00 0.00 H new ATOM 0 HB2 LYS A 666 5.918 10.503 -4.838 1.00 0.00 H new ATOM 0 HB3 LYS A 666 7.540 9.874 -4.630 1.00 0.00 H new ATOM 0 HG2 LYS A 666 7.893 10.235 -7.115 1.00 0.00 H new ATOM 0 HG3 LYS A 666 6.351 11.068 -7.143 1.00 0.00 H new ATOM 0 HD2 LYS A 666 7.179 12.658 -5.436 1.00 0.00 H new ATOM 0 HD3 LYS A 666 8.721 11.825 -5.409 1.00 0.00 H new ATOM 0 HE2 LYS A 666 7.471 13.190 -7.824 1.00 0.00 H new ATOM 0 HE3 LYS A 666 8.802 13.813 -6.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 9.795 12.834 -8.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 9.977 11.659 -7.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 8.776 11.476 -8.669 1.00 0.00 H new ATOM 703 N GLY A 667 8.160 7.172 -5.490 1.00 0.00 N ATOM 704 CA GLY A 667 9.337 6.434 -5.906 1.00 0.00 C ATOM 705 C GLY A 667 9.019 5.087 -6.546 1.00 0.00 C ATOM 706 O GLY A 667 7.854 4.754 -6.757 1.00 0.00 O ATOM 0 H GLY A 667 7.977 7.145 -4.487 1.00 0.00 H new ATOM 0 HA2 GLY A 667 9.903 7.039 -6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 667 9.979 6.273 -5.040 1.00 0.00 H new ATOM 710 N PRO A 668 10.050 4.261 -6.826 1.00 0.00 N ATOM 711 CA PRO A 668 9.879 2.952 -7.506 1.00 0.00 C ATOM 712 C PRO A 668 9.322 1.867 -6.575 1.00 0.00 C ATOM 713 O PRO A 668 9.081 0.740 -6.999 1.00 0.00 O ATOM 714 CB PRO A 668 11.315 2.595 -7.909 1.00 0.00 C ATOM 715 CG PRO A 668 12.163 3.237 -6.861 1.00 0.00 C ATOM 716 CD PRO A 668 11.484 4.539 -6.540 1.00 0.00 C ATOM 0 HA PRO A 668 9.170 3.012 -8.332 1.00 0.00 H new ATOM 0 HB2 PRO A 668 11.464 1.516 -7.935 1.00 0.00 H new ATOM 0 HB3 PRO A 668 11.555 2.974 -8.902 1.00 0.00 H new ATOM 0 HG2 PRO A 668 12.239 2.605 -5.976 1.00 0.00 H new ATOM 0 HG3 PRO A 668 13.178 3.402 -7.223 1.00 0.00 H new ATOM 0 HD2 PRO A 668 11.638 4.826 -5.500 1.00 0.00 H new ATOM 0 HD3 PRO A 668 11.866 5.354 -7.156 1.00 0.00 H new ATOM 724 N ASN A 669 9.196 2.233 -5.300 1.00 0.00 N ATOM 725 CA ASN A 669 8.695 1.414 -4.150 1.00 0.00 C ATOM 726 C ASN A 669 9.440 0.093 -3.899 1.00 0.00 C ATOM 727 O ASN A 669 9.178 -0.575 -2.922 1.00 0.00 O ATOM 728 CB ASN A 669 7.156 1.198 -4.135 1.00 0.00 C ATOM 729 CG ASN A 669 6.623 0.104 -5.034 1.00 0.00 C ATOM 730 OD1 ASN A 669 6.308 0.318 -6.193 1.00 0.00 O ATOM 731 ND2 ASN A 669 6.466 -1.056 -4.486 1.00 0.00 N ATOM 0 H ASN A 669 9.455 3.173 -5.001 1.00 0.00 H new ATOM 0 HA ASN A 669 8.939 2.057 -3.304 1.00 0.00 H new ATOM 0 HB2 ASN A 669 6.851 0.978 -3.112 1.00 0.00 H new ATOM 0 HB3 ASN A 669 6.676 2.136 -4.416 1.00 0.00 H new ATOM 0 HD21 ASN A 669 6.068 -1.825 -5.025 1.00 0.00 H new ATOM 0 HD22 ASN A 669 6.740 -1.202 -3.514 1.00 0.00 H new ATOM 738 N LYS A 670 10.346 -0.263 -4.753 1.00 0.00 N ATOM 739 CA LYS A 670 11.126 -1.471 -4.623 1.00 0.00 C ATOM 740 C LYS A 670 12.562 -1.165 -4.854 1.00 0.00 C ATOM 741 O LYS A 670 12.909 -0.424 -5.789 1.00 0.00 O ATOM 742 CB LYS A 670 10.611 -2.549 -5.581 1.00 0.00 C ATOM 743 CG LYS A 670 9.316 -3.177 -5.100 1.00 0.00 C ATOM 744 CD LYS A 670 8.641 -4.036 -6.143 1.00 0.00 C ATOM 745 CE LYS A 670 8.062 -3.188 -7.255 1.00 0.00 C ATOM 746 NZ LYS A 670 7.304 -3.999 -8.226 1.00 0.00 N ATOM 0 H LYS A 670 10.576 0.285 -5.582 1.00 0.00 H new ATOM 0 HA LYS A 670 11.022 -1.864 -3.612 1.00 0.00 H new ATOM 0 HB2 LYS A 670 10.455 -2.111 -6.567 1.00 0.00 H new ATOM 0 HB3 LYS A 670 11.369 -3.325 -5.693 1.00 0.00 H new ATOM 0 HG2 LYS A 670 9.521 -3.784 -4.218 1.00 0.00 H new ATOM 0 HG3 LYS A 670 8.631 -2.387 -4.792 1.00 0.00 H new ATOM 0 HD2 LYS A 670 9.360 -4.743 -6.557 1.00 0.00 H new ATOM 0 HD3 LYS A 670 7.848 -4.623 -5.678 1.00 0.00 H new ATOM 0 HE2 LYS A 670 7.408 -2.427 -6.829 1.00 0.00 H new ATOM 0 HE3 LYS A 670 8.868 -2.664 -7.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 6.924 -3.382 -8.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 7.934 -4.709 -8.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 6.520 -4.479 -7.740 1.00 0.00 H new ATOM 760 N ILE A 671 13.390 -1.675 -3.997 1.00 0.00 N ATOM 761 CA ILE A 671 14.802 -1.436 -4.074 1.00 0.00 C ATOM 762 C ILE A 671 15.502 -2.743 -4.205 1.00 0.00 C ATOM 763 O ILE A 671 14.909 -3.787 -3.946 1.00 0.00 O ATOM 764 CB ILE A 671 15.358 -0.687 -2.843 1.00 0.00 C ATOM 765 CG1 ILE A 671 15.205 -1.528 -1.579 1.00 0.00 C ATOM 766 CG2 ILE A 671 14.651 0.641 -2.683 1.00 0.00 C ATOM 767 CD1 ILE A 671 15.863 -0.920 -0.369 1.00 0.00 C ATOM 0 H ILE A 671 13.107 -2.272 -3.220 1.00 0.00 H new ATOM 0 HA ILE A 671 14.977 -0.799 -4.941 1.00 0.00 H new ATOM 0 HB ILE A 671 16.421 -0.505 -3.000 1.00 0.00 H new ATOM 0 HG12 ILE A 671 14.144 -1.670 -1.373 1.00 0.00 H new ATOM 0 HG13 ILE A 671 15.630 -2.516 -1.756 1.00 0.00 H new ATOM 0 HG21 ILE A 671 15.049 1.163 -1.813 1.00 0.00 H new ATOM 0 HG22 ILE A 671 14.811 1.248 -3.574 1.00 0.00 H new ATOM 0 HG23 ILE A 671 13.583 0.471 -2.547 1.00 0.00 H new ATOM 0 HD11 ILE A 671 15.714 -1.571 0.492 1.00 0.00 H new ATOM 0 HD12 ILE A 671 16.931 -0.803 -0.555 1.00 0.00 H new ATOM 0 HD13 ILE A 671 15.421 0.056 -0.166 1.00 0.00 H new ATOM 779 N GLN A 672 16.740 -2.691 -4.550 1.00 0.00 N ATOM 780 CA GLN A 672 17.506 -3.851 -4.807 1.00 0.00 C ATOM 781 C GLN A 672 18.902 -3.690 -4.299 1.00 0.00 C ATOM 782 O GLN A 672 19.476 -2.617 -4.351 1.00 0.00 O ATOM 783 CB GLN A 672 17.472 -4.151 -6.299 1.00 0.00 C ATOM 784 CG GLN A 672 18.374 -5.254 -6.762 1.00 0.00 C ATOM 785 CD GLN A 672 18.156 -5.576 -8.218 1.00 0.00 C ATOM 786 OE1 GLN A 672 17.813 -4.709 -9.018 1.00 0.00 O ATOM 787 NE2 GLN A 672 18.293 -6.815 -8.564 1.00 0.00 N ATOM 0 H GLN A 672 17.257 -1.819 -4.663 1.00 0.00 H new ATOM 0 HA GLN A 672 17.076 -4.700 -4.275 1.00 0.00 H new ATOM 0 HB2 GLN A 672 16.449 -4.403 -6.577 1.00 0.00 H new ATOM 0 HB3 GLN A 672 17.734 -3.242 -6.840 1.00 0.00 H new ATOM 0 HG2 GLN A 672 19.413 -4.965 -6.605 1.00 0.00 H new ATOM 0 HG3 GLN A 672 18.197 -6.146 -6.161 1.00 0.00 H new ATOM 0 HE21 GLN A 672 18.579 -7.509 -7.873 1.00 0.00 H new ATOM 0 HE22 GLN A 672 18.115 -7.098 -9.528 1.00 0.00 H new ATOM 796 N CYS A 673 19.402 -4.738 -3.748 1.00 0.00 N ATOM 797 CA CYS A 673 20.743 -4.768 -3.266 1.00 0.00 C ATOM 798 C CYS A 673 21.691 -4.993 -4.412 1.00 0.00 C ATOM 799 O CYS A 673 21.734 -6.097 -4.998 1.00 0.00 O ATOM 800 CB CYS A 673 20.912 -5.864 -2.225 1.00 0.00 C ATOM 801 SG CYS A 673 22.662 -6.239 -1.808 1.00 0.00 S ATOM 0 H CYS A 673 18.889 -5.610 -3.616 1.00 0.00 H new ATOM 0 HA CYS A 673 20.968 -3.810 -2.797 1.00 0.00 H new ATOM 0 HB2 CYS A 673 20.388 -5.570 -1.316 1.00 0.00 H new ATOM 0 HB3 CYS A 673 20.434 -6.773 -2.589 1.00 0.00 H new ATOM 806 N VAL A 674 22.424 -3.970 -4.765 1.00 0.00 N ATOM 807 CA VAL A 674 23.421 -4.119 -5.803 1.00 0.00 C ATOM 808 C VAL A 674 24.709 -4.585 -5.150 1.00 0.00 C ATOM 809 O VAL A 674 24.688 -5.071 -4.028 1.00 0.00 O ATOM 810 CB VAL A 674 23.653 -2.828 -6.638 1.00 0.00 C ATOM 811 CG1 VAL A 674 22.382 -2.411 -7.351 1.00 0.00 C ATOM 812 CG2 VAL A 674 24.200 -1.700 -5.788 1.00 0.00 C ATOM 0 H VAL A 674 22.355 -3.037 -4.359 1.00 0.00 H new ATOM 0 HA VAL A 674 23.058 -4.855 -6.521 1.00 0.00 H new ATOM 0 HB VAL A 674 24.406 -3.056 -7.392 1.00 0.00 H new ATOM 0 HG11 VAL A 674 22.569 -1.506 -7.928 1.00 0.00 H new ATOM 0 HG12 VAL A 674 22.062 -3.209 -8.021 1.00 0.00 H new ATOM 0 HG13 VAL A 674 21.600 -2.218 -6.617 1.00 0.00 H new ATOM 0 HG21 VAL A 674 24.348 -0.816 -6.408 1.00 0.00 H new ATOM 0 HG22 VAL A 674 23.493 -1.470 -4.991 1.00 0.00 H new ATOM 0 HG23 VAL A 674 25.153 -2.002 -5.352 1.00 0.00 H new ATOM 822 N ASP A 675 25.806 -4.515 -5.824 1.00 0.00 N ATOM 823 CA ASP A 675 27.030 -4.971 -5.227 1.00 0.00 C ATOM 824 C ASP A 675 27.717 -3.860 -4.471 1.00 0.00 C ATOM 825 O ASP A 675 28.682 -3.248 -4.929 1.00 0.00 O ATOM 826 CB ASP A 675 27.953 -5.672 -6.223 1.00 0.00 C ATOM 827 CG ASP A 675 28.412 -4.820 -7.398 1.00 0.00 C ATOM 828 OD1 ASP A 675 27.630 -3.998 -7.902 1.00 0.00 O ATOM 829 OD2 ASP A 675 29.561 -5.006 -7.866 1.00 0.00 O ATOM 0 H ASP A 675 25.889 -4.154 -6.774 1.00 0.00 H new ATOM 0 HA ASP A 675 26.764 -5.736 -4.498 1.00 0.00 H new ATOM 0 HB2 ASP A 675 28.834 -6.028 -5.688 1.00 0.00 H new ATOM 0 HB3 ASP A 675 27.439 -6.551 -6.612 1.00 0.00 H new ATOM 834 N GLY A 676 27.133 -3.546 -3.347 1.00 0.00 N ATOM 835 CA GLY A 676 27.672 -2.577 -2.453 1.00 0.00 C ATOM 836 C GLY A 676 26.674 -2.186 -1.417 1.00 0.00 C ATOM 837 O GLY A 676 26.914 -2.326 -0.218 1.00 0.00 O ATOM 0 H GLY A 676 26.259 -3.965 -3.029 1.00 0.00 H new ATOM 0 HA2 GLY A 676 28.563 -2.979 -1.970 1.00 0.00 H new ATOM 0 HA3 GLY A 676 27.984 -1.695 -3.013 1.00 0.00 H new ATOM 841 N GLU A 677 25.550 -1.743 -1.879 1.00 0.00 N ATOM 842 CA GLU A 677 24.493 -1.273 -1.042 1.00 0.00 C ATOM 843 C GLU A 677 23.183 -1.401 -1.806 1.00 0.00 C ATOM 844 O GLU A 677 23.144 -2.035 -2.861 1.00 0.00 O ATOM 845 CB GLU A 677 24.755 0.193 -0.592 1.00 0.00 C ATOM 846 CG GLU A 677 24.765 1.249 -1.700 1.00 0.00 C ATOM 847 CD GLU A 677 25.875 1.089 -2.715 1.00 0.00 C ATOM 848 OE1 GLU A 677 27.021 1.512 -2.456 1.00 0.00 O ATOM 849 OE2 GLU A 677 25.617 0.545 -3.803 1.00 0.00 O ATOM 0 H GLU A 677 25.336 -1.697 -2.875 1.00 0.00 H new ATOM 0 HA GLU A 677 24.439 -1.874 -0.134 1.00 0.00 H new ATOM 0 HB2 GLU A 677 23.993 0.469 0.137 1.00 0.00 H new ATOM 0 HB3 GLU A 677 25.715 0.227 -0.078 1.00 0.00 H new ATOM 0 HG2 GLU A 677 23.808 1.219 -2.221 1.00 0.00 H new ATOM 0 HG3 GLU A 677 24.848 2.235 -1.243 1.00 0.00 H new ATOM 856 N TRP A 678 22.143 -0.824 -1.297 1.00 0.00 N ATOM 857 CA TRP A 678 20.855 -0.882 -1.934 1.00 0.00 C ATOM 858 C TRP A 678 20.724 0.240 -2.969 1.00 0.00 C ATOM 859 O TRP A 678 21.558 1.167 -3.019 1.00 0.00 O ATOM 860 CB TRP A 678 19.759 -0.768 -0.884 1.00 0.00 C ATOM 861 CG TRP A 678 19.701 -1.925 0.080 1.00 0.00 C ATOM 862 CD1 TRP A 678 20.376 -2.069 1.260 1.00 0.00 C ATOM 863 CD2 TRP A 678 18.910 -3.093 -0.069 1.00 0.00 C ATOM 864 NE1 TRP A 678 20.038 -3.266 1.849 1.00 0.00 N ATOM 865 CE2 TRP A 678 19.141 -3.915 1.045 1.00 0.00 C ATOM 866 CE3 TRP A 678 18.028 -3.516 -1.042 1.00 0.00 C ATOM 867 CZ2 TRP A 678 18.510 -5.147 1.199 1.00 0.00 C ATOM 868 CZ3 TRP A 678 17.404 -4.717 -0.904 1.00 0.00 C ATOM 869 CH2 TRP A 678 17.642 -5.533 0.210 1.00 0.00 C ATOM 0 H TRP A 678 22.157 -0.296 -0.425 1.00 0.00 H new ATOM 0 HA TRP A 678 20.754 -1.837 -2.449 1.00 0.00 H new ATOM 0 HB2 TRP A 678 19.907 0.153 -0.320 1.00 0.00 H new ATOM 0 HB3 TRP A 678 18.796 -0.682 -1.388 1.00 0.00 H new ATOM 0 HD1 TRP A 678 21.071 -1.351 1.669 1.00 0.00 H new ATOM 0 HE1 TRP A 678 20.397 -3.612 2.739 1.00 0.00 H new ATOM 0 HE3 TRP A 678 17.834 -2.898 -1.907 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 18.696 -5.771 2.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 16.713 -5.047 -1.666 1.00 0.00 H new ATOM 0 HH2 TRP A 678 17.133 -6.482 0.291 1.00 0.00 H new ATOM 880 N THR A 679 19.712 0.154 -3.794 1.00 0.00 N ATOM 881 CA THR A 679 19.444 1.142 -4.810 1.00 0.00 C ATOM 882 C THR A 679 18.778 2.385 -4.202 1.00 0.00 C ATOM 883 O THR A 679 18.646 2.487 -2.969 1.00 0.00 O ATOM 884 CB THR A 679 18.558 0.532 -5.926 1.00 0.00 C ATOM 885 OG1 THR A 679 17.413 -0.099 -5.340 1.00 0.00 O ATOM 886 CG2 THR A 679 19.327 -0.497 -6.757 1.00 0.00 C ATOM 0 H THR A 679 19.041 -0.614 -3.780 1.00 0.00 H new ATOM 0 HA THR A 679 20.392 1.453 -5.250 1.00 0.00 H new ATOM 0 HB THR A 679 18.248 1.342 -6.586 1.00 0.00 H new ATOM 0 HG1 THR A 679 16.912 -0.578 -6.033 1.00 0.00 H new ATOM 0 HG21 THR A 679 18.673 -0.903 -7.529 1.00 0.00 H new ATOM 0 HG22 THR A 679 20.187 -0.018 -7.225 1.00 0.00 H new ATOM 0 HG23 THR A 679 19.669 -1.305 -6.110 1.00 0.00 H new ATOM 894 N THR A 680 18.406 3.332 -5.037 1.00 0.00 N ATOM 895 CA THR A 680 17.758 4.520 -4.583 1.00 0.00 C ATOM 896 C THR A 680 16.360 4.208 -4.060 1.00 0.00 C ATOM 897 O THR A 680 15.477 3.755 -4.805 1.00 0.00 O ATOM 898 CB THR A 680 17.711 5.595 -5.685 1.00 0.00 C ATOM 899 OG1 THR A 680 19.065 5.872 -6.125 1.00 0.00 O ATOM 900 CG2 THR A 680 17.087 6.885 -5.158 1.00 0.00 C ATOM 0 H THR A 680 18.549 3.290 -6.046 1.00 0.00 H new ATOM 0 HA THR A 680 18.346 4.924 -3.759 1.00 0.00 H new ATOM 0 HB THR A 680 17.104 5.226 -6.512 1.00 0.00 H new ATOM 0 HG1 THR A 680 19.047 6.554 -6.828 1.00 0.00 H new ATOM 0 HG21 THR A 680 17.064 7.630 -5.954 1.00 0.00 H new ATOM 0 HG22 THR A 680 16.071 6.685 -4.819 1.00 0.00 H new ATOM 0 HG23 THR A 680 17.680 7.262 -4.325 1.00 0.00 H new ATOM 908 N LEU A 681 16.202 4.392 -2.769 1.00 0.00 N ATOM 909 CA LEU A 681 14.944 4.183 -2.112 1.00 0.00 C ATOM 910 C LEU A 681 13.876 5.123 -2.600 1.00 0.00 C ATOM 911 O LEU A 681 14.170 6.249 -3.052 1.00 0.00 O ATOM 912 CB LEU A 681 15.045 4.256 -0.592 1.00 0.00 C ATOM 913 CG LEU A 681 15.567 3.017 0.103 1.00 0.00 C ATOM 914 CD1 LEU A 681 17.078 2.921 0.027 1.00 0.00 C ATOM 915 CD2 LEU A 681 15.058 2.979 1.516 1.00 0.00 C ATOM 0 H LEU A 681 16.952 4.693 -2.146 1.00 0.00 H new ATOM 0 HA LEU A 681 14.654 3.166 -2.378 1.00 0.00 H new ATOM 0 HB2 LEU A 681 15.692 5.093 -0.331 1.00 0.00 H new ATOM 0 HB3 LEU A 681 14.056 4.482 -0.193 1.00 0.00 H new ATOM 0 HG LEU A 681 15.189 2.137 -0.417 1.00 0.00 H new ATOM 0 HD11 LEU A 681 17.411 2.018 0.538 1.00 0.00 H new ATOM 0 HD12 LEU A 681 17.388 2.883 -1.017 1.00 0.00 H new ATOM 0 HD13 LEU A 681 17.523 3.794 0.506 1.00 0.00 H new ATOM 0 HD21 LEU A 681 15.435 2.086 2.015 1.00 0.00 H new ATOM 0 HD22 LEU A 681 15.401 3.865 2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 681 13.968 2.958 1.510 1.00 0.00 H new ATOM 927 N PRO A 682 12.617 4.682 -2.524 1.00 0.00 N ATOM 928 CA PRO A 682 11.495 5.465 -2.968 1.00 0.00 C ATOM 929 C PRO A 682 11.261 6.709 -2.144 1.00 0.00 C ATOM 930 O PRO A 682 11.834 6.907 -1.061 1.00 0.00 O ATOM 931 CB PRO A 682 10.313 4.532 -2.823 1.00 0.00 C ATOM 932 CG PRO A 682 10.724 3.557 -1.807 1.00 0.00 C ATOM 933 CD PRO A 682 12.189 3.365 -2.000 1.00 0.00 C ATOM 0 HA PRO A 682 11.662 5.826 -3.983 1.00 0.00 H new ATOM 0 HB2 PRO A 682 9.419 5.073 -2.513 1.00 0.00 H new ATOM 0 HB3 PRO A 682 10.078 4.042 -3.768 1.00 0.00 H new ATOM 0 HG2 PRO A 682 10.506 3.922 -0.803 1.00 0.00 H new ATOM 0 HG3 PRO A 682 10.187 2.616 -1.927 1.00 0.00 H new ATOM 0 HD2 PRO A 682 12.693 3.117 -1.066 1.00 0.00 H new ATOM 0 HD3 PRO A 682 12.404 2.559 -2.702 1.00 0.00 H new ATOM 941 N VAL A 683 10.364 7.485 -2.633 1.00 0.00 N ATOM 942 CA VAL A 683 10.035 8.751 -2.083 1.00 0.00 C ATOM 943 C VAL A 683 8.547 8.772 -1.878 1.00 0.00 C ATOM 944 O VAL A 683 7.791 8.240 -2.706 1.00 0.00 O ATOM 945 CB VAL A 683 10.452 9.915 -3.045 1.00 0.00 C ATOM 946 CG1 VAL A 683 10.118 11.278 -2.455 1.00 0.00 C ATOM 947 CG2 VAL A 683 11.935 9.841 -3.381 1.00 0.00 C ATOM 0 H VAL A 683 9.817 7.247 -3.460 1.00 0.00 H new ATOM 0 HA VAL A 683 10.569 8.898 -1.144 1.00 0.00 H new ATOM 0 HB VAL A 683 9.878 9.793 -3.963 1.00 0.00 H new ATOM 0 HG11 VAL A 683 10.422 12.060 -3.151 1.00 0.00 H new ATOM 0 HG12 VAL A 683 9.044 11.345 -2.280 1.00 0.00 H new ATOM 0 HG13 VAL A 683 10.648 11.406 -1.511 1.00 0.00 H new ATOM 0 HG21 VAL A 683 12.198 10.660 -4.050 1.00 0.00 H new ATOM 0 HG22 VAL A 683 12.520 9.919 -2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 683 12.150 8.891 -3.869 1.00 0.00 H new ATOM 957 N CYS A 684 8.136 9.328 -0.792 1.00 0.00 N ATOM 958 CA CYS A 684 6.753 9.435 -0.463 1.00 0.00 C ATOM 959 C CYS A 684 6.412 10.889 -0.353 1.00 0.00 C ATOM 960 O CYS A 684 7.180 11.663 0.224 1.00 0.00 O ATOM 961 CB CYS A 684 6.479 8.718 0.846 1.00 0.00 C ATOM 962 SG CYS A 684 6.788 6.950 0.787 1.00 0.00 S ATOM 0 H CYS A 684 8.761 9.729 -0.093 1.00 0.00 H new ATOM 0 HA CYS A 684 6.138 8.972 -1.235 1.00 0.00 H new ATOM 0 HB2 CYS A 684 7.098 9.159 1.627 1.00 0.00 H new ATOM 0 HB3 CYS A 684 5.440 8.886 1.130 1.00 0.00 H new ATOM 967 N ILE A 685 5.317 11.273 -0.919 1.00 0.00 N ATOM 968 CA ILE A 685 4.900 12.650 -0.917 1.00 0.00 C ATOM 969 C ILE A 685 3.486 12.742 -0.428 1.00 0.00 C ATOM 970 O ILE A 685 2.690 11.853 -0.677 1.00 0.00 O ATOM 971 CB ILE A 685 5.006 13.298 -2.316 1.00 0.00 C ATOM 972 CG1 ILE A 685 4.260 12.465 -3.363 1.00 0.00 C ATOM 973 CG2 ILE A 685 6.462 13.496 -2.714 1.00 0.00 C ATOM 974 CD1 ILE A 685 4.230 13.092 -4.730 1.00 0.00 C ATOM 0 H ILE A 685 4.677 10.642 -1.401 1.00 0.00 H new ATOM 0 HA ILE A 685 5.570 13.196 -0.252 1.00 0.00 H new ATOM 0 HB ILE A 685 4.534 14.279 -2.269 1.00 0.00 H new ATOM 0 HG12 ILE A 685 4.729 11.484 -3.434 1.00 0.00 H new ATOM 0 HG13 ILE A 685 3.236 12.305 -3.024 1.00 0.00 H new ATOM 0 HG21 ILE A 685 6.510 13.953 -3.702 1.00 0.00 H new ATOM 0 HG22 ILE A 685 6.952 14.146 -1.989 1.00 0.00 H new ATOM 0 HG23 ILE A 685 6.968 12.531 -2.736 1.00 0.00 H new ATOM 0 HD11 ILE A 685 3.685 12.444 -5.416 1.00 0.00 H new ATOM 0 HD12 ILE A 685 3.734 14.061 -4.675 1.00 0.00 H new ATOM 0 HD13 ILE A 685 5.250 13.226 -5.091 1.00 0.00 H new ATOM 986 N VAL A 686 3.187 13.763 0.301 1.00 0.00 N ATOM 987 CA VAL A 686 1.860 13.930 0.809 1.00 0.00 C ATOM 988 C VAL A 686 1.132 14.792 -0.175 1.00 0.00 C ATOM 989 O VAL A 686 1.665 15.798 -0.637 1.00 0.00 O ATOM 990 CB VAL A 686 1.842 14.579 2.249 1.00 0.00 C ATOM 991 CG1 VAL A 686 2.290 16.027 2.237 1.00 0.00 C ATOM 992 CG2 VAL A 686 0.482 14.466 2.904 1.00 0.00 C ATOM 0 H VAL A 686 3.843 14.499 0.562 1.00 0.00 H new ATOM 0 HA VAL A 686 1.380 12.958 0.922 1.00 0.00 H new ATOM 0 HB VAL A 686 2.559 14.009 2.840 1.00 0.00 H new ATOM 0 HG11 VAL A 686 2.259 16.426 3.251 1.00 0.00 H new ATOM 0 HG12 VAL A 686 3.308 16.090 1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 686 1.625 16.608 1.598 1.00 0.00 H new ATOM 0 HG21 VAL A 686 0.515 14.925 3.892 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -0.261 14.977 2.291 1.00 0.00 H new ATOM 0 HG23 VAL A 686 0.211 13.415 3.001 1.00 0.00 H new ATOM 1043 N THR A 690 -7.995 13.876 0.528 1.00 0.00 N ATOM 1044 CA THR A 690 -8.650 12.664 0.976 1.00 0.00 C ATOM 1045 C THR A 690 -9.546 12.019 -0.090 1.00 0.00 C ATOM 1046 O THR A 690 -9.959 12.665 -1.052 1.00 0.00 O ATOM 1047 CB THR A 690 -9.527 12.996 2.201 1.00 0.00 C ATOM 1048 OG1 THR A 690 -10.323 14.168 1.918 1.00 0.00 O ATOM 1049 CG2 THR A 690 -8.683 13.251 3.429 1.00 0.00 C ATOM 0 HA THR A 690 -7.860 11.951 1.213 1.00 0.00 H new ATOM 0 HB THR A 690 -10.172 12.140 2.400 1.00 0.00 H new ATOM 0 HG1 THR A 690 -9.792 14.806 1.396 1.00 0.00 H new ATOM 0 HG21 THR A 690 -9.331 13.482 4.274 1.00 0.00 H new ATOM 0 HG22 THR A 690 -8.093 12.363 3.656 1.00 0.00 H new ATOM 0 HG23 THR A 690 -8.015 14.092 3.243 1.00 0.00 H new ATOM 1057 N CYS A 691 -9.827 10.736 0.101 1.00 0.00 N ATOM 1058 CA CYS A 691 -10.817 10.016 -0.698 1.00 0.00 C ATOM 1059 C CYS A 691 -12.199 10.142 -0.077 1.00 0.00 C ATOM 1060 O CYS A 691 -13.204 9.732 -0.662 1.00 0.00 O ATOM 1061 CB CYS A 691 -10.438 8.534 -0.881 1.00 0.00 C ATOM 1062 SG CYS A 691 -9.281 8.226 -2.248 1.00 0.00 S ATOM 0 H CYS A 691 -9.376 10.163 0.814 1.00 0.00 H new ATOM 0 HA CYS A 691 -10.834 10.473 -1.687 1.00 0.00 H new ATOM 0 HB2 CYS A 691 -9.995 8.167 0.045 1.00 0.00 H new ATOM 0 HB3 CYS A 691 -11.347 7.956 -1.051 1.00 0.00 H new ATOM 1067 N GLY A 692 -12.241 10.687 1.123 1.00 0.00 N ATOM 1068 CA GLY A 692 -13.487 10.912 1.791 1.00 0.00 C ATOM 1069 C GLY A 692 -13.745 9.847 2.799 1.00 0.00 C ATOM 1070 O GLY A 692 -13.465 10.025 3.992 1.00 0.00 O ATOM 0 H GLY A 692 -11.418 10.980 1.649 1.00 0.00 H new ATOM 0 HA2 GLY A 692 -13.472 11.886 2.280 1.00 0.00 H new ATOM 0 HA3 GLY A 692 -14.297 10.933 1.062 1.00 0.00 H new ATOM 1074 N ASP A 693 -14.244 8.739 2.326 1.00 0.00 N ATOM 1075 CA ASP A 693 -14.516 7.582 3.147 1.00 0.00 C ATOM 1076 C ASP A 693 -14.647 6.380 2.220 1.00 0.00 C ATOM 1077 O ASP A 693 -14.359 6.478 1.013 1.00 0.00 O ATOM 1078 CB ASP A 693 -15.801 7.795 4.025 1.00 0.00 C ATOM 1079 CG ASP A 693 -16.033 6.712 5.087 1.00 0.00 C ATOM 1080 OD1 ASP A 693 -15.497 6.821 6.209 1.00 0.00 O ATOM 1081 OD2 ASP A 693 -16.731 5.727 4.809 1.00 0.00 O ATOM 0 H ASP A 693 -14.479 8.608 1.342 1.00 0.00 H new ATOM 0 HA ASP A 693 -13.701 7.414 3.851 1.00 0.00 H new ATOM 0 HB2 ASP A 693 -15.730 8.763 4.521 1.00 0.00 H new ATOM 0 HB3 ASP A 693 -16.671 7.835 3.369 1.00 0.00 H new ATOM 1086 N ILE A 694 -15.025 5.293 2.763 1.00 0.00 N ATOM 1087 CA ILE A 694 -15.233 4.080 2.096 1.00 0.00 C ATOM 1088 C ILE A 694 -16.466 4.149 1.221 1.00 0.00 C ATOM 1089 O ILE A 694 -17.505 4.721 1.603 1.00 0.00 O ATOM 1090 CB ILE A 694 -15.276 2.964 3.166 1.00 0.00 C ATOM 1091 CG1 ILE A 694 -13.855 2.526 3.421 1.00 0.00 C ATOM 1092 CG2 ILE A 694 -16.186 1.788 2.820 1.00 0.00 C ATOM 1093 CD1 ILE A 694 -13.532 2.245 4.853 1.00 0.00 C ATOM 0 H ILE A 694 -15.211 5.226 3.764 1.00 0.00 H new ATOM 0 HA ILE A 694 -14.420 3.857 1.405 1.00 0.00 H new ATOM 0 HB ILE A 694 -15.727 3.373 4.070 1.00 0.00 H new ATOM 0 HG12 ILE A 694 -13.656 1.628 2.836 1.00 0.00 H new ATOM 0 HG13 ILE A 694 -13.180 3.300 3.056 1.00 0.00 H new ATOM 0 HG21 ILE A 694 -16.154 1.054 3.625 1.00 0.00 H new ATOM 0 HG22 ILE A 694 -17.208 2.144 2.693 1.00 0.00 H new ATOM 0 HG23 ILE A 694 -15.846 1.325 1.894 1.00 0.00 H new ATOM 0 HD11 ILE A 694 -12.490 1.937 4.937 1.00 0.00 H new ATOM 0 HD12 ILE A 694 -13.694 3.145 5.446 1.00 0.00 H new ATOM 0 HD13 ILE A 694 -14.177 1.447 5.222 1.00 0.00 H new ATOM 1105 N PRO A 695 -16.334 3.641 0.011 1.00 0.00 N ATOM 1106 CA PRO A 695 -17.405 3.602 -0.947 1.00 0.00 C ATOM 1107 C PRO A 695 -18.400 2.543 -0.575 1.00 0.00 C ATOM 1108 O PRO A 695 -18.269 1.865 0.456 1.00 0.00 O ATOM 1109 CB PRO A 695 -16.705 3.204 -2.241 1.00 0.00 C ATOM 1110 CG PRO A 695 -15.528 2.429 -1.803 1.00 0.00 C ATOM 1111 CD PRO A 695 -15.107 3.033 -0.509 1.00 0.00 C ATOM 0 HA PRO A 695 -17.948 4.545 -1.013 1.00 0.00 H new ATOM 0 HB2 PRO A 695 -17.358 2.607 -2.878 1.00 0.00 H new ATOM 0 HB3 PRO A 695 -16.410 4.080 -2.818 1.00 0.00 H new ATOM 0 HG2 PRO A 695 -15.777 1.375 -1.681 1.00 0.00 H new ATOM 0 HG3 PRO A 695 -14.727 2.484 -2.540 1.00 0.00 H new ATOM 0 HD2 PRO A 695 -14.713 2.280 0.174 1.00 0.00 H new ATOM 0 HD3 PRO A 695 -14.322 3.776 -0.651 1.00 0.00 H new ATOM 1119 N GLU A 696 -19.366 2.373 -1.371 1.00 0.00 N ATOM 1120 CA GLU A 696 -20.292 1.359 -1.089 1.00 0.00 C ATOM 1121 C GLU A 696 -20.301 0.341 -2.170 1.00 0.00 C ATOM 1122 O GLU A 696 -20.459 0.655 -3.359 1.00 0.00 O ATOM 1123 CB GLU A 696 -21.686 1.877 -0.758 1.00 0.00 C ATOM 1124 CG GLU A 696 -22.631 0.762 -0.345 1.00 0.00 C ATOM 1125 CD GLU A 696 -23.946 1.245 0.168 1.00 0.00 C ATOM 1126 OE1 GLU A 696 -24.824 1.601 -0.650 1.00 0.00 O ATOM 1127 OE2 GLU A 696 -24.142 1.250 1.391 1.00 0.00 O ATOM 0 H GLU A 696 -19.541 2.914 -2.218 1.00 0.00 H new ATOM 0 HA GLU A 696 -19.957 0.873 -0.173 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -21.618 2.609 0.046 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -22.095 2.394 -1.626 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -22.803 0.109 -1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -22.151 0.158 0.425 1.00 0.00 H new ATOM 1134 N LEU A 697 -20.060 -0.858 -1.764 1.00 0.00 N ATOM 1135 CA LEU A 697 -20.114 -1.969 -2.621 1.00 0.00 C ATOM 1136 C LEU A 697 -21.558 -2.403 -2.622 1.00 0.00 C ATOM 1137 O LEU A 697 -22.184 -2.401 -1.563 1.00 0.00 O ATOM 1138 CB LEU A 697 -19.206 -3.075 -2.066 1.00 0.00 C ATOM 1139 CG LEU A 697 -19.027 -4.315 -2.930 1.00 0.00 C ATOM 1140 CD1 LEU A 697 -18.448 -3.925 -4.259 1.00 0.00 C ATOM 1141 CD2 LEU A 697 -18.115 -5.315 -2.238 1.00 0.00 C ATOM 0 H LEU A 697 -19.815 -1.088 -0.801 1.00 0.00 H new ATOM 0 HA LEU A 697 -19.773 -1.743 -3.631 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -18.222 -2.645 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -19.604 -3.388 -1.101 1.00 0.00 H new ATOM 0 HG LEU A 697 -20.000 -4.782 -3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -18.321 -4.815 -4.876 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -19.122 -3.230 -4.760 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -17.480 -3.447 -4.108 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -17.997 -6.196 -2.868 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -17.140 -4.859 -2.065 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -18.553 -5.607 -1.284 1.00 0.00 H new ATOM 1153 N GLU A 698 -22.069 -2.754 -3.783 1.00 0.00 N ATOM 1154 CA GLU A 698 -23.474 -3.145 -4.016 1.00 0.00 C ATOM 1155 C GLU A 698 -24.038 -4.051 -2.916 1.00 0.00 C ATOM 1156 O GLU A 698 -25.199 -3.944 -2.536 1.00 0.00 O ATOM 1157 CB GLU A 698 -23.579 -3.880 -5.352 1.00 0.00 C ATOM 1158 CG GLU A 698 -22.767 -5.163 -5.404 1.00 0.00 C ATOM 1159 CD GLU A 698 -23.003 -5.944 -6.644 1.00 0.00 C ATOM 1160 OE1 GLU A 698 -24.018 -6.651 -6.701 1.00 0.00 O ATOM 1161 OE2 GLU A 698 -22.183 -5.899 -7.561 1.00 0.00 O ATOM 0 H GLU A 698 -21.508 -2.781 -4.634 1.00 0.00 H new ATOM 0 HA GLU A 698 -24.060 -2.226 -4.018 1.00 0.00 H new ATOM 0 HB2 GLU A 698 -24.626 -4.114 -5.548 1.00 0.00 H new ATOM 0 HB3 GLU A 698 -23.246 -3.216 -6.150 1.00 0.00 H new ATOM 0 HG2 GLU A 698 -21.707 -4.920 -5.330 1.00 0.00 H new ATOM 0 HG3 GLU A 698 -23.014 -5.779 -4.540 1.00 0.00 H new ATOM 1168 N HIS A 699 -23.201 -4.944 -2.418 1.00 0.00 N ATOM 1169 CA HIS A 699 -23.590 -5.895 -1.412 1.00 0.00 C ATOM 1170 C HIS A 699 -22.407 -6.141 -0.476 1.00 0.00 C ATOM 1171 O HIS A 699 -22.283 -7.200 0.132 1.00 0.00 O ATOM 1172 CB HIS A 699 -24.057 -7.215 -2.075 1.00 0.00 C ATOM 1173 CG HIS A 699 -25.313 -7.098 -2.912 1.00 0.00 C ATOM 1174 ND1 HIS A 699 -25.332 -7.148 -4.301 1.00 0.00 N ATOM 1175 CD2 HIS A 699 -26.601 -6.970 -2.540 1.00 0.00 C ATOM 1176 CE1 HIS A 699 -26.572 -7.059 -4.715 1.00 0.00 C ATOM 1177 NE2 HIS A 699 -27.361 -6.955 -3.675 1.00 0.00 N ATOM 0 H HIS A 699 -22.226 -5.024 -2.708 1.00 0.00 H new ATOM 0 HA HIS A 699 -24.425 -5.500 -0.833 1.00 0.00 H new ATOM 0 HB2 HIS A 699 -23.252 -7.593 -2.705 1.00 0.00 H new ATOM 0 HB3 HIS A 699 -24.226 -7.957 -1.294 1.00 0.00 H new ATOM 0 HD1 HIS A 699 -24.512 -7.239 -4.901 1.00 0.00 H new ATOM 0 HD2 HIS A 699 -26.967 -6.893 -1.527 1.00 0.00 H new ATOM 0 HE1 HIS A 699 -26.892 -7.070 -5.747 1.00 0.00 H new ATOM 1186 N GLY A 700 -21.551 -5.138 -0.363 1.00 0.00 N ATOM 1187 CA GLY A 700 -20.372 -5.234 0.477 1.00 0.00 C ATOM 1188 C GLY A 700 -20.108 -3.944 1.250 1.00 0.00 C ATOM 1189 O GLY A 700 -20.762 -2.922 1.013 1.00 0.00 O ATOM 0 H GLY A 700 -21.653 -4.245 -0.845 1.00 0.00 H new ATOM 0 HA2 GLY A 700 -20.495 -6.058 1.180 1.00 0.00 H new ATOM 0 HA3 GLY A 700 -19.506 -5.469 -0.141 1.00 0.00 H new ATOM 1193 N TRP A 701 -19.137 -3.997 2.133 1.00 0.00 N ATOM 1194 CA TRP A 701 -18.743 -2.938 3.017 1.00 0.00 C ATOM 1195 C TRP A 701 -17.301 -3.180 3.371 1.00 0.00 C ATOM 1196 O TRP A 701 -16.600 -3.803 2.595 1.00 0.00 O ATOM 1197 CB TRP A 701 -19.660 -2.876 4.253 1.00 0.00 C ATOM 1198 CG TRP A 701 -20.120 -4.212 4.758 1.00 0.00 C ATOM 1199 CD1 TRP A 701 -21.221 -4.868 4.349 1.00 0.00 C ATOM 1200 CD2 TRP A 701 -19.509 -5.035 5.747 1.00 0.00 C ATOM 1201 NE1 TRP A 701 -21.347 -6.056 5.011 1.00 0.00 N ATOM 1202 CE2 TRP A 701 -20.310 -6.183 5.886 1.00 0.00 C ATOM 1203 CE3 TRP A 701 -18.373 -4.914 6.522 1.00 0.00 C ATOM 1204 CZ2 TRP A 701 -20.000 -7.202 6.780 1.00 0.00 C ATOM 1205 CZ3 TRP A 701 -18.059 -5.913 7.406 1.00 0.00 C ATOM 1206 CH2 TRP A 701 -18.869 -7.049 7.534 1.00 0.00 C ATOM 0 H TRP A 701 -18.570 -4.836 2.256 1.00 0.00 H new ATOM 0 HA TRP A 701 -18.843 -1.964 2.539 1.00 0.00 H new ATOM 0 HB2 TRP A 701 -19.132 -2.361 5.056 1.00 0.00 H new ATOM 0 HB3 TRP A 701 -20.535 -2.273 4.010 1.00 0.00 H new ATOM 0 HD1 TRP A 701 -21.910 -4.505 3.601 1.00 0.00 H new ATOM 0 HE1 TRP A 701 -22.094 -6.736 4.873 1.00 0.00 H new ATOM 0 HE3 TRP A 701 -17.740 -4.043 6.433 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 -20.626 -8.077 6.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 -17.171 -5.823 8.015 1.00 0.00 H new ATOM 0 HH2 TRP A 701 -18.595 -7.818 8.241 1.00 0.00 H new ATOM 1217 N ALA A 702 -16.858 -2.783 4.514 1.00 0.00 N ATOM 1218 CA ALA A 702 -15.449 -2.806 4.773 1.00 0.00 C ATOM 1219 C ALA A 702 -15.140 -3.226 6.191 1.00 0.00 C ATOM 1220 O ALA A 702 -15.950 -3.017 7.092 1.00 0.00 O ATOM 1221 CB ALA A 702 -14.918 -1.435 4.493 1.00 0.00 C ATOM 0 H ALA A 702 -17.438 -2.441 5.280 1.00 0.00 H new ATOM 0 HA ALA A 702 -14.971 -3.544 4.129 1.00 0.00 H new ATOM 0 HB1 ALA A 702 -13.844 -1.415 4.680 1.00 0.00 H new ATOM 0 HB2 ALA A 702 -15.110 -1.176 3.452 1.00 0.00 H new ATOM 0 HB3 ALA A 702 -15.413 -0.713 5.143 1.00 0.00 H new ATOM 1227 N GLN A 703 -13.969 -3.822 6.391 1.00 0.00 N ATOM 1228 CA GLN A 703 -13.569 -4.234 7.732 1.00 0.00 C ATOM 1229 C GLN A 703 -12.972 -3.054 8.436 1.00 0.00 C ATOM 1230 O GLN A 703 -13.456 -2.615 9.469 1.00 0.00 O ATOM 1231 CB GLN A 703 -12.524 -5.371 7.735 1.00 0.00 C ATOM 1232 CG GLN A 703 -12.959 -6.680 7.109 1.00 0.00 C ATOM 1233 CD GLN A 703 -12.251 -6.953 5.806 1.00 0.00 C ATOM 1234 OE1 GLN A 703 -11.197 -7.568 5.773 1.00 0.00 O ATOM 1235 NE2 GLN A 703 -12.818 -6.486 4.744 1.00 0.00 N ATOM 0 H GLN A 703 -13.291 -4.028 5.657 1.00 0.00 H new ATOM 0 HA GLN A 703 -14.463 -4.607 8.232 1.00 0.00 H new ATOM 0 HB2 GLN A 703 -11.634 -5.020 7.212 1.00 0.00 H new ATOM 0 HB3 GLN A 703 -12.232 -5.565 8.767 1.00 0.00 H new ATOM 0 HG2 GLN A 703 -12.763 -7.496 7.805 1.00 0.00 H new ATOM 0 HG3 GLN A 703 -14.035 -6.659 6.938 1.00 0.00 H new ATOM 0 HE21 GLN A 703 -13.699 -5.978 4.818 1.00 0.00 H new ATOM 0 HE22 GLN A 703 -12.385 -6.625 3.831 1.00 0.00 H new ATOM 1244 N LEU A 704 -11.961 -2.504 7.823 1.00 0.00 N ATOM 1245 CA LEU A 704 -11.226 -1.438 8.410 1.00 0.00 C ATOM 1246 C LEU A 704 -11.501 -0.123 7.716 1.00 0.00 C ATOM 1247 O LEU A 704 -11.732 -0.080 6.502 1.00 0.00 O ATOM 1248 CB LEU A 704 -9.724 -1.793 8.448 1.00 0.00 C ATOM 1249 CG LEU A 704 -9.020 -2.133 7.116 1.00 0.00 C ATOM 1250 CD1 LEU A 704 -8.622 -0.885 6.330 1.00 0.00 C ATOM 1251 CD2 LEU A 704 -7.823 -3.016 7.371 1.00 0.00 C ATOM 0 H LEU A 704 -11.629 -2.788 6.901 1.00 0.00 H new ATOM 0 HA LEU A 704 -11.559 -1.304 9.439 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -9.195 -0.954 8.899 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -9.600 -2.645 9.117 1.00 0.00 H new ATOM 0 HG LEU A 704 -9.736 -2.674 6.497 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -8.131 -1.180 5.403 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -9.513 -0.301 6.099 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -7.938 -0.282 6.927 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -7.335 -3.249 6.425 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -7.121 -2.497 8.024 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -8.148 -3.940 7.849 1.00 0.00 H new ATOM 1263 N SER A 705 -11.506 0.910 8.490 1.00 0.00 N ATOM 1264 CA SER A 705 -11.699 2.242 8.043 1.00 0.00 C ATOM 1265 C SER A 705 -10.809 3.157 8.851 1.00 0.00 C ATOM 1266 O SER A 705 -10.924 3.233 10.078 1.00 0.00 O ATOM 1267 CB SER A 705 -13.163 2.618 8.182 1.00 0.00 C ATOM 1268 OG SER A 705 -13.713 2.153 9.416 1.00 0.00 O ATOM 0 H SER A 705 -11.369 0.841 9.498 1.00 0.00 H new ATOM 0 HA SER A 705 -11.432 2.338 6.991 1.00 0.00 H new ATOM 0 HB2 SER A 705 -13.268 3.701 8.122 1.00 0.00 H new ATOM 0 HB3 SER A 705 -13.728 2.197 7.350 1.00 0.00 H new ATOM 0 HG SER A 705 -13.072 2.311 10.140 1.00 0.00 H new ATOM 1274 N SER A 706 -9.887 3.790 8.200 1.00 0.00 N ATOM 1275 CA SER A 706 -8.956 4.633 8.875 1.00 0.00 C ATOM 1276 C SER A 706 -8.893 6.027 8.234 1.00 0.00 C ATOM 1277 O SER A 706 -8.182 6.246 7.256 1.00 0.00 O ATOM 1278 CB SER A 706 -7.595 3.964 8.865 1.00 0.00 C ATOM 1279 OG SER A 706 -7.658 2.636 9.410 1.00 0.00 O ATOM 0 H SER A 706 -9.759 3.737 7.189 1.00 0.00 H new ATOM 0 HA SER A 706 -9.284 4.776 9.905 1.00 0.00 H new ATOM 0 HB2 SER A 706 -7.216 3.922 7.844 1.00 0.00 H new ATOM 0 HB3 SER A 706 -6.890 4.562 9.442 1.00 0.00 H new ATOM 0 HG SER A 706 -6.766 2.231 9.388 1.00 0.00 H new ATOM 1285 N PRO A 707 -9.705 6.960 8.729 1.00 0.00 N ATOM 1286 CA PRO A 707 -9.687 8.329 8.271 1.00 0.00 C ATOM 1287 C PRO A 707 -8.620 9.153 9.011 1.00 0.00 C ATOM 1288 O PRO A 707 -8.303 8.867 10.176 1.00 0.00 O ATOM 1289 CB PRO A 707 -11.093 8.842 8.582 1.00 0.00 C ATOM 1290 CG PRO A 707 -11.785 7.727 9.333 1.00 0.00 C ATOM 1291 CD PRO A 707 -10.725 6.760 9.750 1.00 0.00 C ATOM 0 HA PRO A 707 -9.435 8.410 7.214 1.00 0.00 H new ATOM 0 HB2 PRO A 707 -11.053 9.751 9.182 1.00 0.00 H new ATOM 0 HB3 PRO A 707 -11.630 9.088 7.666 1.00 0.00 H new ATOM 0 HG2 PRO A 707 -12.315 8.118 10.202 1.00 0.00 H new ATOM 0 HG3 PRO A 707 -12.526 7.238 8.701 1.00 0.00 H new ATOM 0 HD2 PRO A 707 -10.348 6.976 10.750 1.00 0.00 H new ATOM 0 HD3 PRO A 707 -11.092 5.734 9.763 1.00 0.00 H new ATOM 1299 N PRO A 708 -8.053 10.178 8.364 1.00 0.00 N ATOM 1300 CA PRO A 708 -8.416 10.565 7.000 1.00 0.00 C ATOM 1301 C PRO A 708 -7.848 9.604 5.949 1.00 0.00 C ATOM 1302 O PRO A 708 -6.680 9.204 6.015 1.00 0.00 O ATOM 1303 CB PRO A 708 -7.796 11.953 6.862 1.00 0.00 C ATOM 1304 CG PRO A 708 -6.616 11.926 7.761 1.00 0.00 C ATOM 1305 CD PRO A 708 -6.992 11.040 8.912 1.00 0.00 C ATOM 0 HA PRO A 708 -9.493 10.546 6.836 1.00 0.00 H new ATOM 0 HB2 PRO A 708 -7.505 12.157 5.832 1.00 0.00 H new ATOM 0 HB3 PRO A 708 -8.500 12.732 7.154 1.00 0.00 H new ATOM 0 HG2 PRO A 708 -5.739 11.540 7.242 1.00 0.00 H new ATOM 0 HG3 PRO A 708 -6.366 12.929 8.106 1.00 0.00 H new ATOM 0 HD2 PRO A 708 -6.141 10.454 9.260 1.00 0.00 H new ATOM 0 HD3 PRO A 708 -7.349 11.620 9.763 1.00 0.00 H new ATOM 1313 N TYR A 709 -8.680 9.231 5.005 1.00 0.00 N ATOM 1314 CA TYR A 709 -8.272 8.316 3.946 1.00 0.00 C ATOM 1315 C TYR A 709 -7.529 9.111 2.893 1.00 0.00 C ATOM 1316 O TYR A 709 -8.152 9.724 2.012 1.00 0.00 O ATOM 1317 CB TYR A 709 -9.491 7.635 3.286 1.00 0.00 C ATOM 1318 CG TYR A 709 -10.462 7.011 4.245 1.00 0.00 C ATOM 1319 CD1 TYR A 709 -11.457 7.776 4.792 1.00 0.00 C ATOM 1320 CD2 TYR A 709 -10.404 5.664 4.585 1.00 0.00 C ATOM 1321 CE1 TYR A 709 -12.373 7.258 5.647 1.00 0.00 C ATOM 1322 CE2 TYR A 709 -11.332 5.127 5.455 1.00 0.00 C ATOM 1323 CZ TYR A 709 -12.316 5.940 5.983 1.00 0.00 C ATOM 1324 OH TYR A 709 -13.255 5.428 6.837 1.00 0.00 O ATOM 0 H TYR A 709 -9.649 9.544 4.942 1.00 0.00 H new ATOM 0 HA TYR A 709 -7.641 7.540 4.378 1.00 0.00 H new ATOM 0 HB2 TYR A 709 -10.021 8.374 2.685 1.00 0.00 H new ATOM 0 HB3 TYR A 709 -9.133 6.866 2.602 1.00 0.00 H new ATOM 0 HD1 TYR A 709 -11.514 8.823 4.535 1.00 0.00 H new ATOM 0 HD2 TYR A 709 -9.631 5.036 4.167 1.00 0.00 H new ATOM 0 HE1 TYR A 709 -13.146 7.889 6.060 1.00 0.00 H new ATOM 0 HE2 TYR A 709 -11.289 4.081 5.720 1.00 0.00 H new ATOM 0 HH TYR A 709 -14.096 5.919 6.730 1.00 0.00 H new ATOM 1334 N TYR A 710 -6.237 9.176 3.026 1.00 0.00 N ATOM 1335 CA TYR A 710 -5.405 9.896 2.092 1.00 0.00 C ATOM 1336 C TYR A 710 -5.042 9.043 0.913 1.00 0.00 C ATOM 1337 O TYR A 710 -5.172 7.809 0.955 1.00 0.00 O ATOM 1338 CB TYR A 710 -4.127 10.386 2.750 1.00 0.00 C ATOM 1339 CG TYR A 710 -4.220 11.687 3.495 1.00 0.00 C ATOM 1340 CD1 TYR A 710 -5.411 12.178 3.986 1.00 0.00 C ATOM 1341 CD2 TYR A 710 -3.091 12.444 3.673 1.00 0.00 C ATOM 1342 CE1 TYR A 710 -5.455 13.390 4.641 1.00 0.00 C ATOM 1343 CE2 TYR A 710 -3.126 13.633 4.313 1.00 0.00 C ATOM 1344 CZ TYR A 710 -4.302 14.108 4.800 1.00 0.00 C ATOM 1345 OH TYR A 710 -4.326 15.320 5.431 1.00 0.00 O ATOM 0 H TYR A 710 -5.723 8.731 3.787 1.00 0.00 H new ATOM 0 HA TYR A 710 -5.988 10.753 1.754 1.00 0.00 H new ATOM 0 HB2 TYR A 710 -3.783 9.618 3.443 1.00 0.00 H new ATOM 0 HB3 TYR A 710 -3.362 10.486 1.980 1.00 0.00 H new ATOM 0 HD1 TYR A 710 -6.319 11.607 3.856 1.00 0.00 H new ATOM 0 HD2 TYR A 710 -2.149 12.080 3.291 1.00 0.00 H new ATOM 0 HE1 TYR A 710 -6.391 13.769 5.025 1.00 0.00 H new ATOM 0 HE2 TYR A 710 -2.219 14.206 4.438 1.00 0.00 H new ATOM 0 HH TYR A 710 -3.420 15.693 5.458 1.00 0.00 H new ATOM 1355 N TYR A 711 -4.582 9.695 -0.136 1.00 0.00 N ATOM 1356 CA TYR A 711 -4.147 9.014 -1.338 1.00 0.00 C ATOM 1357 C TYR A 711 -2.969 8.121 -0.968 1.00 0.00 C ATOM 1358 O TYR A 711 -2.103 8.508 -0.182 1.00 0.00 O ATOM 1359 CB TYR A 711 -3.753 10.049 -2.412 1.00 0.00 C ATOM 1360 CG TYR A 711 -3.428 9.525 -3.830 1.00 0.00 C ATOM 1361 CD1 TYR A 711 -2.402 8.633 -4.063 1.00 0.00 C ATOM 1362 CD2 TYR A 711 -4.128 9.975 -4.920 1.00 0.00 C ATOM 1363 CE1 TYR A 711 -2.076 8.200 -5.319 1.00 0.00 C ATOM 1364 CE2 TYR A 711 -3.810 9.561 -6.196 1.00 0.00 C ATOM 1365 CZ TYR A 711 -2.788 8.675 -6.393 1.00 0.00 C ATOM 1366 OH TYR A 711 -2.468 8.291 -7.681 1.00 0.00 O ATOM 0 H TYR A 711 -4.499 10.711 -0.179 1.00 0.00 H new ATOM 0 HA TYR A 711 -4.949 8.403 -1.753 1.00 0.00 H new ATOM 0 HB2 TYR A 711 -4.567 10.769 -2.499 1.00 0.00 H new ATOM 0 HB3 TYR A 711 -2.882 10.595 -2.048 1.00 0.00 H new ATOM 0 HD1 TYR A 711 -1.835 8.262 -3.222 1.00 0.00 H new ATOM 0 HD2 TYR A 711 -4.944 10.667 -4.776 1.00 0.00 H new ATOM 0 HE1 TYR A 711 -1.271 7.495 -5.464 1.00 0.00 H new ATOM 0 HE2 TYR A 711 -4.369 9.937 -7.040 1.00 0.00 H new ATOM 0 HH TYR A 711 -3.079 8.725 -8.313 1.00 0.00 H new ATOM 1376 N GLY A 712 -2.952 6.952 -1.525 1.00 0.00 N ATOM 1377 CA GLY A 712 -1.944 5.990 -1.199 1.00 0.00 C ATOM 1378 C GLY A 712 -2.377 5.006 -0.115 1.00 0.00 C ATOM 1379 O GLY A 712 -1.839 3.890 -0.040 1.00 0.00 O ATOM 0 H GLY A 712 -3.633 6.637 -2.216 1.00 0.00 H new ATOM 0 HA2 GLY A 712 -1.677 5.435 -2.098 1.00 0.00 H new ATOM 0 HA3 GLY A 712 -1.046 6.512 -0.868 1.00 0.00 H new ATOM 1383 N ASP A 713 -3.335 5.386 0.731 1.00 0.00 N ATOM 1384 CA ASP A 713 -3.816 4.473 1.767 1.00 0.00 C ATOM 1385 C ASP A 713 -4.744 3.420 1.157 1.00 0.00 C ATOM 1386 O ASP A 713 -5.191 3.556 0.004 1.00 0.00 O ATOM 1387 CB ASP A 713 -4.489 5.222 2.934 1.00 0.00 C ATOM 1388 CG ASP A 713 -4.855 4.310 4.093 1.00 0.00 C ATOM 1389 OD1 ASP A 713 -4.137 3.293 4.321 1.00 0.00 O ATOM 1390 OD2 ASP A 713 -5.861 4.545 4.749 1.00 0.00 O ATOM 0 H ASP A 713 -3.786 6.301 0.721 1.00 0.00 H new ATOM 0 HA ASP A 713 -2.952 3.962 2.191 1.00 0.00 H new ATOM 0 HB2 ASP A 713 -3.819 6.003 3.292 1.00 0.00 H new ATOM 0 HB3 ASP A 713 -5.389 5.717 2.570 1.00 0.00 H new ATOM 1395 N SER A 714 -5.043 2.396 1.908 1.00 0.00 N ATOM 1396 CA SER A 714 -5.777 1.272 1.412 1.00 0.00 C ATOM 1397 C SER A 714 -6.889 0.926 2.342 1.00 0.00 C ATOM 1398 O SER A 714 -6.850 1.251 3.528 1.00 0.00 O ATOM 1399 CB SER A 714 -4.871 0.073 1.330 1.00 0.00 C ATOM 1400 OG SER A 714 -3.586 0.449 0.838 1.00 0.00 O ATOM 0 H SER A 714 -4.780 2.321 2.891 1.00 0.00 H new ATOM 0 HA SER A 714 -6.172 1.533 0.430 1.00 0.00 H new ATOM 0 HB2 SER A 714 -4.771 -0.382 2.315 1.00 0.00 H new ATOM 0 HB3 SER A 714 -5.312 -0.679 0.675 1.00 0.00 H new ATOM 0 HG SER A 714 -3.009 -0.342 0.793 1.00 0.00 H new ATOM 1406 N VAL A 715 -7.853 0.254 1.811 1.00 0.00 N ATOM 1407 CA VAL A 715 -8.959 -0.227 2.557 1.00 0.00 C ATOM 1408 C VAL A 715 -9.281 -1.634 2.112 1.00 0.00 C ATOM 1409 O VAL A 715 -9.076 -1.977 0.956 1.00 0.00 O ATOM 1410 CB VAL A 715 -10.203 0.699 2.444 1.00 0.00 C ATOM 1411 CG1 VAL A 715 -11.404 0.000 2.970 1.00 0.00 C ATOM 1412 CG2 VAL A 715 -10.001 1.952 3.254 1.00 0.00 C ATOM 0 H VAL A 715 -7.892 0.019 0.819 1.00 0.00 H new ATOM 0 HA VAL A 715 -8.684 -0.231 3.612 1.00 0.00 H new ATOM 0 HB VAL A 715 -10.340 0.954 1.393 1.00 0.00 H new ATOM 0 HG11 VAL A 715 -12.271 0.655 2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 715 -11.579 -0.908 2.393 1.00 0.00 H new ATOM 0 HG13 VAL A 715 -11.244 -0.261 4.016 1.00 0.00 H new ATOM 0 HG21 VAL A 715 -10.881 2.589 3.164 1.00 0.00 H new ATOM 0 HG22 VAL A 715 -9.850 1.688 4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 715 -9.126 2.487 2.884 1.00 0.00 H new ATOM 1422 N GLU A 716 -9.718 -2.439 3.034 1.00 0.00 N ATOM 1423 CA GLU A 716 -10.087 -3.783 2.764 1.00 0.00 C ATOM 1424 C GLU A 716 -11.585 -3.963 2.924 1.00 0.00 C ATOM 1425 O GLU A 716 -12.166 -3.688 3.995 1.00 0.00 O ATOM 1426 CB GLU A 716 -9.295 -4.697 3.652 1.00 0.00 C ATOM 1427 CG GLU A 716 -7.816 -4.602 3.343 1.00 0.00 C ATOM 1428 CD GLU A 716 -6.948 -5.325 4.297 1.00 0.00 C ATOM 1429 OE1 GLU A 716 -6.906 -6.557 4.256 1.00 0.00 O ATOM 1430 OE2 GLU A 716 -6.230 -4.668 5.068 1.00 0.00 O ATOM 0 H GLU A 716 -9.827 -2.168 4.011 1.00 0.00 H new ATOM 0 HA GLU A 716 -9.855 -4.038 1.730 1.00 0.00 H new ATOM 0 HB2 GLU A 716 -9.470 -4.438 4.696 1.00 0.00 H new ATOM 0 HB3 GLU A 716 -9.633 -5.724 3.518 1.00 0.00 H new ATOM 0 HG2 GLU A 716 -7.640 -4.993 2.341 1.00 0.00 H new ATOM 0 HG3 GLU A 716 -7.526 -3.551 3.330 1.00 0.00 H new ATOM 1437 N PHE A 717 -12.190 -4.401 1.860 1.00 0.00 N ATOM 1438 CA PHE A 717 -13.616 -4.591 1.756 1.00 0.00 C ATOM 1439 C PHE A 717 -14.031 -5.996 2.096 1.00 0.00 C ATOM 1440 O PHE A 717 -13.285 -6.940 1.890 1.00 0.00 O ATOM 1441 CB PHE A 717 -14.099 -4.213 0.359 1.00 0.00 C ATOM 1442 CG PHE A 717 -14.698 -2.848 0.293 1.00 0.00 C ATOM 1443 CD1 PHE A 717 -14.024 -1.743 0.787 1.00 0.00 C ATOM 1444 CD2 PHE A 717 -15.958 -2.677 -0.248 1.00 0.00 C ATOM 1445 CE1 PHE A 717 -14.609 -0.494 0.739 1.00 0.00 C ATOM 1446 CE2 PHE A 717 -16.539 -1.436 -0.301 1.00 0.00 C ATOM 1447 CZ PHE A 717 -15.869 -0.350 0.193 1.00 0.00 C ATOM 0 H PHE A 717 -11.690 -4.646 1.006 1.00 0.00 H new ATOM 0 HA PHE A 717 -14.085 -3.934 2.488 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -13.261 -4.269 -0.336 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -14.837 -4.943 0.027 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -13.038 -1.859 1.211 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -16.492 -3.532 -0.634 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -14.084 0.366 1.127 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -17.522 -1.316 -0.731 1.00 0.00 H new ATOM 0 HZ PHE A 717 -16.329 0.626 0.156 1.00 0.00 H new ATOM 1457 N ASN A 718 -15.190 -6.111 2.669 1.00 0.00 N ATOM 1458 CA ASN A 718 -15.763 -7.380 3.061 1.00 0.00 C ATOM 1459 C ASN A 718 -17.133 -7.444 2.473 1.00 0.00 C ATOM 1460 O ASN A 718 -17.884 -6.464 2.526 1.00 0.00 O ATOM 1461 CB ASN A 718 -15.857 -7.517 4.596 1.00 0.00 C ATOM 1462 CG ASN A 718 -16.292 -8.915 5.067 1.00 0.00 C ATOM 1463 OD1 ASN A 718 -15.457 -9.796 5.272 1.00 0.00 O ATOM 1464 ND2 ASN A 718 -17.573 -9.115 5.265 1.00 0.00 N ATOM 0 H ASN A 718 -15.785 -5.311 2.886 1.00 0.00 H new ATOM 0 HA ASN A 718 -15.129 -8.191 2.703 1.00 0.00 H new ATOM 0 HB2 ASN A 718 -14.886 -7.282 5.033 1.00 0.00 H new ATOM 0 HB3 ASN A 718 -16.564 -6.779 4.975 1.00 0.00 H new ATOM 0 HD21 ASN A 718 -17.902 -10.021 5.598 1.00 0.00 H new ATOM 0 HD22 ASN A 718 -18.240 -8.364 5.086 1.00 0.00 H new ATOM 1471 N CYS A 719 -17.446 -8.533 1.909 1.00 0.00 N ATOM 1472 CA CYS A 719 -18.703 -8.728 1.285 1.00 0.00 C ATOM 1473 C CYS A 719 -19.645 -9.346 2.289 1.00 0.00 C ATOM 1474 O CYS A 719 -19.210 -10.177 3.099 1.00 0.00 O ATOM 1475 CB CYS A 719 -18.513 -9.660 0.107 1.00 0.00 C ATOM 1476 SG CYS A 719 -19.993 -9.935 -0.879 1.00 0.00 S ATOM 0 H CYS A 719 -16.827 -9.342 1.861 1.00 0.00 H new ATOM 0 HA CYS A 719 -19.117 -7.782 0.936 1.00 0.00 H new ATOM 0 HB2 CYS A 719 -17.733 -9.255 -0.538 1.00 0.00 H new ATOM 0 HB3 CYS A 719 -18.154 -10.621 0.475 1.00 0.00 H new ATOM 1481 N SER A 720 -20.910 -8.948 2.257 1.00 0.00 N ATOM 1482 CA SER A 720 -21.915 -9.494 3.141 1.00 0.00 C ATOM 1483 C SER A 720 -21.914 -11.026 3.044 1.00 0.00 C ATOM 1484 O SER A 720 -21.781 -11.578 1.959 1.00 0.00 O ATOM 1485 CB SER A 720 -23.261 -8.891 2.785 1.00 0.00 C ATOM 1486 OG SER A 720 -23.206 -7.476 2.935 1.00 0.00 O ATOM 0 H SER A 720 -21.262 -8.237 1.615 1.00 0.00 H new ATOM 0 HA SER A 720 -21.697 -9.240 4.178 1.00 0.00 H new ATOM 0 HB2 SER A 720 -23.526 -9.148 1.759 1.00 0.00 H new ATOM 0 HB3 SER A 720 -24.038 -9.305 3.428 1.00 0.00 H new ATOM 0 HG SER A 720 -22.904 -7.070 2.096 1.00 0.00 H new ATOM 1492 N GLU A 721 -22.041 -11.682 4.176 1.00 0.00 N ATOM 1493 CA GLU A 721 -21.823 -13.121 4.303 1.00 0.00 C ATOM 1494 C GLU A 721 -22.718 -13.996 3.393 1.00 0.00 C ATOM 1495 O GLU A 721 -22.297 -15.080 2.969 1.00 0.00 O ATOM 1496 CB GLU A 721 -21.919 -13.532 5.763 1.00 0.00 C ATOM 1497 CG GLU A 721 -21.474 -14.948 6.044 1.00 0.00 C ATOM 1498 CD GLU A 721 -21.470 -15.249 7.502 1.00 0.00 C ATOM 1499 OE1 GLU A 721 -20.436 -15.013 8.172 1.00 0.00 O ATOM 1500 OE2 GLU A 721 -22.497 -15.703 8.020 1.00 0.00 O ATOM 0 H GLU A 721 -22.302 -11.231 5.053 1.00 0.00 H new ATOM 0 HA GLU A 721 -20.814 -13.311 3.938 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -21.315 -12.849 6.360 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -22.951 -13.416 6.093 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -22.136 -15.645 5.531 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -20.474 -15.102 5.639 1.00 0.00 H new ATOM 1507 N SER A 722 -23.909 -13.531 3.064 1.00 0.00 N ATOM 1508 CA SER A 722 -24.793 -14.287 2.165 1.00 0.00 C ATOM 1509 C SER A 722 -24.381 -14.094 0.694 1.00 0.00 C ATOM 1510 O SER A 722 -24.964 -14.668 -0.229 1.00 0.00 O ATOM 1511 CB SER A 722 -26.240 -13.857 2.382 1.00 0.00 C ATOM 1512 OG SER A 722 -26.607 -14.042 3.742 1.00 0.00 O ATOM 0 H SER A 722 -24.293 -12.646 3.395 1.00 0.00 H new ATOM 0 HA SER A 722 -24.701 -15.348 2.397 1.00 0.00 H new ATOM 0 HB2 SER A 722 -26.362 -12.810 2.104 1.00 0.00 H new ATOM 0 HB3 SER A 722 -26.900 -14.437 1.737 1.00 0.00 H new ATOM 0 HG SER A 722 -27.537 -13.761 3.871 1.00 0.00 H new ATOM 1518 N PHE A 723 -23.373 -13.294 0.487 1.00 0.00 N ATOM 1519 CA PHE A 723 -22.879 -13.007 -0.810 1.00 0.00 C ATOM 1520 C PHE A 723 -21.446 -13.447 -0.899 1.00 0.00 C ATOM 1521 O PHE A 723 -20.779 -13.648 0.126 1.00 0.00 O ATOM 1522 CB PHE A 723 -22.989 -11.505 -1.099 1.00 0.00 C ATOM 1523 CG PHE A 723 -24.390 -10.999 -1.117 1.00 0.00 C ATOM 1524 CD1 PHE A 723 -25.007 -10.554 0.040 1.00 0.00 C ATOM 1525 CD2 PHE A 723 -25.093 -10.979 -2.289 1.00 0.00 C ATOM 1526 CE1 PHE A 723 -26.305 -10.107 0.013 1.00 0.00 C ATOM 1527 CE2 PHE A 723 -26.383 -10.536 -2.332 1.00 0.00 C ATOM 1528 CZ PHE A 723 -26.997 -10.097 -1.179 1.00 0.00 C ATOM 0 H PHE A 723 -22.869 -12.819 1.236 1.00 0.00 H new ATOM 0 HA PHE A 723 -23.472 -13.544 -1.551 1.00 0.00 H new ATOM 0 HB2 PHE A 723 -22.424 -10.957 -0.345 1.00 0.00 H new ATOM 0 HB3 PHE A 723 -22.524 -11.294 -2.062 1.00 0.00 H new ATOM 0 HD1 PHE A 723 -24.462 -10.559 0.972 1.00 0.00 H new ATOM 0 HD2 PHE A 723 -24.619 -11.320 -3.198 1.00 0.00 H new ATOM 0 HE1 PHE A 723 -26.781 -9.765 0.920 1.00 0.00 H new ATOM 0 HE2 PHE A 723 -26.922 -10.529 -3.268 1.00 0.00 H new ATOM 0 HZ PHE A 723 -28.018 -9.746 -1.209 1.00 0.00 H new ATOM 1538 N THR A 724 -20.992 -13.639 -2.081 1.00 0.00 N ATOM 1539 CA THR A 724 -19.642 -13.978 -2.319 1.00 0.00 C ATOM 1540 C THR A 724 -19.051 -12.870 -3.167 1.00 0.00 C ATOM 1541 O THR A 724 -19.746 -12.310 -4.045 1.00 0.00 O ATOM 1542 CB THR A 724 -19.504 -15.399 -2.970 1.00 0.00 C ATOM 1543 OG1 THR A 724 -18.132 -15.735 -3.217 1.00 0.00 O ATOM 1544 CG2 THR A 724 -20.313 -15.526 -4.244 1.00 0.00 C ATOM 0 H THR A 724 -21.560 -13.563 -2.925 1.00 0.00 H new ATOM 0 HA THR A 724 -19.087 -14.054 -1.384 1.00 0.00 H new ATOM 0 HB THR A 724 -19.908 -16.108 -2.247 1.00 0.00 H new ATOM 0 HG1 THR A 724 -18.081 -16.626 -3.621 1.00 0.00 H new ATOM 0 HG21 THR A 724 -20.186 -16.526 -4.658 1.00 0.00 H new ATOM 0 HG22 THR A 724 -21.367 -15.356 -4.024 1.00 0.00 H new ATOM 0 HG23 THR A 724 -19.969 -14.787 -4.968 1.00 0.00 H new ATOM 1552 N MET A 725 -17.836 -12.487 -2.870 1.00 0.00 N ATOM 1553 CA MET A 725 -17.230 -11.388 -3.538 1.00 0.00 C ATOM 1554 C MET A 725 -16.427 -11.884 -4.725 1.00 0.00 C ATOM 1555 O MET A 725 -15.817 -12.951 -4.684 1.00 0.00 O ATOM 1556 CB MET A 725 -16.344 -10.601 -2.562 1.00 0.00 C ATOM 1557 CG MET A 725 -14.936 -11.152 -2.367 1.00 0.00 C ATOM 1558 SD MET A 725 -14.121 -10.534 -0.865 1.00 0.00 S ATOM 1559 CE MET A 725 -14.375 -8.767 -1.009 1.00 0.00 C ATOM 0 H MET A 725 -17.251 -12.931 -2.162 1.00 0.00 H new ATOM 0 HA MET A 725 -18.006 -10.718 -3.906 1.00 0.00 H new ATOM 0 HB2 MET A 725 -16.268 -9.573 -2.916 1.00 0.00 H new ATOM 0 HB3 MET A 725 -16.841 -10.569 -1.592 1.00 0.00 H new ATOM 0 HG2 MET A 725 -14.982 -12.240 -2.325 1.00 0.00 H new ATOM 0 HG3 MET A 725 -14.329 -10.892 -3.234 1.00 0.00 H new ATOM 0 HE1 MET A 725 -13.414 -8.272 -1.149 1.00 0.00 H new ATOM 0 HE2 MET A 725 -15.018 -8.560 -1.865 1.00 0.00 H new ATOM 0 HE3 MET A 725 -14.848 -8.392 -0.101 1.00 0.00 H new ATOM 1569 N ILE A 726 -16.482 -11.153 -5.776 1.00 0.00 N ATOM 1570 CA ILE A 726 -15.725 -11.439 -6.953 1.00 0.00 C ATOM 1571 C ILE A 726 -14.676 -10.375 -7.105 1.00 0.00 C ATOM 1572 O ILE A 726 -14.970 -9.246 -7.521 1.00 0.00 O ATOM 1573 CB ILE A 726 -16.600 -11.481 -8.219 1.00 0.00 C ATOM 1574 CG1 ILE A 726 -17.758 -12.464 -8.038 1.00 0.00 C ATOM 1575 CG2 ILE A 726 -15.752 -11.874 -9.423 1.00 0.00 C ATOM 1576 CD1 ILE A 726 -18.674 -12.539 -9.228 1.00 0.00 C ATOM 0 H ILE A 726 -17.065 -10.319 -5.851 1.00 0.00 H new ATOM 0 HA ILE A 726 -15.277 -12.426 -6.842 1.00 0.00 H new ATOM 0 HB ILE A 726 -17.018 -10.489 -8.390 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -17.354 -13.456 -7.838 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -18.337 -12.173 -7.162 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -16.378 -11.902 -10.315 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -14.955 -11.143 -9.561 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -15.316 -12.859 -9.255 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -19.471 -13.255 -9.029 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -19.107 -11.557 -9.416 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -18.108 -12.860 -10.103 1.00 0.00 H new ATOM 1588 N GLY A 727 -13.497 -10.712 -6.725 1.00 0.00 N ATOM 1589 CA GLY A 727 -12.394 -9.800 -6.760 1.00 0.00 C ATOM 1590 C GLY A 727 -11.625 -9.858 -5.481 1.00 0.00 C ATOM 1591 O GLY A 727 -11.813 -10.777 -4.684 1.00 0.00 O ATOM 0 H GLY A 727 -13.260 -11.640 -6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -11.739 -10.045 -7.596 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -12.758 -8.786 -6.926 1.00 0.00 H new ATOM 1595 N HIS A 728 -10.790 -8.891 -5.266 1.00 0.00 N ATOM 1596 CA HIS A 728 -9.982 -8.828 -4.077 1.00 0.00 C ATOM 1597 C HIS A 728 -10.577 -7.848 -3.098 1.00 0.00 C ATOM 1598 O HIS A 728 -11.483 -7.098 -3.445 1.00 0.00 O ATOM 1599 CB HIS A 728 -8.524 -8.469 -4.396 1.00 0.00 C ATOM 1600 CG HIS A 728 -8.325 -7.228 -5.206 1.00 0.00 C ATOM 1601 ND1 HIS A 728 -7.862 -7.241 -6.498 1.00 0.00 N ATOM 1602 CD2 HIS A 728 -8.471 -5.945 -4.873 1.00 0.00 C ATOM 1603 CE1 HIS A 728 -7.718 -6.013 -6.923 1.00 0.00 C ATOM 1604 NE2 HIS A 728 -8.080 -5.192 -5.956 1.00 0.00 N ATOM 0 H HIS A 728 -10.645 -8.115 -5.912 1.00 0.00 H new ATOM 0 HA HIS A 728 -9.974 -9.819 -3.623 1.00 0.00 H new ATOM 0 HB2 HIS A 728 -7.982 -8.359 -3.457 1.00 0.00 H new ATOM 0 HB3 HIS A 728 -8.071 -9.305 -4.929 1.00 0.00 H new ATOM 0 HD1 HIS A 728 -7.661 -8.080 -7.043 1.00 0.00 H new ATOM 0 HD2 HIS A 728 -8.830 -5.567 -3.927 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -7.363 -5.720 -7.900 1.00 0.00 H new ATOM 1613 N ARG A 729 -10.048 -7.813 -1.911 1.00 0.00 N ATOM 1614 CA ARG A 729 -10.614 -6.971 -0.891 1.00 0.00 C ATOM 1615 C ARG A 729 -9.967 -5.613 -0.799 1.00 0.00 C ATOM 1616 O ARG A 729 -10.613 -4.656 -0.390 1.00 0.00 O ATOM 1617 CB ARG A 729 -10.559 -7.621 0.480 1.00 0.00 C ATOM 1618 CG ARG A 729 -9.169 -8.027 0.955 1.00 0.00 C ATOM 1619 CD ARG A 729 -9.180 -8.512 2.396 1.00 0.00 C ATOM 1620 NE ARG A 729 -10.087 -9.645 2.605 1.00 0.00 N ATOM 1621 CZ ARG A 729 -10.267 -10.271 3.776 1.00 0.00 C ATOM 1622 NH1 ARG A 729 -9.520 -9.959 4.828 1.00 0.00 N ATOM 1623 NH2 ARG A 729 -11.172 -11.229 3.894 1.00 0.00 N ATOM 0 H ARG A 729 -9.231 -8.352 -1.623 1.00 0.00 H new ATOM 0 HA ARG A 729 -11.651 -6.835 -1.199 1.00 0.00 H new ATOM 0 HB2 ARG A 729 -10.986 -6.931 1.208 1.00 0.00 H new ATOM 0 HB3 ARG A 729 -11.194 -8.507 0.469 1.00 0.00 H new ATOM 0 HG2 ARG A 729 -8.781 -8.815 0.310 1.00 0.00 H new ATOM 0 HG3 ARG A 729 -8.492 -7.178 0.863 1.00 0.00 H new ATOM 0 HD2 ARG A 729 -8.170 -8.802 2.685 1.00 0.00 H new ATOM 0 HD3 ARG A 729 -9.475 -7.691 3.049 1.00 0.00 H new ATOM 0 HE ARG A 729 -10.619 -9.981 1.802 1.00 0.00 H new ATOM 0 HH11 ARG A 729 -8.803 -9.238 4.748 1.00 0.00 H new ATOM 0 HH12 ARG A 729 -9.663 -10.440 5.716 1.00 0.00 H new ATOM 0 HH21 ARG A 729 -11.739 -11.496 3.090 1.00 0.00 H new ATOM 0 HH22 ARG A 729 -11.302 -11.700 4.789 1.00 0.00 H new ATOM 1637 N SER A 730 -8.728 -5.500 -1.166 1.00 0.00 N ATOM 1638 CA SER A 730 -8.051 -4.264 -0.883 1.00 0.00 C ATOM 1639 C SER A 730 -8.022 -3.260 -2.008 1.00 0.00 C ATOM 1640 O SER A 730 -7.751 -3.578 -3.165 1.00 0.00 O ATOM 1641 CB SER A 730 -6.709 -4.505 -0.260 1.00 0.00 C ATOM 1642 OG SER A 730 -6.032 -5.573 -0.910 1.00 0.00 O ATOM 0 H SER A 730 -8.179 -6.215 -1.644 1.00 0.00 H new ATOM 0 HA SER A 730 -8.675 -3.765 -0.141 1.00 0.00 H new ATOM 0 HB2 SER A 730 -6.108 -3.598 -0.320 1.00 0.00 H new ATOM 0 HB3 SER A 730 -6.831 -4.737 0.798 1.00 0.00 H new ATOM 0 HG SER A 730 -5.158 -5.711 -0.488 1.00 0.00 H new ATOM 1648 N ILE A 731 -8.329 -2.050 -1.653 1.00 0.00 N ATOM 1649 CA ILE A 731 -8.366 -0.949 -2.566 1.00 0.00 C ATOM 1650 C ILE A 731 -7.391 0.091 -2.124 1.00 0.00 C ATOM 1651 O ILE A 731 -6.918 0.049 -1.005 1.00 0.00 O ATOM 1652 CB ILE A 731 -9.766 -0.337 -2.621 1.00 0.00 C ATOM 1653 CG1 ILE A 731 -10.216 0.045 -1.196 1.00 0.00 C ATOM 1654 CG2 ILE A 731 -10.721 -1.293 -3.298 1.00 0.00 C ATOM 1655 CD1 ILE A 731 -11.632 0.477 -1.069 1.00 0.00 C ATOM 0 H ILE A 731 -8.567 -1.794 -0.695 1.00 0.00 H new ATOM 0 HA ILE A 731 -8.104 -1.312 -3.560 1.00 0.00 H new ATOM 0 HB ILE A 731 -9.757 0.576 -3.216 1.00 0.00 H new ATOM 0 HG12 ILE A 731 -10.055 -0.811 -0.541 1.00 0.00 H new ATOM 0 HG13 ILE A 731 -9.575 0.849 -0.834 1.00 0.00 H new ATOM 0 HG21 ILE A 731 -11.716 -0.849 -3.333 1.00 0.00 H new ATOM 0 HG22 ILE A 731 -10.377 -1.493 -4.313 1.00 0.00 H new ATOM 0 HG23 ILE A 731 -10.760 -2.227 -2.737 1.00 0.00 H new ATOM 0 HD11 ILE A 731 -11.846 0.723 -0.029 1.00 0.00 H new ATOM 0 HD12 ILE A 731 -11.802 1.356 -1.691 1.00 0.00 H new ATOM 0 HD13 ILE A 731 -12.289 -0.330 -1.394 1.00 0.00 H new ATOM 1667 N THR A 732 -7.110 1.008 -2.974 1.00 0.00 N ATOM 1668 CA THR A 732 -6.179 2.049 -2.696 1.00 0.00 C ATOM 1669 C THR A 732 -6.778 3.384 -3.110 1.00 0.00 C ATOM 1670 O THR A 732 -7.434 3.469 -4.142 1.00 0.00 O ATOM 1671 CB THR A 732 -4.869 1.785 -3.455 1.00 0.00 C ATOM 1672 OG1 THR A 732 -4.376 0.480 -3.091 1.00 0.00 O ATOM 1673 CG2 THR A 732 -3.830 2.840 -3.118 1.00 0.00 C ATOM 0 H THR A 732 -7.527 1.061 -3.903 1.00 0.00 H new ATOM 0 HA THR A 732 -5.962 2.077 -1.628 1.00 0.00 H new ATOM 0 HB THR A 732 -5.061 1.828 -4.527 1.00 0.00 H new ATOM 0 HG1 THR A 732 -3.541 0.300 -3.571 1.00 0.00 H new ATOM 0 HG21 THR A 732 -2.911 2.634 -3.666 1.00 0.00 H new ATOM 0 HG22 THR A 732 -4.206 3.824 -3.398 1.00 0.00 H new ATOM 0 HG23 THR A 732 -3.626 2.821 -2.047 1.00 0.00 H new ATOM 1681 N CYS A 733 -6.630 4.364 -2.253 1.00 0.00 N ATOM 1682 CA CYS A 733 -7.112 5.711 -2.485 1.00 0.00 C ATOM 1683 C CYS A 733 -6.322 6.368 -3.599 1.00 0.00 C ATOM 1684 O CYS A 733 -5.134 6.681 -3.434 1.00 0.00 O ATOM 1685 CB CYS A 733 -7.009 6.532 -1.195 1.00 0.00 C ATOM 1686 SG CYS A 733 -7.463 8.284 -1.370 1.00 0.00 S ATOM 0 H CYS A 733 -6.162 4.249 -1.354 1.00 0.00 H new ATOM 0 HA CYS A 733 -8.158 5.666 -2.788 1.00 0.00 H new ATOM 0 HB2 CYS A 733 -7.651 6.078 -0.440 1.00 0.00 H new ATOM 0 HB3 CYS A 733 -5.986 6.471 -0.823 1.00 0.00 H new ATOM 1691 N ILE A 734 -6.969 6.527 -4.732 1.00 0.00 N ATOM 1692 CA ILE A 734 -6.379 7.087 -5.922 1.00 0.00 C ATOM 1693 C ILE A 734 -7.287 8.193 -6.486 1.00 0.00 C ATOM 1694 O ILE A 734 -8.319 7.907 -7.043 1.00 0.00 O ATOM 1695 CB ILE A 734 -6.197 5.979 -7.024 1.00 0.00 C ATOM 1696 CG1 ILE A 734 -5.373 4.802 -6.494 1.00 0.00 C ATOM 1697 CG2 ILE A 734 -5.553 6.545 -8.283 1.00 0.00 C ATOM 1698 CD1 ILE A 734 -4.014 5.207 -6.021 1.00 0.00 C ATOM 0 H ILE A 734 -7.947 6.262 -4.852 1.00 0.00 H new ATOM 0 HA ILE A 734 -5.405 7.499 -5.656 1.00 0.00 H new ATOM 0 HB ILE A 734 -7.192 5.617 -7.283 1.00 0.00 H new ATOM 0 HG12 ILE A 734 -5.912 4.329 -5.673 1.00 0.00 H new ATOM 0 HG13 ILE A 734 -5.270 4.054 -7.280 1.00 0.00 H new ATOM 0 HG21 ILE A 734 -5.442 5.752 -9.023 1.00 0.00 H new ATOM 0 HG22 ILE A 734 -6.183 7.336 -8.690 1.00 0.00 H new ATOM 0 HG23 ILE A 734 -4.572 6.952 -8.038 1.00 0.00 H new ATOM 0 HD11 ILE A 734 -3.479 4.330 -5.657 1.00 0.00 H new ATOM 0 HD12 ILE A 734 -3.460 5.654 -6.846 1.00 0.00 H new ATOM 0 HD13 ILE A 734 -4.111 5.933 -5.214 1.00 0.00 H new ATOM 1710 N HIS A 735 -6.908 9.454 -6.287 1.00 0.00 N ATOM 1711 CA HIS A 735 -7.631 10.628 -6.856 1.00 0.00 C ATOM 1712 C HIS A 735 -8.983 10.868 -6.228 1.00 0.00 C ATOM 1713 O HIS A 735 -9.851 11.502 -6.839 1.00 0.00 O ATOM 1714 CB HIS A 735 -7.803 10.525 -8.383 1.00 0.00 C ATOM 1715 CG HIS A 735 -6.528 10.739 -9.159 1.00 0.00 C ATOM 1716 ND1 HIS A 735 -6.095 11.989 -9.533 1.00 0.00 N ATOM 1717 CD2 HIS A 735 -5.594 9.875 -9.622 1.00 0.00 C ATOM 1718 CE1 HIS A 735 -4.962 11.887 -10.186 1.00 0.00 C ATOM 1719 NE2 HIS A 735 -4.634 10.617 -10.254 1.00 0.00 N ATOM 0 H HIS A 735 -6.093 9.708 -5.729 1.00 0.00 H new ATOM 0 HA HIS A 735 -6.992 11.478 -6.619 1.00 0.00 H new ATOM 0 HB2 HIS A 735 -8.205 9.542 -8.628 1.00 0.00 H new ATOM 0 HB3 HIS A 735 -8.541 11.260 -8.706 1.00 0.00 H new ATOM 0 HD2 HIS A 735 -5.605 8.801 -9.513 1.00 0.00 H new ATOM 0 HE1 HIS A 735 -4.395 12.708 -10.598 1.00 0.00 H new ATOM 0 HE2 HIS A 735 -3.799 10.244 -10.705 1.00 0.00 H new ATOM 1728 N GLY A 736 -9.172 10.406 -5.026 1.00 0.00 N ATOM 1729 CA GLY A 736 -10.444 10.607 -4.393 1.00 0.00 C ATOM 1730 C GLY A 736 -11.319 9.423 -4.550 1.00 0.00 C ATOM 1731 O GLY A 736 -12.447 9.387 -4.027 1.00 0.00 O ATOM 0 H GLY A 736 -8.480 9.899 -4.474 1.00 0.00 H new ATOM 0 HA2 GLY A 736 -10.296 10.814 -3.333 1.00 0.00 H new ATOM 0 HA3 GLY A 736 -10.932 11.482 -4.823 1.00 0.00 H new ATOM 1735 N VAL A 737 -10.835 8.451 -5.279 1.00 0.00 N ATOM 1736 CA VAL A 737 -11.570 7.327 -5.537 1.00 0.00 C ATOM 1737 C VAL A 737 -10.737 6.154 -5.120 1.00 0.00 C ATOM 1738 O VAL A 737 -9.533 6.260 -5.060 1.00 0.00 O ATOM 1739 CB VAL A 737 -11.912 7.244 -7.047 1.00 0.00 C ATOM 1740 CG1 VAL A 737 -12.445 8.530 -7.625 1.00 0.00 C ATOM 1741 CG2 VAL A 737 -10.860 6.600 -7.923 1.00 0.00 C ATOM 0 H VAL A 737 -9.905 8.456 -5.697 1.00 0.00 H new ATOM 0 HA VAL A 737 -12.513 7.343 -4.990 1.00 0.00 H new ATOM 0 HB VAL A 737 -12.740 6.536 -7.064 1.00 0.00 H new ATOM 0 HG11 VAL A 737 -12.660 8.391 -8.684 1.00 0.00 H new ATOM 0 HG12 VAL A 737 -13.359 8.812 -7.103 1.00 0.00 H new ATOM 0 HG13 VAL A 737 -11.701 9.318 -7.506 1.00 0.00 H new ATOM 0 HG21 VAL A 737 -11.202 6.594 -8.958 1.00 0.00 H new ATOM 0 HG22 VAL A 737 -9.931 7.165 -7.851 1.00 0.00 H new ATOM 0 HG23 VAL A 737 -10.688 5.576 -7.592 1.00 0.00 H new ATOM 1751 N TRP A 738 -11.338 5.094 -4.775 1.00 0.00 N ATOM 1752 CA TRP A 738 -10.581 3.922 -4.487 1.00 0.00 C ATOM 1753 C TRP A 738 -10.380 3.166 -5.787 1.00 0.00 C ATOM 1754 O TRP A 738 -11.002 3.522 -6.794 1.00 0.00 O ATOM 1755 CB TRP A 738 -11.294 3.098 -3.452 1.00 0.00 C ATOM 1756 CG TRP A 738 -11.458 3.820 -2.142 1.00 0.00 C ATOM 1757 CD1 TRP A 738 -12.522 4.546 -1.731 1.00 0.00 C ATOM 1758 CD2 TRP A 738 -10.508 3.893 -1.099 1.00 0.00 C ATOM 1759 NE1 TRP A 738 -12.301 5.048 -0.476 1.00 0.00 N ATOM 1760 CE2 TRP A 738 -11.056 4.669 -0.074 1.00 0.00 C ATOM 1761 CE3 TRP A 738 -9.254 3.370 -0.941 1.00 0.00 C ATOM 1762 CZ2 TRP A 738 -10.369 4.932 1.096 1.00 0.00 C ATOM 1763 CZ3 TRP A 738 -8.566 3.623 0.205 1.00 0.00 C ATOM 1764 CH2 TRP A 738 -9.117 4.401 1.218 1.00 0.00 C ATOM 0 H TRP A 738 -12.349 4.997 -4.681 1.00 0.00 H new ATOM 0 HA TRP A 738 -9.604 4.172 -4.073 1.00 0.00 H new ATOM 0 HB2 TRP A 738 -12.276 2.817 -3.832 1.00 0.00 H new ATOM 0 HB3 TRP A 738 -10.740 2.174 -3.285 1.00 0.00 H new ATOM 0 HD1 TRP A 738 -13.419 4.707 -2.310 1.00 0.00 H new ATOM 0 HE1 TRP A 738 -12.957 5.610 0.066 1.00 0.00 H new ATOM 0 HE3 TRP A 738 -8.815 2.762 -1.718 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 -10.804 5.532 1.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 -7.575 3.213 0.330 1.00 0.00 H new ATOM 0 HH2 TRP A 738 -8.545 4.588 2.115 1.00 0.00 H new ATOM 1775 N THR A 739 -9.516 2.163 -5.782 1.00 0.00 N ATOM 1776 CA THR A 739 -9.181 1.421 -7.010 1.00 0.00 C ATOM 1777 C THR A 739 -10.373 0.987 -7.844 1.00 0.00 C ATOM 1778 O THR A 739 -10.630 1.563 -8.906 1.00 0.00 O ATOM 1779 CB THR A 739 -8.207 0.231 -6.790 1.00 0.00 C ATOM 1780 OG1 THR A 739 -8.690 -0.679 -5.784 1.00 0.00 O ATOM 1781 CG2 THR A 739 -6.848 0.730 -6.400 1.00 0.00 C ATOM 0 H THR A 739 -9.029 1.836 -4.947 1.00 0.00 H new ATOM 0 HA THR A 739 -8.652 2.174 -7.594 1.00 0.00 H new ATOM 0 HB THR A 739 -8.142 -0.309 -7.735 1.00 0.00 H new ATOM 0 HG1 THR A 739 -8.131 -1.484 -5.775 1.00 0.00 H new ATOM 0 HG21 THR A 739 -6.179 -0.117 -6.250 1.00 0.00 H new ATOM 0 HG22 THR A 739 -6.454 1.368 -7.191 1.00 0.00 H new ATOM 0 HG23 THR A 739 -6.922 1.302 -5.475 1.00 0.00 H new ATOM 1789 N GLN A 740 -11.117 0.025 -7.373 1.00 0.00 N ATOM 1790 CA GLN A 740 -12.183 -0.527 -8.194 1.00 0.00 C ATOM 1791 C GLN A 740 -13.216 -1.306 -7.443 1.00 0.00 C ATOM 1792 O GLN A 740 -14.381 -1.315 -7.847 1.00 0.00 O ATOM 1793 CB GLN A 740 -11.610 -1.322 -9.392 1.00 0.00 C ATOM 1794 CG GLN A 740 -10.344 -2.176 -9.108 1.00 0.00 C ATOM 1795 CD GLN A 740 -10.519 -3.270 -8.070 1.00 0.00 C ATOM 1796 OE1 GLN A 740 -10.924 -4.371 -8.384 1.00 0.00 O ATOM 1797 NE2 GLN A 740 -10.118 -3.005 -6.839 1.00 0.00 N ATOM 0 H GLN A 740 -11.017 -0.392 -6.448 1.00 0.00 H new ATOM 0 HA GLN A 740 -12.727 0.336 -8.579 1.00 0.00 H new ATOM 0 HB2 GLN A 740 -12.391 -1.982 -9.769 1.00 0.00 H new ATOM 0 HB3 GLN A 740 -11.376 -0.617 -10.190 1.00 0.00 H new ATOM 0 HG2 GLN A 740 -10.017 -2.633 -10.042 1.00 0.00 H new ATOM 0 HG3 GLN A 740 -9.544 -1.512 -8.781 1.00 0.00 H new ATOM 0 HE21 GLN A 740 -9.782 -2.072 -6.602 1.00 0.00 H new ATOM 0 HE22 GLN A 740 -10.144 -3.734 -6.126 1.00 0.00 H new ATOM 1806 N LEU A 741 -12.789 -1.935 -6.356 1.00 0.00 N ATOM 1807 CA LEU A 741 -13.626 -2.795 -5.509 1.00 0.00 C ATOM 1808 C LEU A 741 -14.017 -4.085 -6.245 1.00 0.00 C ATOM 1809 O LEU A 741 -13.990 -4.146 -7.478 1.00 0.00 O ATOM 1810 CB LEU A 741 -14.880 -2.046 -5.089 1.00 0.00 C ATOM 1811 CG LEU A 741 -14.633 -0.713 -4.433 1.00 0.00 C ATOM 1812 CD1 LEU A 741 -15.905 0.063 -4.427 1.00 0.00 C ATOM 1813 CD2 LEU A 741 -14.172 -0.907 -3.020 1.00 0.00 C ATOM 0 H LEU A 741 -11.827 -1.864 -6.025 1.00 0.00 H new ATOM 0 HA LEU A 741 -13.048 -3.065 -4.625 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -15.505 -1.891 -5.969 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -15.447 -2.673 -4.401 1.00 0.00 H new ATOM 0 HG LEU A 741 -13.863 -0.177 -4.988 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -15.739 1.031 -3.954 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -16.244 0.213 -5.452 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -16.664 -0.487 -3.871 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -13.997 0.064 -2.558 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -14.936 -1.444 -2.458 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -13.247 -1.483 -3.015 1.00 0.00 H new ATOM 1825 N PRO A 742 -14.332 -5.143 -5.510 1.00 0.00 N ATOM 1826 CA PRO A 742 -14.848 -6.368 -6.107 1.00 0.00 C ATOM 1827 C PRO A 742 -16.346 -6.192 -6.425 1.00 0.00 C ATOM 1828 O PRO A 742 -16.826 -5.078 -6.535 1.00 0.00 O ATOM 1829 CB PRO A 742 -14.674 -7.393 -4.982 1.00 0.00 C ATOM 1830 CG PRO A 742 -14.766 -6.596 -3.731 1.00 0.00 C ATOM 1831 CD PRO A 742 -14.192 -5.248 -4.047 1.00 0.00 C ATOM 0 HA PRO A 742 -14.350 -6.651 -7.034 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -15.448 -8.160 -5.021 1.00 0.00 H new ATOM 0 HB3 PRO A 742 -13.714 -7.904 -5.057 1.00 0.00 H new ATOM 0 HG2 PRO A 742 -15.801 -6.510 -3.400 1.00 0.00 H new ATOM 0 HG3 PRO A 742 -14.212 -7.075 -2.923 1.00 0.00 H new ATOM 0 HD2 PRO A 742 -14.733 -4.452 -3.535 1.00 0.00 H new ATOM 0 HD3 PRO A 742 -13.149 -5.174 -3.738 1.00 0.00 H new ATOM 1839 N GLN A 743 -17.064 -7.264 -6.577 1.00 0.00 N ATOM 1840 CA GLN A 743 -18.499 -7.184 -6.732 1.00 0.00 C ATOM 1841 C GLN A 743 -19.100 -8.367 -6.021 1.00 0.00 C ATOM 1842 O GLN A 743 -18.501 -9.431 -6.001 1.00 0.00 O ATOM 1843 CB GLN A 743 -18.922 -7.140 -8.212 1.00 0.00 C ATOM 1844 CG GLN A 743 -18.642 -8.401 -9.002 1.00 0.00 C ATOM 1845 CD GLN A 743 -19.067 -8.281 -10.441 1.00 0.00 C ATOM 1846 OE1 GLN A 743 -18.284 -7.892 -11.300 1.00 0.00 O ATOM 1847 NE2 GLN A 743 -20.310 -8.554 -10.716 1.00 0.00 N ATOM 0 H GLN A 743 -16.685 -8.211 -6.598 1.00 0.00 H new ATOM 0 HA GLN A 743 -18.864 -6.254 -6.295 1.00 0.00 H new ATOM 0 HB2 GLN A 743 -19.990 -6.929 -8.261 1.00 0.00 H new ATOM 0 HB3 GLN A 743 -18.410 -6.307 -8.695 1.00 0.00 H new ATOM 0 HG2 GLN A 743 -17.576 -8.625 -8.958 1.00 0.00 H new ATOM 0 HG3 GLN A 743 -19.164 -9.239 -8.540 1.00 0.00 H new ATOM 0 HE21 GLN A 743 -20.937 -8.876 -9.978 1.00 0.00 H new ATOM 0 HE22 GLN A 743 -20.657 -8.446 -11.669 1.00 0.00 H new ATOM 1856 N CYS A 744 -20.209 -8.182 -5.383 1.00 0.00 N ATOM 1857 CA CYS A 744 -20.832 -9.274 -4.658 1.00 0.00 C ATOM 1858 C CYS A 744 -21.973 -9.879 -5.417 1.00 0.00 C ATOM 1859 O CYS A 744 -22.715 -9.178 -6.086 1.00 0.00 O ATOM 1860 CB CYS A 744 -21.321 -8.806 -3.318 1.00 0.00 C ATOM 1861 SG CYS A 744 -20.014 -8.370 -2.165 1.00 0.00 S ATOM 0 H CYS A 744 -20.711 -7.295 -5.340 1.00 0.00 H new ATOM 0 HA CYS A 744 -20.068 -10.040 -4.526 1.00 0.00 H new ATOM 0 HB2 CYS A 744 -21.966 -7.939 -3.462 1.00 0.00 H new ATOM 0 HB3 CYS A 744 -21.935 -9.590 -2.874 1.00 0.00 H new ATOM 1866 N VAL A 745 -22.123 -11.167 -5.296 1.00 0.00 N ATOM 1867 CA VAL A 745 -23.172 -11.891 -5.924 1.00 0.00 C ATOM 1868 C VAL A 745 -23.747 -12.808 -4.889 1.00 0.00 C ATOM 1869 O VAL A 745 -23.030 -13.226 -3.965 1.00 0.00 O ATOM 1870 CB VAL A 745 -22.708 -12.694 -7.189 1.00 0.00 C ATOM 1871 CG1 VAL A 745 -22.367 -11.759 -8.341 1.00 0.00 C ATOM 1872 CG2 VAL A 745 -21.517 -13.585 -6.882 1.00 0.00 C ATOM 0 H VAL A 745 -21.498 -11.751 -4.741 1.00 0.00 H new ATOM 0 HA VAL A 745 -23.916 -11.188 -6.298 1.00 0.00 H new ATOM 0 HB VAL A 745 -23.544 -13.327 -7.485 1.00 0.00 H new ATOM 0 HG11 VAL A 745 -22.049 -12.345 -9.203 1.00 0.00 H new ATOM 0 HG12 VAL A 745 -23.246 -11.172 -8.606 1.00 0.00 H new ATOM 0 HG13 VAL A 745 -21.561 -11.090 -8.040 1.00 0.00 H new ATOM 0 HG21 VAL A 745 -21.225 -14.125 -7.783 1.00 0.00 H new ATOM 0 HG22 VAL A 745 -20.683 -12.972 -6.540 1.00 0.00 H new ATOM 0 HG23 VAL A 745 -21.787 -14.298 -6.103 1.00 0.00 H new ATOM 1882 N ALA A 746 -25.010 -13.075 -4.988 1.00 0.00 N ATOM 1883 CA ALA A 746 -25.688 -13.880 -4.016 1.00 0.00 C ATOM 1884 C ALA A 746 -25.323 -15.321 -4.182 1.00 0.00 C ATOM 1885 O ALA A 746 -25.381 -15.860 -5.292 1.00 0.00 O ATOM 1886 CB ALA A 746 -27.185 -13.694 -4.121 1.00 0.00 C ATOM 0 H ALA A 746 -25.604 -12.741 -5.747 1.00 0.00 H new ATOM 0 HA ALA A 746 -25.373 -13.558 -3.023 1.00 0.00 H new ATOM 0 HB1 ALA A 746 -27.682 -14.314 -3.375 1.00 0.00 H new ATOM 0 HB2 ALA A 746 -27.435 -12.647 -3.948 1.00 0.00 H new ATOM 0 HB3 ALA A 746 -27.519 -13.987 -5.116 1.00 0.00 H new ATOM 1892 N ILE A 747 -24.869 -15.906 -3.118 1.00 0.00 N ATOM 1893 CA ILE A 747 -24.562 -17.315 -3.090 1.00 0.00 C ATOM 1894 C ILE A 747 -25.843 -18.111 -3.357 1.00 0.00 C ATOM 1895 O ILE A 747 -26.734 -18.130 -2.490 1.00 0.00 O ATOM 1896 CB ILE A 747 -23.938 -17.740 -1.735 1.00 0.00 C ATOM 1897 CG1 ILE A 747 -22.640 -16.958 -1.483 1.00 0.00 C ATOM 1898 CG2 ILE A 747 -23.672 -19.242 -1.711 1.00 0.00 C ATOM 1899 CD1 ILE A 747 -21.979 -17.261 -0.156 1.00 0.00 C ATOM 1900 OXT ILE A 747 -25.975 -18.701 -4.443 1.00 0.00 O ATOM 0 H ILE A 747 -24.698 -15.423 -2.236 1.00 0.00 H new ATOM 0 HA ILE A 747 -23.825 -17.524 -3.865 1.00 0.00 H new ATOM 0 HB ILE A 747 -24.646 -17.509 -0.939 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -21.936 -17.178 -2.285 1.00 0.00 H new ATOM 0 HG13 ILE A 747 -22.857 -15.891 -1.533 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -23.234 -19.519 -0.752 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -24.610 -19.780 -1.851 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -22.982 -19.502 -2.513 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -21.070 -16.667 -0.058 1.00 0.00 H new ATOM 0 HD12 ILE A 747 -22.663 -17.014 0.656 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -21.727 -18.320 -0.108 1.00 0.00 H new