USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 648 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 682 THR OG1 : rot 180:sc= -0.475 USER MOD Set 1.2: A 683 ASN : amide:sc= -0.962 X(o=-1.4,f=-1.7) USER MOD Single : A 617 ASN : amide:sc= -0.469 K(o=-0.47,f=-1.9) USER MOD Single : A 618 LYS NZ :NH3+ -147:sc= -1.58! (180deg=-1.74!) USER MOD Single : A 633 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 638 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 650 THR OG1 : rot 140:sc= -2.15 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 653 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 654 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 656 SER OG : rot -170:sc= -0.893 USER MOD Single : A 663 HIS : no HD1:sc=-0.00626 X(o=-0.0063,f=0) USER MOD Single : A 674 ASN : amide:sc= -1.31 X(o=-1.3,f=-0.92) USER MOD Single : A 676 LYS NZ :NH3+ -124:sc= -1.94 (180deg=-4.62!) USER MOD Single : A 687 TYR OH : rot 180:sc= -0.0302 USER MOD Single : A 688 ASN : amide:sc=-0.00248 X(o=-0.0025,f=-0.0055) USER MOD Single : A 693 SER OG : rot -25:sc= 1.06 USER MOD Single : A 694 LYS NZ :NH3+ 137:sc= 0.479 (180deg=0) USER MOD Single : A 695 SER OG : rot 180:sc= 0 USER MOD Single : A 698 GLN : amide:sc= -3.56! C(o=-3.6!,f=-3.4!) USER MOD Single : A 704 SER OG : rot 10:sc= 0.0713 USER MOD ----------------------------------------------------------------- ATOM 247 N GLY A 612 175.730 9.513 -2.393 1.00 0.00 N ATOM 248 CA GLY A 612 174.374 9.065 -2.132 1.00 0.00 C ATOM 249 C GLY A 612 174.267 8.174 -0.911 1.00 0.00 C ATOM 250 O GLY A 612 175.263 7.626 -0.439 1.00 0.00 O ATOM 0 HA2 GLY A 612 173.730 9.934 -1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 612 174.002 8.524 -3.003 1.00 0.00 H new ATOM 254 N ARG A 613 173.045 8.017 -0.410 1.00 0.00 N ATOM 255 CA ARG A 613 172.790 7.173 0.752 1.00 0.00 C ATOM 256 C ARG A 613 172.085 5.894 0.319 1.00 0.00 C ATOM 257 O ARG A 613 170.994 5.945 -0.248 1.00 0.00 O ATOM 258 CB ARG A 613 171.933 7.917 1.779 1.00 0.00 C ATOM 259 CG ARG A 613 172.631 9.113 2.406 1.00 0.00 C ATOM 260 CD ARG A 613 172.167 9.340 3.836 1.00 0.00 C ATOM 261 NE ARG A 613 172.588 10.641 4.349 1.00 0.00 N ATOM 262 CZ ARG A 613 173.805 10.892 4.829 1.00 0.00 C ATOM 263 NH1 ARG A 613 174.724 9.936 4.860 1.00 0.00 N ATOM 264 NH2 ARG A 613 174.104 12.104 5.278 1.00 0.00 N ATOM 0 H ARG A 613 172.213 8.466 -0.793 1.00 0.00 H new ATOM 0 HA ARG A 613 173.744 6.920 1.213 1.00 0.00 H new ATOM 0 HB2 ARG A 613 171.015 8.255 1.297 1.00 0.00 H new ATOM 0 HB3 ARG A 613 171.642 7.223 2.567 1.00 0.00 H new ATOM 0 HG2 ARG A 613 173.709 8.955 2.393 1.00 0.00 H new ATOM 0 HG3 ARG A 613 172.432 10.005 1.812 1.00 0.00 H new ATOM 0 HD2 ARG A 613 171.080 9.268 3.880 1.00 0.00 H new ATOM 0 HD3 ARG A 613 172.565 8.552 4.475 1.00 0.00 H new ATOM 0 HE ARG A 613 171.910 11.403 4.339 1.00 0.00 H new ATOM 0 HH11 ARG A 613 174.501 9.002 4.515 1.00 0.00 H new ATOM 0 HH12 ARG A 613 175.654 10.134 5.229 1.00 0.00 H new ATOM 0 HH21 ARG A 613 173.402 12.844 5.256 1.00 0.00 H new ATOM 0 HH22 ARG A 613 175.036 12.296 5.646 1.00 0.00 H new ATOM 278 N VAL A 614 172.710 4.748 0.571 1.00 0.00 N ATOM 279 CA VAL A 614 172.124 3.476 0.181 1.00 0.00 C ATOM 280 C VAL A 614 171.743 2.648 1.399 1.00 0.00 C ATOM 281 O VAL A 614 172.585 2.322 2.229 1.00 0.00 O ATOM 282 CB VAL A 614 173.089 2.664 -0.704 1.00 0.00 C ATOM 283 CG1 VAL A 614 172.433 1.375 -1.176 1.00 0.00 C ATOM 284 CG2 VAL A 614 173.553 3.498 -1.889 1.00 0.00 C ATOM 0 H VAL A 614 173.613 4.676 1.039 1.00 0.00 H new ATOM 0 HA VAL A 614 171.224 3.703 -0.390 1.00 0.00 H new ATOM 0 HB VAL A 614 173.962 2.400 -0.107 1.00 0.00 H new ATOM 0 HG11 VAL A 614 173.132 0.818 -1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 614 172.155 0.771 -0.312 1.00 0.00 H new ATOM 0 HG13 VAL A 614 171.540 1.612 -1.755 1.00 0.00 H new ATOM 0 HG21 VAL A 614 174.234 2.909 -2.504 1.00 0.00 H new ATOM 0 HG22 VAL A 614 172.690 3.795 -2.485 1.00 0.00 H new ATOM 0 HG23 VAL A 614 174.068 4.388 -1.528 1.00 0.00 H new ATOM 294 N ILE A 615 170.467 2.299 1.489 1.00 0.00 N ATOM 295 CA ILE A 615 169.977 1.496 2.597 1.00 0.00 C ATOM 296 C ILE A 615 169.562 0.115 2.105 1.00 0.00 C ATOM 297 O ILE A 615 168.730 -0.009 1.206 1.00 0.00 O ATOM 298 CB ILE A 615 168.787 2.172 3.304 1.00 0.00 C ATOM 299 CG1 ILE A 615 169.155 3.600 3.711 1.00 0.00 C ATOM 300 CG2 ILE A 615 168.368 1.366 4.523 1.00 0.00 C ATOM 301 CD1 ILE A 615 169.013 4.604 2.589 1.00 0.00 C ATOM 0 H ILE A 615 169.754 2.560 0.808 1.00 0.00 H new ATOM 0 HA ILE A 615 170.790 1.398 3.316 1.00 0.00 H new ATOM 0 HB ILE A 615 167.947 2.212 2.610 1.00 0.00 H new ATOM 0 HG12 ILE A 615 168.522 3.906 4.544 1.00 0.00 H new ATOM 0 HG13 ILE A 615 170.184 3.613 4.071 1.00 0.00 H new ATOM 0 HG21 ILE A 615 167.526 1.857 5.012 1.00 0.00 H new ATOM 0 HG22 ILE A 615 168.074 0.363 4.213 1.00 0.00 H new ATOM 0 HG23 ILE A 615 169.203 1.299 5.220 1.00 0.00 H new ATOM 0 HD11 ILE A 615 169.291 5.594 2.950 1.00 0.00 H new ATOM 0 HD12 ILE A 615 169.667 4.322 1.764 1.00 0.00 H new ATOM 0 HD13 ILE A 615 167.979 4.620 2.244 1.00 0.00 H new ATOM 313 N LEU A 616 170.157 -0.920 2.686 1.00 0.00 N ATOM 314 CA LEU A 616 169.857 -2.288 2.288 1.00 0.00 C ATOM 315 C LEU A 616 169.313 -3.104 3.455 1.00 0.00 C ATOM 316 O LEU A 616 169.635 -2.846 4.613 1.00 0.00 O ATOM 317 CB LEU A 616 171.110 -2.957 1.718 1.00 0.00 C ATOM 318 CG LEU A 616 171.207 -2.937 0.194 1.00 0.00 C ATOM 319 CD1 LEU A 616 172.586 -3.380 -0.266 1.00 0.00 C ATOM 320 CD2 LEU A 616 170.131 -3.822 -0.413 1.00 0.00 C ATOM 0 H LEU A 616 170.848 -0.838 3.432 1.00 0.00 H new ATOM 0 HA LEU A 616 169.086 -2.250 1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 616 171.989 -2.462 2.131 1.00 0.00 H new ATOM 0 HB3 LEU A 616 171.138 -3.993 2.057 1.00 0.00 H new ATOM 0 HG LEU A 616 171.050 -1.914 -0.147 1.00 0.00 H new ATOM 0 HD11 LEU A 616 172.631 -3.358 -1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 616 173.340 -2.706 0.142 1.00 0.00 H new ATOM 0 HD13 LEU A 616 172.778 -4.394 0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 616 170.211 -3.799 -1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 616 170.261 -4.846 -0.061 1.00 0.00 H new ATOM 0 HD23 LEU A 616 169.148 -3.457 -0.114 1.00 0.00 H new ATOM 332 N ASN A 617 168.489 -4.094 3.133 1.00 0.00 N ATOM 333 CA ASN A 617 167.894 -4.960 4.143 1.00 0.00 C ATOM 334 C ASN A 617 168.233 -6.418 3.860 1.00 0.00 C ATOM 335 O ASN A 617 167.995 -6.915 2.758 1.00 0.00 O ATOM 336 CB ASN A 617 166.377 -4.774 4.171 1.00 0.00 C ATOM 337 CG ASN A 617 165.963 -3.491 4.865 1.00 0.00 C ATOM 338 OD1 ASN A 617 165.882 -2.432 4.242 1.00 0.00 O ATOM 339 ND2 ASN A 617 165.697 -3.580 6.164 1.00 0.00 N ATOM 0 H ASN A 617 168.217 -4.317 2.176 1.00 0.00 H new ATOM 0 HA ASN A 617 168.303 -4.687 5.116 1.00 0.00 H new ATOM 0 HB2 ASN A 617 165.996 -4.771 3.150 1.00 0.00 H new ATOM 0 HB3 ASN A 617 165.919 -5.623 4.679 1.00 0.00 H new ATOM 0 HD21 ASN A 617 165.413 -2.750 6.684 1.00 0.00 H new ATOM 0 HD22 ASN A 617 165.777 -4.478 6.641 1.00 0.00 H new ATOM 346 N LYS A 618 168.792 -7.102 4.852 1.00 0.00 N ATOM 347 CA LYS A 618 169.163 -8.505 4.696 1.00 0.00 C ATOM 348 C LYS A 618 167.982 -9.420 5.007 1.00 0.00 C ATOM 349 O LYS A 618 168.078 -10.313 5.849 1.00 0.00 O ATOM 350 CB LYS A 618 170.347 -8.850 5.603 1.00 0.00 C ATOM 351 CG LYS A 618 171.396 -7.751 5.691 1.00 0.00 C ATOM 352 CD LYS A 618 172.382 -8.008 6.818 1.00 0.00 C ATOM 353 CE LYS A 618 173.719 -8.505 6.292 1.00 0.00 C ATOM 354 NZ LYS A 618 174.790 -7.480 6.438 1.00 0.00 N ATOM 0 H LYS A 618 168.998 -6.710 5.771 1.00 0.00 H new ATOM 0 HA LYS A 618 169.456 -8.662 3.658 1.00 0.00 H new ATOM 0 HB2 LYS A 618 169.975 -9.064 6.605 1.00 0.00 H new ATOM 0 HB3 LYS A 618 170.819 -9.761 5.237 1.00 0.00 H new ATOM 0 HG2 LYS A 618 171.933 -7.683 4.745 1.00 0.00 H new ATOM 0 HG3 LYS A 618 170.905 -6.790 5.848 1.00 0.00 H new ATOM 0 HD2 LYS A 618 172.533 -7.090 7.386 1.00 0.00 H new ATOM 0 HD3 LYS A 618 171.965 -8.744 7.506 1.00 0.00 H new ATOM 0 HE2 LYS A 618 174.007 -9.409 6.828 1.00 0.00 H new ATOM 0 HE3 LYS A 618 173.617 -8.776 5.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 618 175.462 -7.566 5.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 618 174.365 -6.531 6.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 618 175.291 -7.627 7.337 1.00 0.00 H new ATOM 516 N LEU A 629 172.820 -12.252 1.627 1.00 0.00 N ATOM 517 CA LEU A 629 173.010 -11.128 2.540 1.00 0.00 C ATOM 518 C LEU A 629 172.106 -9.952 2.152 1.00 0.00 C ATOM 519 O LEU A 629 170.957 -9.885 2.589 1.00 0.00 O ATOM 520 CB LEU A 629 174.484 -10.698 2.585 1.00 0.00 C ATOM 521 CG LEU A 629 175.520 -11.798 2.315 1.00 0.00 C ATOM 522 CD1 LEU A 629 175.287 -13.007 3.201 1.00 0.00 C ATOM 523 CD2 LEU A 629 175.526 -12.200 0.846 1.00 0.00 C ATOM 0 HA LEU A 629 172.727 -11.455 3.541 1.00 0.00 H new ATOM 0 HB2 LEU A 629 174.631 -9.902 1.855 1.00 0.00 H new ATOM 0 HB3 LEU A 629 174.686 -10.271 3.567 1.00 0.00 H new ATOM 0 HG LEU A 629 176.500 -11.389 2.558 1.00 0.00 H new ATOM 0 HD11 LEU A 629 176.038 -13.767 2.984 1.00 0.00 H new ATOM 0 HD12 LEU A 629 175.362 -12.711 4.247 1.00 0.00 H new ATOM 0 HD13 LEU A 629 174.294 -13.413 3.009 1.00 0.00 H new ATOM 0 HD21 LEU A 629 176.270 -12.981 0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 629 174.541 -12.574 0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 629 175.772 -11.333 0.233 1.00 0.00 H new ATOM 535 N LEU A 630 172.608 -9.030 1.324 1.00 0.00 N ATOM 536 CA LEU A 630 171.807 -7.885 0.894 1.00 0.00 C ATOM 537 C LEU A 630 171.750 -7.796 -0.632 1.00 0.00 C ATOM 538 O LEU A 630 170.685 -7.545 -1.198 1.00 0.00 O ATOM 539 CB LEU A 630 172.334 -6.569 1.489 1.00 0.00 C ATOM 540 CG LEU A 630 173.787 -6.587 1.959 1.00 0.00 C ATOM 541 CD1 LEU A 630 174.377 -5.185 1.939 1.00 0.00 C ATOM 542 CD2 LEU A 630 173.894 -7.190 3.347 1.00 0.00 C ATOM 0 H LEU A 630 173.554 -9.055 0.943 1.00 0.00 H new ATOM 0 HA LEU A 630 170.795 -8.040 1.269 1.00 0.00 H new ATOM 0 HB2 LEU A 630 172.224 -5.784 0.741 1.00 0.00 H new ATOM 0 HB3 LEU A 630 171.702 -6.295 2.334 1.00 0.00 H new ATOM 0 HG LEU A 630 174.359 -7.209 1.270 1.00 0.00 H new ATOM 0 HD11 LEU A 630 175.412 -5.221 2.277 1.00 0.00 H new ATOM 0 HD12 LEU A 630 174.341 -4.789 0.924 1.00 0.00 H new ATOM 0 HD13 LEU A 630 173.801 -4.538 2.601 1.00 0.00 H new ATOM 0 HD21 LEU A 630 174.937 -7.193 3.663 1.00 0.00 H new ATOM 0 HD22 LEU A 630 173.305 -6.598 4.047 1.00 0.00 H new ATOM 0 HD23 LEU A 630 173.517 -8.213 3.330 1.00 0.00 H new ATOM 554 N GLY A 631 172.883 -8.017 -1.306 1.00 0.00 N ATOM 555 CA GLY A 631 172.876 -7.964 -2.762 1.00 0.00 C ATOM 556 C GLY A 631 174.205 -7.569 -3.400 1.00 0.00 C ATOM 557 O GLY A 631 174.249 -7.302 -4.601 1.00 0.00 O ATOM 0 H GLY A 631 173.786 -8.227 -0.880 1.00 0.00 H new ATOM 0 HA2 GLY A 631 172.583 -8.942 -3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 631 172.112 -7.255 -3.081 1.00 0.00 H new ATOM 561 N LEU A 632 175.287 -7.535 -2.626 1.00 0.00 N ATOM 562 CA LEU A 632 176.592 -7.171 -3.183 1.00 0.00 C ATOM 563 C LEU A 632 177.748 -7.637 -2.292 1.00 0.00 C ATOM 564 O LEU A 632 177.623 -7.716 -1.074 1.00 0.00 O ATOM 565 CB LEU A 632 176.659 -5.653 -3.423 1.00 0.00 C ATOM 566 CG LEU A 632 177.376 -4.820 -2.353 1.00 0.00 C ATOM 567 CD1 LEU A 632 177.223 -3.339 -2.653 1.00 0.00 C ATOM 568 CD2 LEU A 632 176.838 -5.135 -0.966 1.00 0.00 C ATOM 0 H LEU A 632 175.291 -7.750 -1.629 1.00 0.00 H new ATOM 0 HA LEU A 632 176.702 -7.685 -4.138 1.00 0.00 H new ATOM 0 HB2 LEU A 632 177.155 -5.481 -4.378 1.00 0.00 H new ATOM 0 HB3 LEU A 632 175.640 -5.278 -3.521 1.00 0.00 H new ATOM 0 HG LEU A 632 178.435 -5.078 -2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 632 177.736 -2.758 -1.887 1.00 0.00 H new ATOM 0 HD12 LEU A 632 177.658 -3.118 -3.628 1.00 0.00 H new ATOM 0 HD13 LEU A 632 176.165 -3.077 -2.660 1.00 0.00 H new ATOM 0 HD21 LEU A 632 177.363 -4.531 -0.226 1.00 0.00 H new ATOM 0 HD22 LEU A 632 175.772 -4.909 -0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 632 176.992 -6.192 -0.747 1.00 0.00 H new ATOM 580 N LYS A 633 178.885 -7.925 -2.915 1.00 0.00 N ATOM 581 CA LYS A 633 180.069 -8.360 -2.185 1.00 0.00 C ATOM 582 C LYS A 633 181.023 -7.186 -2.016 1.00 0.00 C ATOM 583 O LYS A 633 181.330 -6.490 -2.983 1.00 0.00 O ATOM 584 CB LYS A 633 180.765 -9.499 -2.931 1.00 0.00 C ATOM 585 CG LYS A 633 181.833 -10.206 -2.111 1.00 0.00 C ATOM 586 CD LYS A 633 181.413 -11.621 -1.745 1.00 0.00 C ATOM 587 CE LYS A 633 182.617 -12.513 -1.489 1.00 0.00 C ATOM 588 NZ LYS A 633 183.096 -12.409 -0.083 1.00 0.00 N ATOM 0 H LYS A 633 179.012 -7.865 -3.925 1.00 0.00 H new ATOM 0 HA LYS A 633 179.767 -8.724 -1.203 1.00 0.00 H new ATOM 0 HB2 LYS A 633 180.017 -10.228 -3.242 1.00 0.00 H new ATOM 0 HB3 LYS A 633 181.220 -9.102 -3.839 1.00 0.00 H new ATOM 0 HG2 LYS A 633 182.765 -10.237 -2.676 1.00 0.00 H new ATOM 0 HG3 LYS A 633 182.030 -9.638 -1.202 1.00 0.00 H new ATOM 0 HD2 LYS A 633 180.783 -11.596 -0.856 1.00 0.00 H new ATOM 0 HD3 LYS A 633 180.812 -12.043 -2.550 1.00 0.00 H new ATOM 0 HE2 LYS A 633 182.355 -13.548 -1.708 1.00 0.00 H new ATOM 0 HE3 LYS A 633 183.424 -12.238 -2.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 633 183.918 -13.032 0.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 633 183.370 -11.426 0.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 633 182.335 -12.696 0.565 1.00 0.00 H new ATOM 602 N VAL A 634 181.477 -6.950 -0.789 1.00 0.00 N ATOM 603 CA VAL A 634 182.379 -5.835 -0.526 1.00 0.00 C ATOM 604 C VAL A 634 183.661 -6.283 0.156 1.00 0.00 C ATOM 605 O VAL A 634 183.698 -7.300 0.842 1.00 0.00 O ATOM 606 CB VAL A 634 181.696 -4.755 0.341 1.00 0.00 C ATOM 607 CG1 VAL A 634 182.724 -3.955 1.135 1.00 0.00 C ATOM 608 CG2 VAL A 634 180.856 -3.836 -0.529 1.00 0.00 C ATOM 0 H VAL A 634 181.238 -7.509 0.030 1.00 0.00 H new ATOM 0 HA VAL A 634 182.634 -5.413 -1.498 1.00 0.00 H new ATOM 0 HB VAL A 634 181.041 -5.255 1.055 1.00 0.00 H new ATOM 0 HG11 VAL A 634 182.214 -3.202 1.736 1.00 0.00 H new ATOM 0 HG12 VAL A 634 183.280 -4.626 1.790 1.00 0.00 H new ATOM 0 HG13 VAL A 634 183.413 -3.465 0.448 1.00 0.00 H new ATOM 0 HG21 VAL A 634 180.380 -3.079 0.095 1.00 0.00 H new ATOM 0 HG22 VAL A 634 181.494 -3.349 -1.266 1.00 0.00 H new ATOM 0 HG23 VAL A 634 180.090 -4.419 -1.040 1.00 0.00 H new ATOM 618 N VAL A 635 184.707 -5.493 -0.042 1.00 0.00 N ATOM 619 CA VAL A 635 186.001 -5.770 0.543 1.00 0.00 C ATOM 620 C VAL A 635 186.357 -4.713 1.586 1.00 0.00 C ATOM 621 O VAL A 635 185.811 -3.610 1.576 1.00 0.00 O ATOM 622 CB VAL A 635 187.077 -5.834 -0.561 1.00 0.00 C ATOM 623 CG1 VAL A 635 188.367 -5.149 -0.138 1.00 0.00 C ATOM 624 CG2 VAL A 635 187.324 -7.278 -0.946 1.00 0.00 C ATOM 0 H VAL A 635 184.678 -4.647 -0.611 1.00 0.00 H new ATOM 0 HA VAL A 635 185.960 -6.737 1.045 1.00 0.00 H new ATOM 0 HB VAL A 635 186.708 -5.291 -1.431 1.00 0.00 H new ATOM 0 HG11 VAL A 635 189.097 -5.218 -0.945 1.00 0.00 H new ATOM 0 HG12 VAL A 635 188.167 -4.100 0.082 1.00 0.00 H new ATOM 0 HG13 VAL A 635 188.763 -5.637 0.752 1.00 0.00 H new ATOM 0 HG21 VAL A 635 188.084 -7.322 -1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 635 187.667 -7.834 -0.073 1.00 0.00 H new ATOM 0 HG23 VAL A 635 186.399 -7.719 -1.316 1.00 0.00 H new ATOM 634 N GLY A 636 187.277 -5.056 2.482 1.00 0.00 N ATOM 635 CA GLY A 636 187.690 -4.124 3.515 1.00 0.00 C ATOM 636 C GLY A 636 189.198 -3.984 3.598 1.00 0.00 C ATOM 637 O GLY A 636 189.928 -4.962 3.435 1.00 0.00 O ATOM 0 H GLY A 636 187.744 -5.962 2.511 1.00 0.00 H new ATOM 0 HA2 GLY A 636 187.247 -3.148 3.318 1.00 0.00 H new ATOM 0 HA3 GLY A 636 187.305 -4.459 4.478 1.00 0.00 H new ATOM 641 N GLY A 637 189.665 -2.767 3.852 1.00 0.00 N ATOM 642 CA GLY A 637 191.094 -2.528 3.954 1.00 0.00 C ATOM 643 C GLY A 637 191.745 -2.304 2.602 1.00 0.00 C ATOM 644 O GLY A 637 192.739 -2.950 2.269 1.00 0.00 O ATOM 0 H GLY A 637 189.081 -1.942 3.989 1.00 0.00 H new ATOM 0 HA2 GLY A 637 191.269 -1.658 4.586 1.00 0.00 H new ATOM 0 HA3 GLY A 637 191.567 -3.379 4.445 1.00 0.00 H new ATOM 648 N LYS A 638 191.183 -1.386 1.822 1.00 0.00 N ATOM 649 CA LYS A 638 191.717 -1.076 0.500 1.00 0.00 C ATOM 650 C LYS A 638 192.437 0.268 0.506 1.00 0.00 C ATOM 651 O LYS A 638 191.831 1.309 0.250 1.00 0.00 O ATOM 652 CB LYS A 638 190.591 -1.061 -0.536 1.00 0.00 C ATOM 653 CG LYS A 638 190.147 -2.447 -0.974 1.00 0.00 C ATOM 654 CD LYS A 638 191.061 -3.009 -2.052 1.00 0.00 C ATOM 655 CE LYS A 638 190.269 -3.718 -3.139 1.00 0.00 C ATOM 656 NZ LYS A 638 189.964 -2.814 -4.282 1.00 0.00 N ATOM 0 H LYS A 638 190.359 -0.844 2.082 1.00 0.00 H new ATOM 0 HA LYS A 638 192.436 -1.851 0.234 1.00 0.00 H new ATOM 0 HB2 LYS A 638 189.735 -0.529 -0.122 1.00 0.00 H new ATOM 0 HB3 LYS A 638 190.921 -0.501 -1.411 1.00 0.00 H new ATOM 0 HG2 LYS A 638 190.141 -3.117 -0.114 1.00 0.00 H new ATOM 0 HG3 LYS A 638 189.125 -2.401 -1.349 1.00 0.00 H new ATOM 0 HD2 LYS A 638 191.644 -2.201 -2.494 1.00 0.00 H new ATOM 0 HD3 LYS A 638 191.769 -3.705 -1.603 1.00 0.00 H new ATOM 0 HE2 LYS A 638 190.834 -4.579 -3.497 1.00 0.00 H new ATOM 0 HE3 LYS A 638 189.338 -4.100 -2.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 638 189.423 -3.335 -5.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 638 189.403 -2.006 -3.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 638 190.852 -2.469 -4.699 1.00 0.00 H new ATOM 763 N LEU A 645 192.311 3.580 4.328 1.00 0.00 N ATOM 764 CA LEU A 645 191.662 2.335 3.933 1.00 0.00 C ATOM 765 C LEU A 645 190.164 2.538 3.734 1.00 0.00 C ATOM 766 O LEU A 645 189.559 3.416 4.350 1.00 0.00 O ATOM 767 CB LEU A 645 191.906 1.252 4.985 1.00 0.00 C ATOM 768 CG LEU A 645 193.370 0.856 5.179 1.00 0.00 C ATOM 769 CD1 LEU A 645 193.494 -0.223 6.244 1.00 0.00 C ATOM 770 CD2 LEU A 645 193.971 0.382 3.864 1.00 0.00 C ATOM 0 HA LEU A 645 192.095 2.016 2.985 1.00 0.00 H new ATOM 0 HB2 LEU A 645 191.510 1.598 5.940 1.00 0.00 H new ATOM 0 HB3 LEU A 645 191.339 0.363 4.708 1.00 0.00 H new ATOM 0 HG LEU A 645 193.924 1.733 5.514 1.00 0.00 H new ATOM 0 HD11 LEU A 645 194.543 -0.492 6.369 1.00 0.00 H new ATOM 0 HD12 LEU A 645 193.101 0.152 7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 645 192.927 -1.103 5.939 1.00 0.00 H new ATOM 0 HD21 LEU A 645 195.013 0.104 4.020 1.00 0.00 H new ATOM 0 HD22 LEU A 645 193.415 -0.482 3.501 1.00 0.00 H new ATOM 0 HD23 LEU A 645 193.915 1.184 3.128 1.00 0.00 H new ATOM 782 N GLY A 646 189.571 1.722 2.869 1.00 0.00 N ATOM 783 CA GLY A 646 188.148 1.829 2.603 1.00 0.00 C ATOM 784 C GLY A 646 187.535 0.509 2.178 1.00 0.00 C ATOM 785 O GLY A 646 188.134 -0.550 2.364 1.00 0.00 O ATOM 0 H GLY A 646 190.050 0.988 2.347 1.00 0.00 H new ATOM 0 HA2 GLY A 646 187.641 2.190 3.498 1.00 0.00 H new ATOM 0 HA3 GLY A 646 187.983 2.571 1.822 1.00 0.00 H new ATOM 789 N ALA A 647 186.336 0.573 1.606 1.00 0.00 N ATOM 790 CA ALA A 647 185.640 -0.625 1.155 1.00 0.00 C ATOM 791 C ALA A 647 185.307 -0.545 -0.331 1.00 0.00 C ATOM 792 O ALA A 647 185.013 0.528 -0.855 1.00 0.00 O ATOM 793 CB ALA A 647 184.372 -0.839 1.968 1.00 0.00 C ATOM 0 H ALA A 647 185.827 1.442 1.444 1.00 0.00 H new ATOM 0 HA ALA A 647 186.305 -1.475 1.306 1.00 0.00 H new ATOM 0 HB1 ALA A 647 183.863 -1.738 1.619 1.00 0.00 H new ATOM 0 HB2 ALA A 647 184.630 -0.954 3.021 1.00 0.00 H new ATOM 0 HB3 ALA A 647 183.713 0.021 1.847 1.00 0.00 H new ATOM 799 N PHE A 648 185.352 -1.693 -1.003 1.00 0.00 N ATOM 800 CA PHE A 648 185.051 -1.759 -2.428 1.00 0.00 C ATOM 801 C PHE A 648 184.187 -2.976 -2.738 1.00 0.00 C ATOM 802 O PHE A 648 184.375 -4.045 -2.158 1.00 0.00 O ATOM 803 CB PHE A 648 186.345 -1.815 -3.242 1.00 0.00 C ATOM 804 CG PHE A 648 187.046 -0.491 -3.348 1.00 0.00 C ATOM 805 CD1 PHE A 648 187.909 -0.067 -2.350 1.00 0.00 C ATOM 806 CD2 PHE A 648 186.841 0.331 -4.444 1.00 0.00 C ATOM 807 CE1 PHE A 648 188.555 1.150 -2.444 1.00 0.00 C ATOM 808 CE2 PHE A 648 187.484 1.550 -4.544 1.00 0.00 C ATOM 809 CZ PHE A 648 188.342 1.960 -3.542 1.00 0.00 C ATOM 0 H PHE A 648 185.594 -2.590 -0.582 1.00 0.00 H new ATOM 0 HA PHE A 648 184.499 -0.861 -2.703 1.00 0.00 H new ATOM 0 HB2 PHE A 648 187.020 -2.539 -2.786 1.00 0.00 H new ATOM 0 HB3 PHE A 648 186.118 -2.178 -4.244 1.00 0.00 H new ATOM 0 HD1 PHE A 648 188.078 -0.696 -1.488 1.00 0.00 H new ATOM 0 HD2 PHE A 648 186.171 0.015 -5.230 1.00 0.00 H new ATOM 0 HE1 PHE A 648 189.226 1.468 -1.660 1.00 0.00 H new ATOM 0 HE2 PHE A 648 187.316 2.181 -5.404 1.00 0.00 H new ATOM 0 HZ PHE A 648 188.845 2.913 -3.617 1.00 0.00 H new ATOM 819 N ILE A 649 183.236 -2.809 -3.651 1.00 0.00 N ATOM 820 CA ILE A 649 182.345 -3.901 -4.028 1.00 0.00 C ATOM 821 C ILE A 649 182.980 -4.784 -5.102 1.00 0.00 C ATOM 822 O ILE A 649 183.319 -4.313 -6.187 1.00 0.00 O ATOM 823 CB ILE A 649 180.987 -3.370 -4.538 1.00 0.00 C ATOM 824 CG1 ILE A 649 180.249 -2.631 -3.419 1.00 0.00 C ATOM 825 CG2 ILE A 649 180.128 -4.507 -5.075 1.00 0.00 C ATOM 826 CD1 ILE A 649 179.303 -1.563 -3.925 1.00 0.00 C ATOM 0 H ILE A 649 183.063 -1.932 -4.142 1.00 0.00 H new ATOM 0 HA ILE A 649 182.175 -4.497 -3.131 1.00 0.00 H new ATOM 0 HB ILE A 649 181.179 -2.672 -5.353 1.00 0.00 H new ATOM 0 HG12 ILE A 649 179.687 -3.353 -2.827 1.00 0.00 H new ATOM 0 HG13 ILE A 649 180.980 -2.172 -2.753 1.00 0.00 H new ATOM 0 HG21 ILE A 649 179.177 -4.109 -5.428 1.00 0.00 H new ATOM 0 HG22 ILE A 649 180.646 -4.996 -5.900 1.00 0.00 H new ATOM 0 HG23 ILE A 649 179.946 -5.231 -4.281 1.00 0.00 H new ATOM 0 HD11 ILE A 649 178.814 -1.080 -3.079 1.00 0.00 H new ATOM 0 HD12 ILE A 649 179.863 -0.820 -4.493 1.00 0.00 H new ATOM 0 HD13 ILE A 649 178.550 -2.019 -4.568 1.00 0.00 H new ATOM 838 N THR A 650 183.146 -6.064 -4.783 1.00 0.00 N ATOM 839 CA THR A 650 183.750 -7.012 -5.714 1.00 0.00 C ATOM 840 C THR A 650 182.737 -7.510 -6.744 1.00 0.00 C ATOM 841 O THR A 650 183.101 -7.814 -7.880 1.00 0.00 O ATOM 842 CB THR A 650 184.347 -8.197 -4.953 1.00 0.00 C ATOM 843 OG1 THR A 650 183.327 -9.061 -4.489 1.00 0.00 O ATOM 844 CG2 THR A 650 185.181 -7.786 -3.760 1.00 0.00 C ATOM 0 H THR A 650 182.871 -6.469 -3.888 1.00 0.00 H new ATOM 0 HA THR A 650 184.544 -6.490 -6.248 1.00 0.00 H new ATOM 0 HB THR A 650 184.995 -8.702 -5.670 1.00 0.00 H new ATOM 0 HG1 THR A 650 183.611 -9.992 -4.601 1.00 0.00 H new ATOM 0 HG21 THR A 650 185.573 -8.675 -3.267 1.00 0.00 H new ATOM 0 HG22 THR A 650 186.009 -7.161 -4.093 1.00 0.00 H new ATOM 0 HG23 THR A 650 184.562 -7.226 -3.059 1.00 0.00 H new ATOM 852 N LYS A 651 181.469 -7.598 -6.349 1.00 0.00 N ATOM 853 CA LYS A 651 180.426 -8.066 -7.258 1.00 0.00 C ATOM 854 C LYS A 651 179.029 -7.796 -6.701 1.00 0.00 C ATOM 855 O LYS A 651 178.831 -7.728 -5.490 1.00 0.00 O ATOM 856 CB LYS A 651 180.597 -9.564 -7.537 1.00 0.00 C ATOM 857 CG LYS A 651 180.262 -10.456 -6.351 1.00 0.00 C ATOM 858 CD LYS A 651 180.808 -11.863 -6.541 1.00 0.00 C ATOM 859 CE LYS A 651 179.806 -12.760 -7.250 1.00 0.00 C ATOM 860 NZ LYS A 651 180.457 -13.611 -8.285 1.00 0.00 N ATOM 0 H LYS A 651 181.141 -7.354 -5.415 1.00 0.00 H new ATOM 0 HA LYS A 651 180.529 -7.510 -8.190 1.00 0.00 H new ATOM 0 HB2 LYS A 651 179.962 -9.841 -8.378 1.00 0.00 H new ATOM 0 HB3 LYS A 651 181.627 -9.751 -7.840 1.00 0.00 H new ATOM 0 HG2 LYS A 651 180.676 -10.023 -5.440 1.00 0.00 H new ATOM 0 HG3 LYS A 651 179.181 -10.499 -6.220 1.00 0.00 H new ATOM 0 HD2 LYS A 651 181.732 -11.821 -7.118 1.00 0.00 H new ATOM 0 HD3 LYS A 651 181.058 -12.291 -5.570 1.00 0.00 H new ATOM 0 HE2 LYS A 651 179.307 -13.396 -6.519 1.00 0.00 H new ATOM 0 HE3 LYS A 651 179.036 -12.146 -7.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 651 179.740 -14.208 -8.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 651 180.912 -13.005 -8.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 651 181.174 -14.216 -7.836 1.00 0.00 H new ATOM 874 N VAL A 652 178.064 -7.648 -7.606 1.00 0.00 N ATOM 875 CA VAL A 652 176.677 -7.390 -7.223 1.00 0.00 C ATOM 876 C VAL A 652 175.748 -8.451 -7.802 1.00 0.00 C ATOM 877 O VAL A 652 175.868 -8.825 -8.969 1.00 0.00 O ATOM 878 CB VAL A 652 176.192 -5.998 -7.696 1.00 0.00 C ATOM 879 CG1 VAL A 652 176.152 -5.014 -6.538 1.00 0.00 C ATOM 880 CG2 VAL A 652 177.067 -5.467 -8.821 1.00 0.00 C ATOM 0 H VAL A 652 178.218 -7.702 -8.613 1.00 0.00 H new ATOM 0 HA VAL A 652 176.647 -7.421 -6.134 1.00 0.00 H new ATOM 0 HB VAL A 652 175.179 -6.112 -8.081 1.00 0.00 H new ATOM 0 HG11 VAL A 652 175.808 -4.044 -6.897 1.00 0.00 H new ATOM 0 HG12 VAL A 652 175.469 -5.381 -5.772 1.00 0.00 H new ATOM 0 HG13 VAL A 652 177.151 -4.911 -6.114 1.00 0.00 H new ATOM 0 HG21 VAL A 652 176.703 -4.488 -9.134 1.00 0.00 H new ATOM 0 HG22 VAL A 652 178.095 -5.377 -8.471 1.00 0.00 H new ATOM 0 HG23 VAL A 652 177.030 -6.155 -9.666 1.00 0.00 H new ATOM 890 N LYS A 653 174.818 -8.930 -6.983 1.00 0.00 N ATOM 891 CA LYS A 653 173.866 -9.944 -7.423 1.00 0.00 C ATOM 892 C LYS A 653 172.735 -9.308 -8.225 1.00 0.00 C ATOM 893 O LYS A 653 171.862 -8.645 -7.665 1.00 0.00 O ATOM 894 CB LYS A 653 173.298 -10.700 -6.218 1.00 0.00 C ATOM 895 CG LYS A 653 173.821 -12.121 -6.089 1.00 0.00 C ATOM 896 CD LYS A 653 173.038 -13.084 -6.969 1.00 0.00 C ATOM 897 CE LYS A 653 172.008 -13.863 -6.167 1.00 0.00 C ATOM 898 NZ LYS A 653 172.093 -15.326 -6.427 1.00 0.00 N ATOM 0 H LYS A 653 174.703 -8.634 -6.014 1.00 0.00 H new ATOM 0 HA LYS A 653 174.391 -10.651 -8.066 1.00 0.00 H new ATOM 0 HB2 LYS A 653 173.538 -10.150 -5.308 1.00 0.00 H new ATOM 0 HB3 LYS A 653 172.211 -10.728 -6.296 1.00 0.00 H new ATOM 0 HG2 LYS A 653 174.875 -12.149 -6.365 1.00 0.00 H new ATOM 0 HG3 LYS A 653 173.756 -12.441 -5.049 1.00 0.00 H new ATOM 0 HD2 LYS A 653 172.538 -12.528 -7.762 1.00 0.00 H new ATOM 0 HD3 LYS A 653 173.726 -13.779 -7.451 1.00 0.00 H new ATOM 0 HE2 LYS A 653 172.157 -13.674 -5.104 1.00 0.00 H new ATOM 0 HE3 LYS A 653 171.008 -13.507 -6.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 171.374 -15.821 -5.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 171.926 -15.509 -7.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 173.038 -15.671 -6.165 1.00 0.00 H new ATOM 912 N LYS A 654 172.758 -9.512 -9.538 1.00 0.00 N ATOM 913 CA LYS A 654 171.735 -8.957 -10.418 1.00 0.00 C ATOM 914 C LYS A 654 170.344 -9.425 -10.001 1.00 0.00 C ATOM 915 O LYS A 654 169.941 -10.549 -10.301 1.00 0.00 O ATOM 916 CB LYS A 654 172.007 -9.356 -11.869 1.00 0.00 C ATOM 917 CG LYS A 654 172.849 -8.345 -12.631 1.00 0.00 C ATOM 918 CD LYS A 654 173.338 -8.911 -13.954 1.00 0.00 C ATOM 919 CE LYS A 654 174.462 -8.071 -14.538 1.00 0.00 C ATOM 920 NZ LYS A 654 174.470 -8.110 -16.027 1.00 0.00 N ATOM 0 H LYS A 654 173.474 -10.058 -10.017 1.00 0.00 H new ATOM 0 HA LYS A 654 171.772 -7.871 -10.335 1.00 0.00 H new ATOM 0 HB2 LYS A 654 172.513 -10.321 -11.883 1.00 0.00 H new ATOM 0 HB3 LYS A 654 171.056 -9.487 -12.385 1.00 0.00 H new ATOM 0 HG2 LYS A 654 172.262 -7.445 -12.814 1.00 0.00 H new ATOM 0 HG3 LYS A 654 173.704 -8.050 -12.022 1.00 0.00 H new ATOM 0 HD2 LYS A 654 173.685 -9.934 -13.807 1.00 0.00 H new ATOM 0 HD3 LYS A 654 172.509 -8.954 -14.661 1.00 0.00 H new ATOM 0 HE2 LYS A 654 174.356 -7.039 -14.203 1.00 0.00 H new ATOM 0 HE3 LYS A 654 175.419 -8.432 -14.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 654 175.251 -7.525 -16.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 654 174.597 -9.091 -16.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 654 173.567 -7.742 -16.389 1.00 0.00 H new ATOM 934 N GLY A 655 169.615 -8.557 -9.307 1.00 0.00 N ATOM 935 CA GLY A 655 168.279 -8.900 -8.859 1.00 0.00 C ATOM 936 C GLY A 655 168.118 -8.761 -7.357 1.00 0.00 C ATOM 937 O GLY A 655 167.004 -8.608 -6.858 1.00 0.00 O ATOM 0 H GLY A 655 169.927 -7.621 -9.047 1.00 0.00 H new ATOM 0 HA2 GLY A 655 167.555 -8.258 -9.360 1.00 0.00 H new ATOM 0 HA3 GLY A 655 168.053 -9.925 -9.152 1.00 0.00 H new ATOM 941 N SER A 656 169.235 -8.812 -6.636 1.00 0.00 N ATOM 942 CA SER A 656 169.211 -8.690 -5.185 1.00 0.00 C ATOM 943 C SER A 656 168.831 -7.274 -4.765 1.00 0.00 C ATOM 944 O SER A 656 168.731 -6.375 -5.600 1.00 0.00 O ATOM 945 CB SER A 656 170.575 -9.060 -4.597 1.00 0.00 C ATOM 946 OG SER A 656 170.763 -10.465 -4.588 1.00 0.00 O ATOM 0 H SER A 656 170.166 -8.937 -7.034 1.00 0.00 H new ATOM 0 HA SER A 656 168.459 -9.379 -4.800 1.00 0.00 H new ATOM 0 HB2 SER A 656 171.366 -8.588 -5.180 1.00 0.00 H new ATOM 0 HB3 SER A 656 170.654 -8.673 -3.581 1.00 0.00 H new ATOM 0 HG SER A 656 171.565 -10.684 -4.069 1.00 0.00 H new ATOM 952 N LEU A 657 168.619 -7.085 -3.468 1.00 0.00 N ATOM 953 CA LEU A 657 168.247 -5.779 -2.936 1.00 0.00 C ATOM 954 C LEU A 657 169.288 -4.725 -3.292 1.00 0.00 C ATOM 955 O LEU A 657 168.962 -3.668 -3.831 1.00 0.00 O ATOM 956 CB LEU A 657 168.085 -5.852 -1.417 1.00 0.00 C ATOM 957 CG LEU A 657 167.075 -6.891 -0.923 1.00 0.00 C ATOM 958 CD1 LEU A 657 167.687 -7.758 0.169 1.00 0.00 C ATOM 959 CD2 LEU A 657 165.812 -6.208 -0.421 1.00 0.00 C ATOM 0 H LEU A 657 168.698 -7.820 -2.765 1.00 0.00 H new ATOM 0 HA LEU A 657 167.297 -5.492 -3.387 1.00 0.00 H new ATOM 0 HB2 LEU A 657 169.056 -6.072 -0.973 1.00 0.00 H new ATOM 0 HB3 LEU A 657 167.782 -4.871 -1.051 1.00 0.00 H new ATOM 0 HG LEU A 657 166.808 -7.536 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 657 166.953 -8.490 0.507 1.00 0.00 H new ATOM 0 HD12 LEU A 657 168.561 -8.276 -0.225 1.00 0.00 H new ATOM 0 HD13 LEU A 657 167.985 -7.130 1.008 1.00 0.00 H new ATOM 0 HD21 LEU A 657 165.105 -6.961 -0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 657 166.063 -5.539 0.402 1.00 0.00 H new ATOM 0 HD23 LEU A 657 165.362 -5.634 -1.231 1.00 0.00 H new ATOM 971 N ALA A 658 170.542 -5.022 -2.981 1.00 0.00 N ATOM 972 CA ALA A 658 171.646 -4.105 -3.254 1.00 0.00 C ATOM 973 C ALA A 658 171.590 -3.560 -4.679 1.00 0.00 C ATOM 974 O ALA A 658 172.069 -2.460 -4.951 1.00 0.00 O ATOM 975 CB ALA A 658 172.976 -4.800 -3.010 1.00 0.00 C ATOM 0 H ALA A 658 170.824 -5.896 -2.537 1.00 0.00 H new ATOM 0 HA ALA A 658 171.550 -3.259 -2.573 1.00 0.00 H new ATOM 0 HB1 ALA A 658 173.792 -4.107 -3.217 1.00 0.00 H new ATOM 0 HB2 ALA A 658 173.031 -5.126 -1.971 1.00 0.00 H new ATOM 0 HB3 ALA A 658 173.060 -5.666 -3.667 1.00 0.00 H new ATOM 981 N ASP A 659 171.016 -4.338 -5.588 1.00 0.00 N ATOM 982 CA ASP A 659 170.917 -3.929 -6.986 1.00 0.00 C ATOM 983 C ASP A 659 169.627 -3.160 -7.260 1.00 0.00 C ATOM 984 O ASP A 659 169.648 -2.089 -7.866 1.00 0.00 O ATOM 985 CB ASP A 659 170.995 -5.155 -7.900 1.00 0.00 C ATOM 986 CG ASP A 659 171.882 -4.919 -9.106 1.00 0.00 C ATOM 987 OD1 ASP A 659 171.505 -4.098 -9.970 1.00 0.00 O ATOM 988 OD2 ASP A 659 172.953 -5.557 -9.189 1.00 0.00 O ATOM 0 H ASP A 659 170.613 -5.253 -5.385 1.00 0.00 H new ATOM 0 HA ASP A 659 171.755 -3.263 -7.195 1.00 0.00 H new ATOM 0 HB2 ASP A 659 171.376 -6.004 -7.333 1.00 0.00 H new ATOM 0 HB3 ASP A 659 169.992 -5.419 -8.236 1.00 0.00 H new ATOM 993 N VAL A 660 168.508 -3.723 -6.828 1.00 0.00 N ATOM 994 CA VAL A 660 167.203 -3.098 -7.044 1.00 0.00 C ATOM 995 C VAL A 660 166.991 -1.874 -6.153 1.00 0.00 C ATOM 996 O VAL A 660 166.525 -0.837 -6.620 1.00 0.00 O ATOM 997 CB VAL A 660 166.041 -4.091 -6.821 1.00 0.00 C ATOM 998 CG1 VAL A 660 165.793 -4.909 -8.079 1.00 0.00 C ATOM 999 CG2 VAL A 660 166.315 -5.000 -5.631 1.00 0.00 C ATOM 0 H VAL A 660 168.473 -4.610 -6.326 1.00 0.00 H new ATOM 0 HA VAL A 660 167.202 -2.777 -8.086 1.00 0.00 H new ATOM 0 HB VAL A 660 165.142 -3.516 -6.599 1.00 0.00 H new ATOM 0 HG11 VAL A 660 164.971 -5.604 -7.905 1.00 0.00 H new ATOM 0 HG12 VAL A 660 165.536 -4.242 -8.902 1.00 0.00 H new ATOM 0 HG13 VAL A 660 166.693 -5.468 -8.333 1.00 0.00 H new ATOM 0 HG21 VAL A 660 165.480 -5.688 -5.499 1.00 0.00 H new ATOM 0 HG22 VAL A 660 167.228 -5.568 -5.810 1.00 0.00 H new ATOM 0 HG23 VAL A 660 166.433 -4.396 -4.731 1.00 0.00 H new ATOM 1009 N VAL A 661 167.323 -1.996 -4.870 1.00 0.00 N ATOM 1010 CA VAL A 661 167.150 -0.887 -3.937 1.00 0.00 C ATOM 1011 C VAL A 661 168.452 -0.117 -3.731 1.00 0.00 C ATOM 1012 O VAL A 661 168.437 1.087 -3.477 1.00 0.00 O ATOM 1013 CB VAL A 661 166.617 -1.371 -2.571 1.00 0.00 C ATOM 1014 CG1 VAL A 661 167.605 -2.315 -1.903 1.00 0.00 C ATOM 1015 CG2 VAL A 661 166.307 -0.186 -1.668 1.00 0.00 C ATOM 0 H VAL A 661 167.710 -2.844 -4.456 1.00 0.00 H new ATOM 0 HA VAL A 661 166.414 -0.219 -4.384 1.00 0.00 H new ATOM 0 HB VAL A 661 165.693 -1.922 -2.744 1.00 0.00 H new ATOM 0 HG11 VAL A 661 167.205 -2.641 -0.943 1.00 0.00 H new ATOM 0 HG12 VAL A 661 167.767 -3.183 -2.542 1.00 0.00 H new ATOM 0 HG13 VAL A 661 168.552 -1.799 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 661 165.933 -0.547 -0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 661 167.214 0.396 -1.507 1.00 0.00 H new ATOM 0 HG23 VAL A 661 165.552 0.443 -2.139 1.00 0.00 H new ATOM 1025 N GLY A 662 169.578 -0.815 -3.845 1.00 0.00 N ATOM 1026 CA GLY A 662 170.868 -0.170 -3.671 1.00 0.00 C ATOM 1027 C GLY A 662 171.318 0.553 -4.926 1.00 0.00 C ATOM 1028 O GLY A 662 171.604 1.750 -4.894 1.00 0.00 O ATOM 0 H GLY A 662 169.621 -1.812 -4.054 1.00 0.00 H new ATOM 0 HA2 GLY A 662 170.810 0.539 -2.846 1.00 0.00 H new ATOM 0 HA3 GLY A 662 171.613 -0.917 -3.397 1.00 0.00 H new ATOM 1032 N HIS A 663 171.366 -0.178 -6.035 1.00 0.00 N ATOM 1033 CA HIS A 663 171.769 0.388 -7.319 1.00 0.00 C ATOM 1034 C HIS A 663 173.262 0.724 -7.355 1.00 0.00 C ATOM 1035 O HIS A 663 173.643 1.887 -7.490 1.00 0.00 O ATOM 1036 CB HIS A 663 170.936 1.636 -7.635 1.00 0.00 C ATOM 1037 CG HIS A 663 170.022 1.462 -8.807 1.00 0.00 C ATOM 1038 ND1 HIS A 663 170.196 2.125 -10.005 1.00 0.00 N ATOM 1039 CD2 HIS A 663 168.918 0.691 -8.964 1.00 0.00 C ATOM 1040 CE1 HIS A 663 169.241 1.770 -10.845 1.00 0.00 C ATOM 1041 NE2 HIS A 663 168.453 0.902 -10.238 1.00 0.00 N ATOM 0 H HIS A 663 171.129 -1.170 -6.071 1.00 0.00 H new ATOM 0 HA HIS A 663 171.586 -0.369 -8.081 1.00 0.00 H new ATOM 0 HB2 HIS A 663 170.344 1.900 -6.759 1.00 0.00 H new ATOM 0 HB3 HIS A 663 171.608 2.472 -7.829 1.00 0.00 H new ATOM 0 HD2 HIS A 663 168.485 0.033 -8.225 1.00 0.00 H new ATOM 0 HE1 HIS A 663 169.124 2.129 -11.857 1.00 0.00 H new ATOM 0 HE2 HIS A 663 167.631 0.460 -10.649 1.00 0.00 H new ATOM 1050 N LEU A 664 174.105 -0.302 -7.266 1.00 0.00 N ATOM 1051 CA LEU A 664 175.548 -0.109 -7.324 1.00 0.00 C ATOM 1052 C LEU A 664 176.195 -1.256 -8.088 1.00 0.00 C ATOM 1053 O LEU A 664 175.527 -2.225 -8.450 1.00 0.00 O ATOM 1054 CB LEU A 664 176.168 0.024 -5.926 1.00 0.00 C ATOM 1055 CG LEU A 664 175.517 -0.805 -4.819 1.00 0.00 C ATOM 1056 CD1 LEU A 664 174.144 -0.257 -4.479 1.00 0.00 C ATOM 1057 CD2 LEU A 664 175.429 -2.264 -5.228 1.00 0.00 C ATOM 0 H LEU A 664 173.813 -1.273 -7.154 1.00 0.00 H new ATOM 0 HA LEU A 664 175.737 0.827 -7.850 1.00 0.00 H new ATOM 0 HB2 LEU A 664 177.220 -0.255 -5.989 1.00 0.00 H new ATOM 0 HB3 LEU A 664 176.133 1.074 -5.634 1.00 0.00 H new ATOM 0 HG LEU A 664 176.140 -0.738 -3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 664 173.697 -0.860 -3.689 1.00 0.00 H new ATOM 0 HD12 LEU A 664 174.238 0.774 -4.139 1.00 0.00 H new ATOM 0 HD13 LEU A 664 173.509 -0.291 -5.365 1.00 0.00 H new ATOM 0 HD21 LEU A 664 174.963 -2.839 -4.428 1.00 0.00 H new ATOM 0 HD22 LEU A 664 174.830 -2.352 -6.134 1.00 0.00 H new ATOM 0 HD23 LEU A 664 176.431 -2.650 -5.416 1.00 0.00 H new ATOM 1069 N ARG A 665 177.489 -1.138 -8.343 1.00 0.00 N ATOM 1070 CA ARG A 665 178.209 -2.167 -9.081 1.00 0.00 C ATOM 1071 C ARG A 665 179.604 -2.382 -8.510 1.00 0.00 C ATOM 1072 O ARG A 665 180.125 -1.541 -7.778 1.00 0.00 O ATOM 1073 CB ARG A 665 178.309 -1.789 -10.560 1.00 0.00 C ATOM 1074 CG ARG A 665 176.966 -1.759 -11.273 1.00 0.00 C ATOM 1075 CD ARG A 665 176.944 -0.710 -12.373 1.00 0.00 C ATOM 1076 NE ARG A 665 175.612 -0.554 -12.955 1.00 0.00 N ATOM 1077 CZ ARG A 665 175.365 0.136 -14.066 1.00 0.00 C ATOM 1078 NH1 ARG A 665 176.353 0.734 -14.719 1.00 0.00 N ATOM 1079 NH2 ARG A 665 174.124 0.227 -14.526 1.00 0.00 N ATOM 0 H ARG A 665 178.061 -0.345 -8.052 1.00 0.00 H new ATOM 0 HA ARG A 665 177.651 -3.098 -8.983 1.00 0.00 H new ATOM 0 HB2 ARG A 665 178.778 -0.809 -10.645 1.00 0.00 H new ATOM 0 HB3 ARG A 665 178.963 -2.500 -11.065 1.00 0.00 H new ATOM 0 HG2 ARG A 665 176.757 -2.740 -11.700 1.00 0.00 H new ATOM 0 HG3 ARG A 665 176.175 -1.550 -10.553 1.00 0.00 H new ATOM 0 HD2 ARG A 665 177.277 0.246 -11.969 1.00 0.00 H new ATOM 0 HD3 ARG A 665 177.651 -0.989 -13.155 1.00 0.00 H new ATOM 0 HE ARG A 665 174.826 -1.000 -12.482 1.00 0.00 H new ATOM 0 HH11 ARG A 665 177.309 0.667 -14.370 1.00 0.00 H new ATOM 0 HH12 ARG A 665 176.156 1.261 -15.570 1.00 0.00 H new ATOM 0 HH21 ARG A 665 173.361 -0.231 -14.028 1.00 0.00 H new ATOM 0 HH22 ARG A 665 173.933 0.755 -15.377 1.00 0.00 H new ATOM 1093 N ALA A 666 180.206 -3.517 -8.853 1.00 0.00 N ATOM 1094 CA ALA A 666 181.543 -3.845 -8.380 1.00 0.00 C ATOM 1095 C ALA A 666 182.532 -2.748 -8.745 1.00 0.00 C ATOM 1096 O ALA A 666 182.673 -2.388 -9.914 1.00 0.00 O ATOM 1097 CB ALA A 666 181.995 -5.177 -8.953 1.00 0.00 C ATOM 0 H ALA A 666 179.787 -4.224 -9.457 1.00 0.00 H new ATOM 0 HA ALA A 666 181.509 -3.925 -7.293 1.00 0.00 H new ATOM 0 HB1 ALA A 666 182.996 -5.408 -8.590 1.00 0.00 H new ATOM 0 HB2 ALA A 666 181.305 -5.961 -8.639 1.00 0.00 H new ATOM 0 HB3 ALA A 666 182.008 -5.119 -10.041 1.00 0.00 H new ATOM 1103 N GLY A 667 183.207 -2.212 -7.737 1.00 0.00 N ATOM 1104 CA GLY A 667 184.167 -1.151 -7.968 1.00 0.00 C ATOM 1105 C GLY A 667 183.850 0.086 -7.153 1.00 0.00 C ATOM 1106 O GLY A 667 184.731 0.899 -6.873 1.00 0.00 O ATOM 0 H GLY A 667 183.107 -2.494 -6.762 1.00 0.00 H new ATOM 0 HA2 GLY A 667 185.167 -1.505 -7.716 1.00 0.00 H new ATOM 0 HA3 GLY A 667 184.177 -0.895 -9.027 1.00 0.00 H new ATOM 1110 N ASP A 668 182.584 0.226 -6.766 1.00 0.00 N ATOM 1111 CA ASP A 668 182.149 1.368 -5.973 1.00 0.00 C ATOM 1112 C ASP A 668 182.825 1.357 -4.606 1.00 0.00 C ATOM 1113 O ASP A 668 183.055 0.296 -4.026 1.00 0.00 O ATOM 1114 CB ASP A 668 180.626 1.352 -5.808 1.00 0.00 C ATOM 1115 CG ASP A 668 179.956 2.515 -6.511 1.00 0.00 C ATOM 1116 OD1 ASP A 668 180.505 3.636 -6.460 1.00 0.00 O ATOM 1117 OD2 ASP A 668 178.882 2.306 -7.114 1.00 0.00 O ATOM 0 H ASP A 668 181.843 -0.438 -6.990 1.00 0.00 H new ATOM 0 HA ASP A 668 182.436 2.280 -6.496 1.00 0.00 H new ATOM 0 HB2 ASP A 668 180.230 0.416 -6.202 1.00 0.00 H new ATOM 0 HB3 ASP A 668 180.378 1.381 -4.747 1.00 0.00 H new ATOM 1122 N GLU A 669 183.144 2.541 -4.099 1.00 0.00 N ATOM 1123 CA GLU A 669 183.797 2.661 -2.803 1.00 0.00 C ATOM 1124 C GLU A 669 182.807 3.095 -1.728 1.00 0.00 C ATOM 1125 O GLU A 669 182.287 4.210 -1.765 1.00 0.00 O ATOM 1126 CB GLU A 669 184.952 3.660 -2.881 1.00 0.00 C ATOM 1127 CG GLU A 669 185.919 3.565 -1.712 1.00 0.00 C ATOM 1128 CD GLU A 669 186.807 4.788 -1.588 1.00 0.00 C ATOM 1129 OE1 GLU A 669 186.390 5.874 -2.045 1.00 0.00 O ATOM 1130 OE2 GLU A 669 187.919 4.660 -1.033 1.00 0.00 O ATOM 0 H GLU A 669 182.961 3.430 -4.565 1.00 0.00 H new ATOM 0 HA GLU A 669 184.189 1.681 -2.533 1.00 0.00 H new ATOM 0 HB2 GLU A 669 185.500 3.497 -3.809 1.00 0.00 H new ATOM 0 HB3 GLU A 669 184.545 4.670 -2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 669 185.355 3.435 -0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 669 186.542 2.679 -1.832 1.00 0.00 H new ATOM 1137 N VAL A 670 182.556 2.212 -0.768 1.00 0.00 N ATOM 1138 CA VAL A 670 181.634 2.513 0.320 1.00 0.00 C ATOM 1139 C VAL A 670 182.389 3.062 1.526 1.00 0.00 C ATOM 1140 O VAL A 670 183.055 2.319 2.244 1.00 0.00 O ATOM 1141 CB VAL A 670 180.825 1.266 0.748 1.00 0.00 C ATOM 1142 CG1 VAL A 670 180.080 1.514 2.054 1.00 0.00 C ATOM 1143 CG2 VAL A 670 179.853 0.861 -0.349 1.00 0.00 C ATOM 0 H VAL A 670 182.977 1.284 -0.721 1.00 0.00 H new ATOM 0 HA VAL A 670 180.937 3.265 -0.050 1.00 0.00 H new ATOM 0 HB VAL A 670 181.528 0.449 0.912 1.00 0.00 H new ATOM 0 HG11 VAL A 670 179.521 0.620 2.329 1.00 0.00 H new ATOM 0 HG12 VAL A 670 180.795 1.751 2.842 1.00 0.00 H new ATOM 0 HG13 VAL A 670 179.390 2.349 1.927 1.00 0.00 H new ATOM 0 HG21 VAL A 670 179.292 -0.018 -0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 670 179.162 1.681 -0.544 1.00 0.00 H new ATOM 0 HG23 VAL A 670 180.407 0.629 -1.259 1.00 0.00 H new ATOM 1153 N LEU A 671 182.276 4.367 1.742 1.00 0.00 N ATOM 1154 CA LEU A 671 182.948 5.012 2.865 1.00 0.00 C ATOM 1155 C LEU A 671 182.120 4.895 4.145 1.00 0.00 C ATOM 1156 O LEU A 671 182.514 5.406 5.193 1.00 0.00 O ATOM 1157 CB LEU A 671 183.215 6.489 2.554 1.00 0.00 C ATOM 1158 CG LEU A 671 183.915 6.769 1.219 1.00 0.00 C ATOM 1159 CD1 LEU A 671 184.992 5.731 0.938 1.00 0.00 C ATOM 1160 CD2 LEU A 671 182.902 6.809 0.084 1.00 0.00 C ATOM 0 H LEU A 671 181.728 4.998 1.157 1.00 0.00 H new ATOM 0 HA LEU A 671 183.898 4.501 3.020 1.00 0.00 H new ATOM 0 HB2 LEU A 671 182.264 7.021 2.564 1.00 0.00 H new ATOM 0 HB3 LEU A 671 183.822 6.907 3.357 1.00 0.00 H new ATOM 0 HG LEU A 671 184.397 7.744 1.288 1.00 0.00 H new ATOM 0 HD11 LEU A 671 185.472 5.954 -0.015 1.00 0.00 H new ATOM 0 HD12 LEU A 671 185.736 5.755 1.734 1.00 0.00 H new ATOM 0 HD13 LEU A 671 184.540 4.740 0.894 1.00 0.00 H new ATOM 0 HD21 LEU A 671 183.416 7.009 -0.856 1.00 0.00 H new ATOM 0 HD22 LEU A 671 182.389 5.849 0.020 1.00 0.00 H new ATOM 0 HD23 LEU A 671 182.174 7.598 0.274 1.00 0.00 H new ATOM 1172 N GLU A 672 180.968 4.233 4.056 1.00 0.00 N ATOM 1173 CA GLU A 672 180.096 4.072 5.212 1.00 0.00 C ATOM 1174 C GLU A 672 179.350 2.742 5.173 1.00 0.00 C ATOM 1175 O GLU A 672 178.694 2.417 4.185 1.00 0.00 O ATOM 1176 CB GLU A 672 179.092 5.219 5.264 1.00 0.00 C ATOM 1177 CG GLU A 672 179.677 6.513 5.805 1.00 0.00 C ATOM 1178 CD GLU A 672 178.681 7.302 6.633 1.00 0.00 C ATOM 1179 OE1 GLU A 672 177.906 6.674 7.385 1.00 0.00 O ATOM 1180 OE2 GLU A 672 178.679 8.546 6.531 1.00 0.00 O ATOM 0 H GLU A 672 180.620 3.802 3.199 1.00 0.00 H new ATOM 0 HA GLU A 672 180.721 4.083 6.105 1.00 0.00 H new ATOM 0 HB2 GLU A 672 178.703 5.397 4.261 1.00 0.00 H new ATOM 0 HB3 GLU A 672 178.247 4.924 5.886 1.00 0.00 H new ATOM 0 HG2 GLU A 672 180.551 6.285 6.415 1.00 0.00 H new ATOM 0 HG3 GLU A 672 180.020 7.128 4.973 1.00 0.00 H new ATOM 1187 N TRP A 673 179.443 1.987 6.261 1.00 0.00 N ATOM 1188 CA TRP A 673 178.766 0.700 6.367 1.00 0.00 C ATOM 1189 C TRP A 673 177.999 0.614 7.682 1.00 0.00 C ATOM 1190 O TRP A 673 178.594 0.614 8.758 1.00 0.00 O ATOM 1191 CB TRP A 673 179.778 -0.442 6.283 1.00 0.00 C ATOM 1192 CG TRP A 673 179.152 -1.764 5.962 1.00 0.00 C ATOM 1193 CD1 TRP A 673 178.431 -2.557 6.808 1.00 0.00 C ATOM 1194 CD2 TRP A 673 179.194 -2.447 4.707 1.00 0.00 C ATOM 1195 NE1 TRP A 673 178.021 -3.693 6.152 1.00 0.00 N ATOM 1196 CE2 TRP A 673 178.479 -3.649 4.860 1.00 0.00 C ATOM 1197 CE3 TRP A 673 179.768 -2.157 3.467 1.00 0.00 C ATOM 1198 CZ2 TRP A 673 178.322 -4.559 3.817 1.00 0.00 C ATOM 1199 CZ3 TRP A 673 179.612 -3.061 2.436 1.00 0.00 C ATOM 1200 CH2 TRP A 673 178.894 -4.250 2.616 1.00 0.00 C ATOM 0 H TRP A 673 179.984 2.246 7.086 1.00 0.00 H new ATOM 0 HA TRP A 673 178.063 0.611 5.539 1.00 0.00 H new ATOM 0 HB2 TRP A 673 180.521 -0.205 5.521 1.00 0.00 H new ATOM 0 HB3 TRP A 673 180.308 -0.519 7.232 1.00 0.00 H new ATOM 0 HD1 TRP A 673 178.215 -2.326 7.841 1.00 0.00 H new ATOM 0 HE1 TRP A 673 177.467 -4.446 6.560 1.00 0.00 H new ATOM 0 HE3 TRP A 673 180.323 -1.243 3.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 673 177.768 -5.476 3.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 673 180.052 -2.848 1.473 1.00 0.00 H new ATOM 0 HH2 TRP A 673 178.791 -4.936 1.788 1.00 0.00 H new ATOM 1211 N ASN A 674 176.676 0.551 7.590 1.00 0.00 N ATOM 1212 CA ASN A 674 175.832 0.474 8.778 1.00 0.00 C ATOM 1213 C ASN A 674 175.917 1.766 9.585 1.00 0.00 C ATOM 1214 O ASN A 674 175.914 1.745 10.815 1.00 0.00 O ATOM 1215 CB ASN A 674 176.237 -0.717 9.650 1.00 0.00 C ATOM 1216 CG ASN A 674 175.245 -0.980 10.767 1.00 0.00 C ATOM 1217 OD1 ASN A 674 175.568 -0.835 11.946 1.00 0.00 O ATOM 1218 ND2 ASN A 674 174.031 -1.370 10.400 1.00 0.00 N ATOM 0 H ASN A 674 176.165 0.552 6.707 1.00 0.00 H new ATOM 0 HA ASN A 674 174.801 0.335 8.452 1.00 0.00 H new ATOM 0 HB2 ASN A 674 176.323 -1.607 9.027 1.00 0.00 H new ATOM 0 HB3 ASN A 674 177.222 -0.532 10.079 1.00 0.00 H new ATOM 0 HD21 ASN A 674 173.322 -1.563 11.107 1.00 0.00 H new ATOM 0 HD22 ASN A 674 173.807 -1.477 9.411 1.00 0.00 H new ATOM 1225 N GLY A 675 175.983 2.889 8.878 1.00 0.00 N ATOM 1226 CA GLY A 675 176.059 4.182 9.534 1.00 0.00 C ATOM 1227 C GLY A 675 177.379 4.418 10.245 1.00 0.00 C ATOM 1228 O GLY A 675 177.480 5.308 11.090 1.00 0.00 O ATOM 0 H GLY A 675 175.985 2.927 7.859 1.00 0.00 H new ATOM 0 HA2 GLY A 675 175.908 4.967 8.793 1.00 0.00 H new ATOM 0 HA3 GLY A 675 175.246 4.264 10.255 1.00 0.00 H new ATOM 1232 N LYS A 676 178.396 3.626 9.912 1.00 0.00 N ATOM 1233 CA LYS A 676 179.706 3.769 10.537 1.00 0.00 C ATOM 1234 C LYS A 676 180.738 4.248 9.531 1.00 0.00 C ATOM 1235 O LYS A 676 180.677 3.893 8.353 1.00 0.00 O ATOM 1236 CB LYS A 676 180.153 2.429 11.148 1.00 0.00 C ATOM 1237 CG LYS A 676 181.489 1.884 10.617 1.00 0.00 C ATOM 1238 CD LYS A 676 182.558 1.872 11.700 1.00 0.00 C ATOM 1239 CE LYS A 676 182.112 1.079 12.919 1.00 0.00 C ATOM 1240 NZ LYS A 676 183.255 0.401 13.592 1.00 0.00 N ATOM 0 H LYS A 676 178.338 2.882 9.216 1.00 0.00 H new ATOM 0 HA LYS A 676 179.624 4.514 11.328 1.00 0.00 H new ATOM 0 HB2 LYS A 676 180.231 2.548 12.229 1.00 0.00 H new ATOM 0 HB3 LYS A 676 179.377 1.686 10.964 1.00 0.00 H new ATOM 0 HG2 LYS A 676 181.345 0.873 10.236 1.00 0.00 H new ATOM 0 HG3 LYS A 676 181.825 2.495 9.780 1.00 0.00 H new ATOM 0 HD2 LYS A 676 183.476 1.441 11.301 1.00 0.00 H new ATOM 0 HD3 LYS A 676 182.789 2.895 11.996 1.00 0.00 H new ATOM 0 HE2 LYS A 676 181.619 1.747 13.626 1.00 0.00 H new ATOM 0 HE3 LYS A 676 181.375 0.334 12.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 183.065 -0.620 13.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 184.124 0.558 13.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 183.375 0.790 14.549 1.00 0.00 H new ATOM 1254 N PRO A 677 181.728 5.032 9.981 1.00 0.00 N ATOM 1255 CA PRO A 677 182.780 5.504 9.101 1.00 0.00 C ATOM 1256 C PRO A 677 183.847 4.432 8.909 1.00 0.00 C ATOM 1257 O PRO A 677 184.489 3.994 9.865 1.00 0.00 O ATOM 1258 CB PRO A 677 183.346 6.700 9.863 1.00 0.00 C ATOM 1259 CG PRO A 677 183.152 6.352 11.301 1.00 0.00 C ATOM 1260 CD PRO A 677 181.914 5.491 11.371 1.00 0.00 C ATOM 0 HA PRO A 677 182.427 5.754 8.100 1.00 0.00 H new ATOM 0 HB2 PRO A 677 184.400 6.856 9.631 1.00 0.00 H new ATOM 0 HB3 PRO A 677 182.823 7.620 9.603 1.00 0.00 H new ATOM 0 HG2 PRO A 677 184.018 5.818 11.691 1.00 0.00 H new ATOM 0 HG3 PRO A 677 183.034 7.251 11.905 1.00 0.00 H new ATOM 0 HD2 PRO A 677 182.047 4.653 12.055 1.00 0.00 H new ATOM 0 HD3 PRO A 677 181.052 6.057 11.725 1.00 0.00 H new ATOM 1268 N LEU A 678 184.019 4.013 7.667 1.00 0.00 N ATOM 1269 CA LEU A 678 184.995 2.986 7.323 1.00 0.00 C ATOM 1270 C LEU A 678 186.377 3.573 7.007 1.00 0.00 C ATOM 1271 O LEU A 678 187.393 2.958 7.331 1.00 0.00 O ATOM 1272 CB LEU A 678 184.495 2.166 6.133 1.00 0.00 C ATOM 1273 CG LEU A 678 183.097 1.569 6.304 1.00 0.00 C ATOM 1274 CD1 LEU A 678 182.563 1.063 4.972 1.00 0.00 C ATOM 1275 CD2 LEU A 678 183.114 0.452 7.342 1.00 0.00 C ATOM 0 H LEU A 678 183.491 4.371 6.871 1.00 0.00 H new ATOM 0 HA LEU A 678 185.107 2.343 8.196 1.00 0.00 H new ATOM 0 HB2 LEU A 678 184.497 2.800 5.247 1.00 0.00 H new ATOM 0 HB3 LEU A 678 185.200 1.356 5.947 1.00 0.00 H new ATOM 0 HG LEU A 678 182.429 2.354 6.660 1.00 0.00 H new ATOM 0 HD11 LEU A 678 181.568 0.642 5.115 1.00 0.00 H new ATOM 0 HD12 LEU A 678 182.509 1.890 4.264 1.00 0.00 H new ATOM 0 HD13 LEU A 678 183.229 0.294 4.581 1.00 0.00 H new ATOM 0 HD21 LEU A 678 182.111 0.040 7.450 1.00 0.00 H new ATOM 0 HD22 LEU A 678 183.796 -0.334 7.019 1.00 0.00 H new ATOM 0 HD23 LEU A 678 183.447 0.851 8.300 1.00 0.00 H new ATOM 1287 N PRO A 679 186.451 4.761 6.366 1.00 0.00 N ATOM 1288 CA PRO A 679 187.733 5.386 6.021 1.00 0.00 C ATOM 1289 C PRO A 679 188.767 5.261 7.136 1.00 0.00 C ATOM 1290 O PRO A 679 188.601 5.821 8.220 1.00 0.00 O ATOM 1291 CB PRO A 679 187.346 6.843 5.796 1.00 0.00 C ATOM 1292 CG PRO A 679 185.963 6.771 5.251 1.00 0.00 C ATOM 1293 CD PRO A 679 185.309 5.587 5.918 1.00 0.00 C ATOM 0 HA PRO A 679 188.206 4.914 5.160 1.00 0.00 H new ATOM 0 HB2 PRO A 679 187.379 7.412 6.725 1.00 0.00 H new ATOM 0 HB3 PRO A 679 188.025 7.333 5.098 1.00 0.00 H new ATOM 0 HG2 PRO A 679 185.414 7.689 5.461 1.00 0.00 H new ATOM 0 HG3 PRO A 679 185.977 6.649 4.168 1.00 0.00 H new ATOM 0 HD2 PRO A 679 184.684 5.895 6.757 1.00 0.00 H new ATOM 0 HD3 PRO A 679 184.668 5.041 5.226 1.00 0.00 H new ATOM 1301 N GLY A 680 189.832 4.516 6.857 1.00 0.00 N ATOM 1302 CA GLY A 680 190.881 4.318 7.841 1.00 0.00 C ATOM 1303 C GLY A 680 190.848 2.931 8.458 1.00 0.00 C ATOM 1304 O GLY A 680 191.797 2.519 9.125 1.00 0.00 O ATOM 0 H GLY A 680 189.988 4.045 5.966 1.00 0.00 H new ATOM 0 HA2 GLY A 680 191.851 4.479 7.370 1.00 0.00 H new ATOM 0 HA3 GLY A 680 190.781 5.065 8.629 1.00 0.00 H new ATOM 1308 N ALA A 681 189.752 2.208 8.237 1.00 0.00 N ATOM 1309 CA ALA A 681 189.602 0.862 8.778 1.00 0.00 C ATOM 1310 C ALA A 681 190.128 -0.184 7.799 1.00 0.00 C ATOM 1311 O ALA A 681 189.884 -0.101 6.596 1.00 0.00 O ATOM 1312 CB ALA A 681 188.144 0.593 9.117 1.00 0.00 C ATOM 0 H ALA A 681 188.956 2.533 7.687 1.00 0.00 H new ATOM 0 HA ALA A 681 190.193 0.792 9.691 1.00 0.00 H new ATOM 0 HB1 ALA A 681 188.044 -0.415 9.520 1.00 0.00 H new ATOM 0 HB2 ALA A 681 187.804 1.316 9.858 1.00 0.00 H new ATOM 0 HB3 ALA A 681 187.538 0.685 8.216 1.00 0.00 H new ATOM 1318 N THR A 682 190.853 -1.165 8.326 1.00 0.00 N ATOM 1319 CA THR A 682 191.417 -2.228 7.502 1.00 0.00 C ATOM 1320 C THR A 682 190.431 -3.381 7.349 1.00 0.00 C ATOM 1321 O THR A 682 189.328 -3.345 7.897 1.00 0.00 O ATOM 1322 CB THR A 682 192.729 -2.729 8.114 1.00 0.00 C ATOM 1323 OG1 THR A 682 193.194 -3.888 7.441 1.00 0.00 O ATOM 1324 CG2 THR A 682 192.611 -3.062 9.586 1.00 0.00 C ATOM 0 H THR A 682 191.064 -1.246 9.321 1.00 0.00 H new ATOM 0 HA THR A 682 191.620 -1.822 6.511 1.00 0.00 H new ATOM 0 HB THR A 682 193.433 -1.905 8.000 1.00 0.00 H new ATOM 0 HG1 THR A 682 194.033 -4.188 7.848 1.00 0.00 H new ATOM 0 HG21 THR A 682 193.574 -3.411 9.958 1.00 0.00 H new ATOM 0 HG22 THR A 682 192.310 -2.171 10.137 1.00 0.00 H new ATOM 0 HG23 THR A 682 191.864 -3.844 9.723 1.00 0.00 H new ATOM 1332 N ASN A 683 190.833 -4.401 6.598 1.00 0.00 N ATOM 1333 CA ASN A 683 189.987 -5.568 6.364 1.00 0.00 C ATOM 1334 C ASN A 683 189.410 -6.107 7.670 1.00 0.00 C ATOM 1335 O ASN A 683 188.220 -6.410 7.754 1.00 0.00 O ATOM 1336 CB ASN A 683 190.784 -6.666 5.657 1.00 0.00 C ATOM 1337 CG ASN A 683 191.946 -7.166 6.493 1.00 0.00 C ATOM 1338 OD1 ASN A 683 191.782 -8.037 7.347 1.00 0.00 O ATOM 1339 ND2 ASN A 683 193.129 -6.614 6.252 1.00 0.00 N ATOM 0 H ASN A 683 191.743 -4.444 6.139 1.00 0.00 H new ATOM 0 HA ASN A 683 189.158 -5.256 5.728 1.00 0.00 H new ATOM 0 HB2 ASN A 683 190.122 -7.500 5.425 1.00 0.00 H new ATOM 0 HB3 ASN A 683 191.160 -6.284 4.708 1.00 0.00 H new ATOM 0 HD21 ASN A 683 193.947 -6.909 6.784 1.00 0.00 H new ATOM 0 HD22 ASN A 683 193.220 -5.895 5.534 1.00 0.00 H new ATOM 1346 N GLU A 684 190.259 -6.230 8.684 1.00 0.00 N ATOM 1347 CA GLU A 684 189.828 -6.737 9.981 1.00 0.00 C ATOM 1348 C GLU A 684 188.813 -5.803 10.624 1.00 0.00 C ATOM 1349 O GLU A 684 187.853 -6.255 11.250 1.00 0.00 O ATOM 1350 CB GLU A 684 191.033 -6.932 10.906 1.00 0.00 C ATOM 1351 CG GLU A 684 191.273 -8.381 11.296 1.00 0.00 C ATOM 1352 CD GLU A 684 192.671 -8.617 11.832 1.00 0.00 C ATOM 1353 OE1 GLU A 684 193.618 -8.671 11.019 1.00 0.00 O ATOM 1354 OE2 GLU A 684 192.820 -8.747 13.065 1.00 0.00 O ATOM 0 H GLU A 684 191.248 -5.986 8.633 1.00 0.00 H new ATOM 0 HA GLU A 684 189.347 -7.702 9.823 1.00 0.00 H new ATOM 0 HB2 GLU A 684 191.925 -6.545 10.413 1.00 0.00 H new ATOM 0 HB3 GLU A 684 190.886 -6.341 11.810 1.00 0.00 H new ATOM 0 HG2 GLU A 684 190.544 -8.676 12.051 1.00 0.00 H new ATOM 0 HG3 GLU A 684 191.108 -9.019 10.428 1.00 0.00 H new ATOM 1361 N GLU A 685 189.017 -4.503 10.457 1.00 0.00 N ATOM 1362 CA GLU A 685 188.098 -3.523 11.015 1.00 0.00 C ATOM 1363 C GLU A 685 186.722 -3.699 10.390 1.00 0.00 C ATOM 1364 O GLU A 685 185.746 -3.990 11.079 1.00 0.00 O ATOM 1365 CB GLU A 685 188.615 -2.105 10.769 1.00 0.00 C ATOM 1366 CG GLU A 685 188.684 -1.254 12.028 1.00 0.00 C ATOM 1367 CD GLU A 685 189.601 -1.843 13.081 1.00 0.00 C ATOM 1368 OE1 GLU A 685 189.176 -2.789 13.777 1.00 0.00 O ATOM 1369 OE2 GLU A 685 190.745 -1.359 13.210 1.00 0.00 O ATOM 0 H GLU A 685 189.804 -4.106 9.944 1.00 0.00 H new ATOM 0 HA GLU A 685 188.024 -3.678 12.091 1.00 0.00 H new ATOM 0 HB2 GLU A 685 189.608 -2.162 10.324 1.00 0.00 H new ATOM 0 HB3 GLU A 685 187.968 -1.613 10.043 1.00 0.00 H new ATOM 0 HG2 GLU A 685 189.031 -0.254 11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 685 187.682 -1.145 12.444 1.00 0.00 H new ATOM 1376 N VAL A 686 186.662 -3.541 9.071 1.00 0.00 N ATOM 1377 CA VAL A 686 185.416 -3.700 8.334 1.00 0.00 C ATOM 1378 C VAL A 686 184.716 -4.998 8.725 1.00 0.00 C ATOM 1379 O VAL A 686 183.502 -5.024 8.925 1.00 0.00 O ATOM 1380 CB VAL A 686 185.667 -3.693 6.811 1.00 0.00 C ATOM 1381 CG1 VAL A 686 184.376 -3.953 6.049 1.00 0.00 C ATOM 1382 CG2 VAL A 686 186.291 -2.375 6.381 1.00 0.00 C ATOM 0 H VAL A 686 187.466 -3.302 8.490 1.00 0.00 H new ATOM 0 HA VAL A 686 184.776 -2.856 8.591 1.00 0.00 H new ATOM 0 HB VAL A 686 186.365 -4.496 6.575 1.00 0.00 H new ATOM 0 HG11 VAL A 686 184.578 -3.943 4.978 1.00 0.00 H new ATOM 0 HG12 VAL A 686 183.975 -4.926 6.334 1.00 0.00 H new ATOM 0 HG13 VAL A 686 183.649 -3.177 6.288 1.00 0.00 H new ATOM 0 HG21 VAL A 686 186.461 -2.387 5.304 1.00 0.00 H new ATOM 0 HG22 VAL A 686 185.619 -1.555 6.633 1.00 0.00 H new ATOM 0 HG23 VAL A 686 187.241 -2.237 6.897 1.00 0.00 H new ATOM 1392 N TYR A 687 185.494 -6.071 8.837 1.00 0.00 N ATOM 1393 CA TYR A 687 184.952 -7.375 9.211 1.00 0.00 C ATOM 1394 C TYR A 687 184.033 -7.251 10.422 1.00 0.00 C ATOM 1395 O TYR A 687 182.945 -7.822 10.448 1.00 0.00 O ATOM 1396 CB TYR A 687 186.085 -8.361 9.521 1.00 0.00 C ATOM 1397 CG TYR A 687 186.928 -8.748 8.320 1.00 0.00 C ATOM 1398 CD1 TYR A 687 186.521 -8.458 7.022 1.00 0.00 C ATOM 1399 CD2 TYR A 687 188.140 -9.410 8.491 1.00 0.00 C ATOM 1400 CE1 TYR A 687 187.294 -8.814 5.934 1.00 0.00 C ATOM 1401 CE2 TYR A 687 188.917 -9.769 7.406 1.00 0.00 C ATOM 1402 CZ TYR A 687 188.490 -9.469 6.131 1.00 0.00 C ATOM 1403 OH TYR A 687 189.261 -9.825 5.048 1.00 0.00 O ATOM 0 H TYR A 687 186.501 -6.064 8.674 1.00 0.00 H new ATOM 0 HA TYR A 687 184.374 -7.752 8.368 1.00 0.00 H new ATOM 0 HB2 TYR A 687 186.734 -7.922 10.279 1.00 0.00 H new ATOM 0 HB3 TYR A 687 185.655 -9.264 9.954 1.00 0.00 H new ATOM 0 HD1 TYR A 687 185.584 -7.945 6.862 1.00 0.00 H new ATOM 0 HD2 TYR A 687 188.479 -9.647 9.489 1.00 0.00 H new ATOM 0 HE1 TYR A 687 186.962 -8.580 4.933 1.00 0.00 H new ATOM 0 HE2 TYR A 687 189.855 -10.283 7.557 1.00 0.00 H new ATOM 0 HH TYR A 687 190.073 -10.278 5.359 1.00 0.00 H new ATOM 1413 N ASN A 688 184.483 -6.499 11.416 1.00 0.00 N ATOM 1414 CA ASN A 688 183.704 -6.291 12.631 1.00 0.00 C ATOM 1415 C ASN A 688 182.481 -5.425 12.352 1.00 0.00 C ATOM 1416 O ASN A 688 181.391 -5.689 12.859 1.00 0.00 O ATOM 1417 CB ASN A 688 184.570 -5.638 13.711 1.00 0.00 C ATOM 1418 CG ASN A 688 185.756 -6.499 14.101 1.00 0.00 C ATOM 1419 OD1 ASN A 688 185.600 -7.665 14.462 1.00 0.00 O ATOM 1420 ND2 ASN A 688 186.952 -5.926 14.030 1.00 0.00 N ATOM 0 H ASN A 688 185.384 -6.022 11.406 1.00 0.00 H new ATOM 0 HA ASN A 688 183.364 -7.264 12.986 1.00 0.00 H new ATOM 0 HB2 ASN A 688 184.928 -4.673 13.352 1.00 0.00 H new ATOM 0 HB3 ASN A 688 183.960 -5.443 14.593 1.00 0.00 H new ATOM 0 HD21 ASN A 688 187.787 -6.456 14.280 1.00 0.00 H new ATOM 0 HD22 ASN A 688 187.036 -4.956 13.725 1.00 0.00 H new ATOM 1427 N ILE A 689 182.670 -4.389 11.540 1.00 0.00 N ATOM 1428 CA ILE A 689 181.584 -3.481 11.191 1.00 0.00 C ATOM 1429 C ILE A 689 180.458 -4.219 10.470 1.00 0.00 C ATOM 1430 O ILE A 689 179.347 -4.337 10.988 1.00 0.00 O ATOM 1431 CB ILE A 689 182.092 -2.319 10.305 1.00 0.00 C ATOM 1432 CG1 ILE A 689 182.896 -1.326 11.144 1.00 0.00 C ATOM 1433 CG2 ILE A 689 180.936 -1.609 9.611 1.00 0.00 C ATOM 1434 CD1 ILE A 689 184.354 -1.696 11.296 1.00 0.00 C ATOM 0 H ILE A 689 183.566 -4.158 11.111 1.00 0.00 H new ATOM 0 HA ILE A 689 181.195 -3.070 12.123 1.00 0.00 H new ATOM 0 HB ILE A 689 182.740 -2.740 9.536 1.00 0.00 H new ATOM 0 HG12 ILE A 689 182.827 -0.339 10.687 1.00 0.00 H new ATOM 0 HG13 ILE A 689 182.445 -1.251 12.133 1.00 0.00 H new ATOM 0 HG21 ILE A 689 181.324 -0.797 8.996 1.00 0.00 H new ATOM 0 HG22 ILE A 689 180.400 -2.318 8.980 1.00 0.00 H new ATOM 0 HG23 ILE A 689 180.256 -1.203 10.360 1.00 0.00 H new ATOM 0 HD11 ILE A 689 184.859 -0.945 11.903 1.00 0.00 H new ATOM 0 HD12 ILE A 689 184.434 -2.669 11.782 1.00 0.00 H new ATOM 0 HD13 ILE A 689 184.822 -1.742 10.313 1.00 0.00 H new ATOM 1446 N ILE A 690 180.751 -4.706 9.268 1.00 0.00 N ATOM 1447 CA ILE A 690 179.762 -5.423 8.468 1.00 0.00 C ATOM 1448 C ILE A 690 179.114 -6.557 9.259 1.00 0.00 C ATOM 1449 O ILE A 690 177.889 -6.633 9.356 1.00 0.00 O ATOM 1450 CB ILE A 690 180.392 -5.986 7.179 1.00 0.00 C ATOM 1451 CG1 ILE A 690 181.065 -4.852 6.390 1.00 0.00 C ATOM 1452 CG2 ILE A 690 179.333 -6.687 6.335 1.00 0.00 C ATOM 1453 CD1 ILE A 690 181.366 -5.190 4.943 1.00 0.00 C ATOM 0 H ILE A 690 181.666 -4.617 8.826 1.00 0.00 H new ATOM 0 HA ILE A 690 178.989 -4.703 8.200 1.00 0.00 H new ATOM 0 HB ILE A 690 181.152 -6.721 7.442 1.00 0.00 H new ATOM 0 HG12 ILE A 690 180.421 -3.973 6.419 1.00 0.00 H new ATOM 0 HG13 ILE A 690 181.996 -4.581 6.889 1.00 0.00 H new ATOM 0 HG21 ILE A 690 179.792 -7.080 5.428 1.00 0.00 H new ATOM 0 HG22 ILE A 690 178.897 -7.507 6.906 1.00 0.00 H new ATOM 0 HG23 ILE A 690 178.551 -5.976 6.068 1.00 0.00 H new ATOM 0 HD11 ILE A 690 181.840 -4.335 4.461 1.00 0.00 H new ATOM 0 HD12 ILE A 690 182.037 -6.048 4.902 1.00 0.00 H new ATOM 0 HD13 ILE A 690 180.438 -5.430 4.425 1.00 0.00 H new ATOM 1465 N LEU A 691 179.937 -7.436 9.826 1.00 0.00 N ATOM 1466 CA LEU A 691 179.428 -8.561 10.609 1.00 0.00 C ATOM 1467 C LEU A 691 178.478 -8.081 11.695 1.00 0.00 C ATOM 1468 O LEU A 691 177.365 -8.587 11.835 1.00 0.00 O ATOM 1469 CB LEU A 691 180.586 -9.336 11.235 1.00 0.00 C ATOM 1470 CG LEU A 691 181.309 -10.308 10.298 1.00 0.00 C ATOM 1471 CD1 LEU A 691 181.295 -9.796 8.863 1.00 0.00 C ATOM 1472 CD2 LEU A 691 182.739 -10.535 10.768 1.00 0.00 C ATOM 0 H LEU A 691 180.954 -7.392 9.759 1.00 0.00 H new ATOM 0 HA LEU A 691 178.878 -9.220 9.937 1.00 0.00 H new ATOM 0 HB2 LEU A 691 181.313 -8.621 11.620 1.00 0.00 H new ATOM 0 HB3 LEU A 691 180.206 -9.896 12.089 1.00 0.00 H new ATOM 0 HG LEU A 691 180.778 -11.260 10.323 1.00 0.00 H new ATOM 0 HD11 LEU A 691 181.815 -10.505 8.219 1.00 0.00 H new ATOM 0 HD12 LEU A 691 180.264 -9.687 8.526 1.00 0.00 H new ATOM 0 HD13 LEU A 691 181.796 -8.829 8.817 1.00 0.00 H new ATOM 0 HD21 LEU A 691 183.239 -11.228 10.091 1.00 0.00 H new ATOM 0 HD22 LEU A 691 183.275 -9.586 10.776 1.00 0.00 H new ATOM 0 HD23 LEU A 691 182.729 -10.954 11.774 1.00 0.00 H new ATOM 1484 N GLU A 692 178.923 -7.096 12.459 1.00 0.00 N ATOM 1485 CA GLU A 692 178.112 -6.536 13.534 1.00 0.00 C ATOM 1486 C GLU A 692 176.767 -6.048 13.000 1.00 0.00 C ATOM 1487 O GLU A 692 175.783 -5.982 13.736 1.00 0.00 O ATOM 1488 CB GLU A 692 178.852 -5.382 14.214 1.00 0.00 C ATOM 1489 CG GLU A 692 179.813 -5.832 15.302 1.00 0.00 C ATOM 1490 CD GLU A 692 180.402 -4.670 16.076 1.00 0.00 C ATOM 1491 OE1 GLU A 692 180.567 -3.583 15.483 1.00 0.00 O ATOM 1492 OE2 GLU A 692 180.696 -4.845 17.278 1.00 0.00 O ATOM 0 H GLU A 692 179.842 -6.666 12.356 1.00 0.00 H new ATOM 0 HA GLU A 692 177.931 -7.322 14.267 1.00 0.00 H new ATOM 0 HB2 GLU A 692 179.406 -4.823 13.460 1.00 0.00 H new ATOM 0 HB3 GLU A 692 178.122 -4.698 14.646 1.00 0.00 H new ATOM 0 HG2 GLU A 692 179.291 -6.495 15.991 1.00 0.00 H new ATOM 0 HG3 GLU A 692 180.620 -6.411 14.852 1.00 0.00 H new ATOM 1499 N SER A 693 176.736 -5.707 11.715 1.00 0.00 N ATOM 1500 CA SER A 693 175.515 -5.224 11.079 1.00 0.00 C ATOM 1501 C SER A 693 174.755 -6.360 10.393 1.00 0.00 C ATOM 1502 O SER A 693 173.602 -6.190 9.996 1.00 0.00 O ATOM 1503 CB SER A 693 175.846 -4.132 10.061 1.00 0.00 C ATOM 1504 OG SER A 693 176.414 -4.684 8.886 1.00 0.00 O ATOM 0 H SER A 693 177.543 -5.756 11.093 1.00 0.00 H new ATOM 0 HA SER A 693 174.875 -4.810 11.859 1.00 0.00 H new ATOM 0 HB2 SER A 693 174.940 -3.581 9.807 1.00 0.00 H new ATOM 0 HB3 SER A 693 176.540 -3.417 10.503 1.00 0.00 H new ATOM 0 HG SER A 693 176.838 -5.541 9.099 1.00 0.00 H new ATOM 1510 N LYS A 694 175.399 -7.517 10.256 1.00 0.00 N ATOM 1511 CA LYS A 694 174.766 -8.668 9.620 1.00 0.00 C ATOM 1512 C LYS A 694 173.525 -9.104 10.393 1.00 0.00 C ATOM 1513 O LYS A 694 172.609 -9.703 9.829 1.00 0.00 O ATOM 1514 CB LYS A 694 175.751 -9.834 9.513 1.00 0.00 C ATOM 1515 CG LYS A 694 176.709 -9.718 8.338 1.00 0.00 C ATOM 1516 CD LYS A 694 177.638 -10.918 8.257 1.00 0.00 C ATOM 1517 CE LYS A 694 178.512 -10.863 7.014 1.00 0.00 C ATOM 1518 NZ LYS A 694 178.059 -11.827 5.973 1.00 0.00 N ATOM 0 H LYS A 694 176.354 -7.681 10.575 1.00 0.00 H new ATOM 0 HA LYS A 694 174.462 -8.370 8.616 1.00 0.00 H new ATOM 0 HB2 LYS A 694 176.328 -9.897 10.436 1.00 0.00 H new ATOM 0 HB3 LYS A 694 175.191 -10.765 9.423 1.00 0.00 H new ATOM 0 HG2 LYS A 694 176.141 -9.633 7.411 1.00 0.00 H new ATOM 0 HG3 LYS A 694 177.298 -8.806 8.436 1.00 0.00 H new ATOM 0 HD2 LYS A 694 178.269 -10.952 9.145 1.00 0.00 H new ATOM 0 HD3 LYS A 694 177.049 -11.835 8.249 1.00 0.00 H new ATOM 0 HE2 LYS A 694 178.497 -9.853 6.604 1.00 0.00 H new ATOM 0 HE3 LYS A 694 179.545 -11.082 7.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 694 178.086 -11.368 5.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 694 178.688 -12.655 5.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 694 177.087 -12.131 6.181 1.00 0.00 H new ATOM 1532 N SER A 695 173.503 -8.800 11.688 1.00 0.00 N ATOM 1533 CA SER A 695 172.374 -9.161 12.537 1.00 0.00 C ATOM 1534 C SER A 695 171.257 -8.122 12.448 1.00 0.00 C ATOM 1535 O SER A 695 170.119 -8.389 12.833 1.00 0.00 O ATOM 1536 CB SER A 695 172.833 -9.313 13.989 1.00 0.00 C ATOM 1537 OG SER A 695 172.412 -10.553 14.531 1.00 0.00 O ATOM 0 H SER A 695 174.253 -8.305 12.171 1.00 0.00 H new ATOM 0 HA SER A 695 171.979 -10.113 12.183 1.00 0.00 H new ATOM 0 HB2 SER A 695 173.919 -9.241 14.039 1.00 0.00 H new ATOM 0 HB3 SER A 695 172.431 -8.496 14.588 1.00 0.00 H new ATOM 0 HG SER A 695 172.719 -10.626 15.459 1.00 0.00 H new ATOM 1543 N GLU A 696 171.585 -6.935 11.940 1.00 0.00 N ATOM 1544 CA GLU A 696 170.605 -5.867 11.807 1.00 0.00 C ATOM 1545 C GLU A 696 169.753 -6.067 10.554 1.00 0.00 C ATOM 1546 O GLU A 696 170.284 -6.221 9.454 1.00 0.00 O ATOM 1547 CB GLU A 696 171.307 -4.510 11.746 1.00 0.00 C ATOM 1548 CG GLU A 696 171.803 -4.021 13.096 1.00 0.00 C ATOM 1549 CD GLU A 696 170.704 -3.384 13.925 1.00 0.00 C ATOM 1550 OE1 GLU A 696 169.538 -3.812 13.793 1.00 0.00 O ATOM 1551 OE2 GLU A 696 171.009 -2.457 14.704 1.00 0.00 O ATOM 0 H GLU A 696 172.521 -6.692 11.615 1.00 0.00 H new ATOM 0 HA GLU A 696 169.952 -5.893 12.679 1.00 0.00 H new ATOM 0 HB2 GLU A 696 172.152 -4.578 11.061 1.00 0.00 H new ATOM 0 HB3 GLU A 696 170.619 -3.773 11.332 1.00 0.00 H new ATOM 0 HG2 GLU A 696 172.230 -4.859 13.647 1.00 0.00 H new ATOM 0 HG3 GLU A 696 172.604 -3.298 12.944 1.00 0.00 H new ATOM 1558 N PRO A 697 168.415 -6.067 10.699 1.00 0.00 N ATOM 1559 CA PRO A 697 167.501 -6.249 9.566 1.00 0.00 C ATOM 1560 C PRO A 697 167.678 -5.180 8.490 1.00 0.00 C ATOM 1561 O PRO A 697 167.182 -5.329 7.372 1.00 0.00 O ATOM 1562 CB PRO A 697 166.107 -6.136 10.197 1.00 0.00 C ATOM 1563 CG PRO A 697 166.314 -6.404 11.647 1.00 0.00 C ATOM 1564 CD PRO A 697 167.687 -5.892 11.969 1.00 0.00 C ATOM 0 HA PRO A 697 167.680 -7.198 9.060 1.00 0.00 H new ATOM 0 HB2 PRO A 697 165.681 -5.146 10.036 1.00 0.00 H new ATOM 0 HB3 PRO A 697 165.416 -6.856 9.758 1.00 0.00 H new ATOM 0 HG2 PRO A 697 165.558 -5.900 12.249 1.00 0.00 H new ATOM 0 HG3 PRO A 697 166.234 -7.470 11.862 1.00 0.00 H new ATOM 0 HD2 PRO A 697 167.665 -4.848 12.281 1.00 0.00 H new ATOM 0 HD3 PRO A 697 168.148 -6.457 12.779 1.00 0.00 H new ATOM 1572 N GLN A 698 168.382 -4.101 8.827 1.00 0.00 N ATOM 1573 CA GLN A 698 168.607 -3.016 7.879 1.00 0.00 C ATOM 1574 C GLN A 698 170.047 -2.514 7.944 1.00 0.00 C ATOM 1575 O GLN A 698 170.709 -2.622 8.977 1.00 0.00 O ATOM 1576 CB GLN A 698 167.641 -1.862 8.158 1.00 0.00 C ATOM 1577 CG GLN A 698 167.448 -0.927 6.975 1.00 0.00 C ATOM 1578 CD GLN A 698 166.757 0.366 7.362 1.00 0.00 C ATOM 1579 OE1 GLN A 698 166.767 0.765 8.526 1.00 0.00 O ATOM 1580 NE2 GLN A 698 166.149 1.030 6.383 1.00 0.00 N ATOM 0 H GLN A 698 168.804 -3.957 9.745 1.00 0.00 H new ATOM 0 HA GLN A 698 168.426 -3.404 6.877 1.00 0.00 H new ATOM 0 HB2 GLN A 698 166.673 -2.272 8.447 1.00 0.00 H new ATOM 0 HB3 GLN A 698 168.011 -1.288 9.007 1.00 0.00 H new ATOM 0 HG2 GLN A 698 168.419 -0.699 6.535 1.00 0.00 H new ATOM 0 HG3 GLN A 698 166.861 -1.433 6.208 1.00 0.00 H new ATOM 0 HE21 GLN A 698 166.165 0.663 5.431 1.00 0.00 H new ATOM 0 HE22 GLN A 698 165.667 1.906 6.584 1.00 0.00 H new ATOM 1589 N VAL A 699 170.524 -1.965 6.830 1.00 0.00 N ATOM 1590 CA VAL A 699 171.883 -1.442 6.749 1.00 0.00 C ATOM 1591 C VAL A 699 171.923 -0.155 5.934 1.00 0.00 C ATOM 1592 O VAL A 699 171.212 -0.015 4.940 1.00 0.00 O ATOM 1593 CB VAL A 699 172.844 -2.470 6.113 1.00 0.00 C ATOM 1594 CG1 VAL A 699 174.180 -1.826 5.756 1.00 0.00 C ATOM 1595 CG2 VAL A 699 173.052 -3.653 7.047 1.00 0.00 C ATOM 0 H VAL A 699 169.986 -1.871 5.968 1.00 0.00 H new ATOM 0 HA VAL A 699 172.207 -1.236 7.769 1.00 0.00 H new ATOM 0 HB VAL A 699 172.389 -2.832 5.191 1.00 0.00 H new ATOM 0 HG11 VAL A 699 174.836 -2.573 5.310 1.00 0.00 H new ATOM 0 HG12 VAL A 699 174.015 -1.017 5.045 1.00 0.00 H new ATOM 0 HG13 VAL A 699 174.644 -1.427 6.658 1.00 0.00 H new ATOM 0 HG21 VAL A 699 173.732 -4.368 6.583 1.00 0.00 H new ATOM 0 HG22 VAL A 699 173.479 -3.304 7.987 1.00 0.00 H new ATOM 0 HG23 VAL A 699 172.094 -4.136 7.241 1.00 0.00 H new ATOM 1605 N GLU A 700 172.773 0.775 6.353 1.00 0.00 N ATOM 1606 CA GLU A 700 172.926 2.046 5.657 1.00 0.00 C ATOM 1607 C GLU A 700 174.349 2.187 5.130 1.00 0.00 C ATOM 1608 O GLU A 700 175.290 2.369 5.903 1.00 0.00 O ATOM 1609 CB GLU A 700 172.593 3.211 6.591 1.00 0.00 C ATOM 1610 CG GLU A 700 172.504 4.552 5.881 1.00 0.00 C ATOM 1611 CD GLU A 700 172.023 5.664 6.792 1.00 0.00 C ATOM 1612 OE1 GLU A 700 170.825 5.667 7.143 1.00 0.00 O ATOM 1613 OE2 GLU A 700 172.845 6.532 7.154 1.00 0.00 O ATOM 0 H GLU A 700 173.369 0.672 7.175 1.00 0.00 H new ATOM 0 HA GLU A 700 172.233 2.067 4.816 1.00 0.00 H new ATOM 0 HB2 GLU A 700 171.644 3.008 7.088 1.00 0.00 H new ATOM 0 HB3 GLU A 700 173.354 3.271 7.369 1.00 0.00 H new ATOM 0 HG2 GLU A 700 173.484 4.813 5.482 1.00 0.00 H new ATOM 0 HG3 GLU A 700 171.827 4.465 5.032 1.00 0.00 H new ATOM 1620 N ILE A 701 174.503 2.094 3.813 1.00 0.00 N ATOM 1621 CA ILE A 701 175.818 2.204 3.196 1.00 0.00 C ATOM 1622 C ILE A 701 175.896 3.398 2.258 1.00 0.00 C ATOM 1623 O ILE A 701 174.962 3.678 1.507 1.00 0.00 O ATOM 1624 CB ILE A 701 176.200 0.929 2.414 1.00 0.00 C ATOM 1625 CG1 ILE A 701 174.963 0.297 1.765 1.00 0.00 C ATOM 1626 CG2 ILE A 701 176.898 -0.057 3.336 1.00 0.00 C ATOM 1627 CD1 ILE A 701 175.244 -1.023 1.074 1.00 0.00 C ATOM 0 H ILE A 701 173.737 1.944 3.156 1.00 0.00 H new ATOM 0 HA ILE A 701 176.525 2.340 4.015 1.00 0.00 H new ATOM 0 HB ILE A 701 176.889 1.201 1.615 1.00 0.00 H new ATOM 0 HG12 ILE A 701 174.202 0.142 2.530 1.00 0.00 H new ATOM 0 HG13 ILE A 701 174.548 0.996 1.039 1.00 0.00 H new ATOM 0 HG21 ILE A 701 177.164 -0.953 2.776 1.00 0.00 H new ATOM 0 HG22 ILE A 701 177.802 0.400 3.740 1.00 0.00 H new ATOM 0 HG23 ILE A 701 176.230 -0.325 4.154 1.00 0.00 H new ATOM 0 HD11 ILE A 701 174.322 -1.409 0.639 1.00 0.00 H new ATOM 0 HD12 ILE A 701 175.982 -0.871 0.286 1.00 0.00 H new ATOM 0 HD13 ILE A 701 175.630 -1.739 1.800 1.00 0.00 H new ATOM 1639 N ILE A 702 177.022 4.096 2.311 1.00 0.00 N ATOM 1640 CA ILE A 702 177.241 5.263 1.471 1.00 0.00 C ATOM 1641 C ILE A 702 178.445 5.052 0.565 1.00 0.00 C ATOM 1642 O ILE A 702 179.404 4.385 0.944 1.00 0.00 O ATOM 1643 CB ILE A 702 177.457 6.534 2.319 1.00 0.00 C ATOM 1644 CG1 ILE A 702 176.520 6.537 3.533 1.00 0.00 C ATOM 1645 CG2 ILE A 702 177.239 7.782 1.476 1.00 0.00 C ATOM 1646 CD1 ILE A 702 175.059 6.342 3.181 1.00 0.00 C ATOM 0 H ILE A 702 177.801 3.872 2.930 1.00 0.00 H new ATOM 0 HA ILE A 702 176.347 5.397 0.862 1.00 0.00 H new ATOM 0 HB ILE A 702 178.486 6.536 2.678 1.00 0.00 H new ATOM 0 HG12 ILE A 702 176.827 5.747 4.219 1.00 0.00 H new ATOM 0 HG13 ILE A 702 176.633 7.482 4.064 1.00 0.00 H new ATOM 0 HG21 ILE A 702 177.396 8.668 2.091 1.00 0.00 H new ATOM 0 HG22 ILE A 702 177.944 7.788 0.645 1.00 0.00 H new ATOM 0 HG23 ILE A 702 176.221 7.785 1.087 1.00 0.00 H new ATOM 0 HD11 ILE A 702 174.460 6.356 4.092 1.00 0.00 H new ATOM 0 HD12 ILE A 702 174.733 7.146 2.520 1.00 0.00 H new ATOM 0 HD13 ILE A 702 174.931 5.384 2.677 1.00 0.00 H new ATOM 1658 N VAL A 703 178.390 5.617 -0.636 1.00 0.00 N ATOM 1659 CA VAL A 703 179.482 5.475 -1.590 1.00 0.00 C ATOM 1660 C VAL A 703 179.888 6.817 -2.184 1.00 0.00 C ATOM 1661 O VAL A 703 179.303 7.853 -1.869 1.00 0.00 O ATOM 1662 CB VAL A 703 179.104 4.519 -2.734 1.00 0.00 C ATOM 1663 CG1 VAL A 703 179.083 3.082 -2.242 1.00 0.00 C ATOM 1664 CG2 VAL A 703 177.760 4.906 -3.332 1.00 0.00 C ATOM 0 H VAL A 703 177.604 6.175 -0.970 1.00 0.00 H new ATOM 0 HA VAL A 703 180.325 5.062 -1.036 1.00 0.00 H new ATOM 0 HB VAL A 703 179.859 4.600 -3.516 1.00 0.00 H new ATOM 0 HG11 VAL A 703 178.814 2.420 -3.065 1.00 0.00 H new ATOM 0 HG12 VAL A 703 180.070 2.812 -1.867 1.00 0.00 H new ATOM 0 HG13 VAL A 703 178.350 2.982 -1.441 1.00 0.00 H new ATOM 0 HG21 VAL A 703 177.510 4.218 -4.140 1.00 0.00 H new ATOM 0 HG22 VAL A 703 176.991 4.856 -2.561 1.00 0.00 H new ATOM 0 HG23 VAL A 703 177.815 5.922 -3.724 1.00 0.00 H new ATOM 1674 N SER A 704 180.897 6.785 -3.048 1.00 0.00 N ATOM 1675 CA SER A 704 181.391 7.995 -3.695 1.00 0.00 C ATOM 1676 C SER A 704 181.818 7.706 -5.130 1.00 0.00 C ATOM 1677 O SER A 704 182.873 7.118 -5.368 1.00 0.00 O ATOM 1678 CB SER A 704 182.566 8.576 -2.908 1.00 0.00 C ATOM 1679 OG SER A 704 182.115 9.272 -1.757 1.00 0.00 O ATOM 0 H SER A 704 181.389 5.933 -3.317 1.00 0.00 H new ATOM 0 HA SER A 704 180.581 8.724 -3.715 1.00 0.00 H new ATOM 0 HB2 SER A 704 183.241 7.773 -2.610 1.00 0.00 H new ATOM 0 HB3 SER A 704 183.136 9.252 -3.545 1.00 0.00 H new ATOM 0 HG SER A 704 181.159 9.101 -1.625 1.00 0.00 H new ATOM 1741 N GLY B 945 186.279 -9.785 0.306 1.00 0.00 N ATOM 1742 CA GLY B 945 186.467 -9.505 1.717 1.00 0.00 C ATOM 1743 C GLY B 945 185.335 -10.037 2.573 1.00 0.00 C ATOM 1744 O GLY B 945 185.566 -10.777 3.528 1.00 0.00 O ATOM 0 HA2 GLY B 945 187.407 -9.946 2.049 1.00 0.00 H new ATOM 0 HA3 GLY B 945 186.552 -8.428 1.862 1.00 0.00 H new ATOM 1748 N ILE B 946 184.106 -9.654 2.238 1.00 0.00 N ATOM 1749 CA ILE B 946 182.937 -10.096 2.990 1.00 0.00 C ATOM 1750 C ILE B 946 181.733 -10.270 2.081 1.00 0.00 C ATOM 1751 O ILE B 946 181.667 -9.692 0.997 1.00 0.00 O ATOM 1752 CB ILE B 946 182.562 -9.114 4.117 1.00 0.00 C ATOM 1753 CG1 ILE B 946 183.766 -8.261 4.520 1.00 0.00 C ATOM 1754 CG2 ILE B 946 182.023 -9.878 5.320 1.00 0.00 C ATOM 1755 CD1 ILE B 946 183.547 -7.493 5.800 1.00 0.00 C ATOM 0 H ILE B 946 183.895 -9.039 1.452 1.00 0.00 H new ATOM 0 HA ILE B 946 183.209 -11.054 3.434 1.00 0.00 H new ATOM 0 HB ILE B 946 181.784 -8.446 3.747 1.00 0.00 H new ATOM 0 HG12 ILE B 946 184.638 -8.905 4.635 1.00 0.00 H new ATOM 0 HG13 ILE B 946 183.992 -7.560 3.717 1.00 0.00 H new ATOM 0 HG21 ILE B 946 181.761 -9.174 6.110 1.00 0.00 H new ATOM 0 HG22 ILE B 946 181.137 -10.440 5.027 1.00 0.00 H new ATOM 0 HG23 ILE B 946 182.785 -10.567 5.685 1.00 0.00 H new ATOM 0 HD11 ILE B 946 184.438 -6.908 6.030 1.00 0.00 H new ATOM 0 HD12 ILE B 946 182.694 -6.824 5.682 1.00 0.00 H new ATOM 0 HD13 ILE B 946 183.351 -8.191 6.614 1.00 0.00 H new ATOM 1767 N TRP B 947 180.778 -11.067 2.536 1.00 0.00 N ATOM 1768 CA TRP B 947 179.567 -11.316 1.770 1.00 0.00 C ATOM 1769 C TRP B 947 178.457 -10.359 2.178 1.00 0.00 C ATOM 1770 O TRP B 947 178.099 -10.268 3.353 1.00 0.00 O ATOM 1771 CB TRP B 947 179.109 -12.767 1.938 1.00 0.00 C ATOM 1772 CG TRP B 947 179.356 -13.602 0.718 1.00 0.00 C ATOM 1773 CD1 TRP B 947 179.971 -14.820 0.665 1.00 0.00 C ATOM 1774 CD2 TRP B 947 178.999 -13.275 -0.632 1.00 0.00 C ATOM 1775 NE1 TRP B 947 180.019 -15.271 -0.632 1.00 0.00 N ATOM 1776 CE2 TRP B 947 179.429 -14.339 -1.448 1.00 0.00 C ATOM 1777 CE3 TRP B 947 178.358 -12.187 -1.230 1.00 0.00 C ATOM 1778 CZ2 TRP B 947 179.238 -14.343 -2.829 1.00 0.00 C ATOM 1779 CZ3 TRP B 947 178.170 -12.193 -2.599 1.00 0.00 C ATOM 1780 CH2 TRP B 947 178.608 -13.264 -3.385 1.00 0.00 C ATOM 0 H TRP B 947 180.819 -11.552 3.432 1.00 0.00 H new ATOM 0 HA TRP B 947 179.795 -11.144 0.718 1.00 0.00 H new ATOM 0 HB2 TRP B 947 179.629 -13.211 2.787 1.00 0.00 H new ATOM 0 HB3 TRP B 947 178.045 -12.782 2.173 1.00 0.00 H new ATOM 0 HD1 TRP B 947 180.363 -15.352 1.519 1.00 0.00 H new ATOM 0 HE1 TRP B 947 180.427 -16.154 -0.938 1.00 0.00 H new ATOM 0 HE3 TRP B 947 178.015 -11.355 -0.632 1.00 0.00 H new ATOM 0 HZ2 TRP B 947 179.575 -15.169 -3.438 1.00 0.00 H new ATOM 0 HZ3 TRP B 947 177.676 -11.356 -3.070 1.00 0.00 H new ATOM 0 HH2 TRP B 947 178.445 -13.238 -4.452 1.00 0.00 H new ATOM 1791 N ALA B 948 177.914 -9.648 1.196 1.00 0.00 N ATOM 1792 CA ALA B 948 176.839 -8.701 1.436 1.00 0.00 C ATOM 1793 C ALA B 948 175.845 -8.719 0.280 1.00 0.00 C ATOM 1794 O ALA B 948 175.309 -7.647 -0.059 1.00 0.00 O ATOM 1795 CB ALA B 948 177.401 -7.301 1.638 1.00 0.00 C ATOM 1796 OXT ALA B 948 175.617 -9.804 -0.289 1.00 0.00 O ATOM 0 H ALA B 948 178.205 -9.713 0.221 1.00 0.00 H new ATOM 0 HA ALA B 948 176.313 -8.995 2.345 1.00 0.00 H new ATOM 0 HB1 ALA B 948 176.583 -6.603 1.817 1.00 0.00 H new ATOM 0 HB2 ALA B 948 178.074 -7.299 2.496 1.00 0.00 H new ATOM 0 HB3 ALA B 948 177.949 -6.997 0.746 1.00 0.00 H new