USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=12 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 674 ASN :FLIP amide:sc= -0.726 F(o=-3.6,f=-0.46) USER MOD Set 1.2: A 693 SER OG : rot 88:sc= 0.262 USER MOD Set 2.1: A 682 THR OG1 : rot 180:sc= -0.0852! USER MOD Set 2.2: A 683 ASN : amide:sc= -0.946 K(o=-1,f=-3.4) USER MOD Single : A 617 ASN : amide:sc= -1.86 K(o=-1.9,f=-3.3!) USER MOD Single : A 618 LYS NZ :NH3+ -112:sc= -3.72! (180deg=-7.65!) USER MOD Single : A 633 LYS NZ :NH3+ 137:sc= 0.245 (180deg=0.0188) USER MOD Single : A 638 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 650 THR OG1 : rot 180:sc= -0.0948 USER MOD Single : A 651 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.881) 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= -0.964 USER MOD Single : A 663 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 676 LYS NZ :NH3+ 143:sc= -0.184 (180deg=-0.644) USER MOD Single : A 687 TYR OH : rot 180:sc= 0 USER MOD Single : A 688 ASN : amide:sc= 0.179 X(o=0.18,f=0) USER MOD Single : A 694 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 695 SER OG : rot 180:sc= 0 USER MOD Single : A 698 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.17) USER MOD Single : A 704 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 247 N GLY A 612 176.187 9.582 -2.541 1.00 0.00 N ATOM 248 CA GLY A 612 174.836 9.102 -2.330 1.00 0.00 C ATOM 249 C GLY A 612 174.701 8.243 -1.090 1.00 0.00 C ATOM 250 O GLY A 612 175.692 7.738 -0.562 1.00 0.00 O ATOM 0 HA2 GLY A 612 174.162 9.955 -2.250 1.00 0.00 H new ATOM 0 HA3 GLY A 612 174.521 8.527 -3.200 1.00 0.00 H new ATOM 254 N ARG A 613 173.466 8.065 -0.634 1.00 0.00 N ATOM 255 CA ARG A 613 173.191 7.248 0.542 1.00 0.00 C ATOM 256 C ARG A 613 172.370 6.028 0.149 1.00 0.00 C ATOM 257 O ARG A 613 171.307 6.158 -0.457 1.00 0.00 O ATOM 258 CB ARG A 613 172.445 8.066 1.600 1.00 0.00 C ATOM 259 CG ARG A 613 172.125 7.279 2.861 1.00 0.00 C ATOM 260 CD ARG A 613 170.747 7.628 3.406 1.00 0.00 C ATOM 261 NE ARG A 613 170.580 9.068 3.603 1.00 0.00 N ATOM 262 CZ ARG A 613 169.964 9.875 2.740 1.00 0.00 C ATOM 263 NH1 ARG A 613 169.462 9.399 1.606 1.00 0.00 N ATOM 264 NH2 ARG A 613 169.848 11.168 3.013 1.00 0.00 N ATOM 0 H ARG A 613 172.637 8.477 -1.063 1.00 0.00 H new ATOM 0 HA ARG A 613 174.139 6.916 0.965 1.00 0.00 H new ATOM 0 HB2 ARG A 613 173.046 8.935 1.867 1.00 0.00 H new ATOM 0 HB3 ARG A 613 171.516 8.441 1.170 1.00 0.00 H new ATOM 0 HG2 ARG A 613 172.172 6.211 2.646 1.00 0.00 H new ATOM 0 HG3 ARG A 613 172.880 7.485 3.620 1.00 0.00 H new ATOM 0 HD2 ARG A 613 169.983 7.266 2.718 1.00 0.00 H new ATOM 0 HD3 ARG A 613 170.592 7.113 4.354 1.00 0.00 H new ATOM 0 HE ARG A 613 170.959 9.481 4.455 1.00 0.00 H new ATOM 0 HH11 ARG A 613 169.546 8.406 1.388 1.00 0.00 H new ATOM 0 HH12 ARG A 613 168.993 10.026 0.953 1.00 0.00 H new ATOM 0 HH21 ARG A 613 170.230 11.542 3.882 1.00 0.00 H new ATOM 0 HH22 ARG A 613 169.377 11.788 2.354 1.00 0.00 H new ATOM 278 N VAL A 614 172.869 4.838 0.475 1.00 0.00 N ATOM 279 CA VAL A 614 172.169 3.611 0.123 1.00 0.00 C ATOM 280 C VAL A 614 171.765 2.814 1.356 1.00 0.00 C ATOM 281 O VAL A 614 172.585 2.538 2.231 1.00 0.00 O ATOM 282 CB VAL A 614 173.031 2.718 -0.790 1.00 0.00 C ATOM 283 CG1 VAL A 614 172.237 1.508 -1.262 1.00 0.00 C ATOM 284 CG2 VAL A 614 173.556 3.513 -1.976 1.00 0.00 C ATOM 0 H VAL A 614 173.746 4.700 0.977 1.00 0.00 H new ATOM 0 HA VAL A 614 171.268 3.913 -0.411 1.00 0.00 H new ATOM 0 HB VAL A 614 173.885 2.362 -0.213 1.00 0.00 H new ATOM 0 HG11 VAL A 614 172.863 0.890 -1.905 1.00 0.00 H new ATOM 0 HG12 VAL A 614 171.916 0.924 -0.399 1.00 0.00 H new ATOM 0 HG13 VAL A 614 171.362 1.842 -1.820 1.00 0.00 H new ATOM 0 HG21 VAL A 614 174.162 2.865 -2.609 1.00 0.00 H new ATOM 0 HG22 VAL A 614 172.717 3.902 -2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 614 174.165 4.343 -1.617 1.00 0.00 H new ATOM 294 N ILE A 615 170.496 2.430 1.403 1.00 0.00 N ATOM 295 CA ILE A 615 169.971 1.643 2.509 1.00 0.00 C ATOM 296 C ILE A 615 169.617 0.245 2.023 1.00 0.00 C ATOM 297 O ILE A 615 168.839 0.085 1.083 1.00 0.00 O ATOM 298 CB ILE A 615 168.723 2.294 3.138 1.00 0.00 C ATOM 299 CG1 ILE A 615 168.891 3.814 3.217 1.00 0.00 C ATOM 300 CG2 ILE A 615 168.468 1.714 4.520 1.00 0.00 C ATOM 301 CD1 ILE A 615 170.017 4.251 4.127 1.00 0.00 C ATOM 0 H ILE A 615 169.809 2.653 0.683 1.00 0.00 H new ATOM 0 HA ILE A 615 170.747 1.593 3.273 1.00 0.00 H new ATOM 0 HB ILE A 615 167.862 2.078 2.505 1.00 0.00 H new ATOM 0 HG12 ILE A 615 169.072 4.204 2.215 1.00 0.00 H new ATOM 0 HG13 ILE A 615 167.959 4.257 3.568 1.00 0.00 H new ATOM 0 HG21 ILE A 615 167.584 2.182 4.954 1.00 0.00 H new ATOM 0 HG22 ILE A 615 168.307 0.639 4.439 1.00 0.00 H new ATOM 0 HG23 ILE A 615 169.330 1.905 5.159 1.00 0.00 H new ATOM 0 HD11 ILE A 615 170.077 5.339 4.134 1.00 0.00 H new ATOM 0 HD12 ILE A 615 169.828 3.891 5.138 1.00 0.00 H new ATOM 0 HD13 ILE A 615 170.958 3.838 3.765 1.00 0.00 H new ATOM 313 N LEU A 616 170.201 -0.768 2.652 1.00 0.00 N ATOM 314 CA LEU A 616 169.951 -2.148 2.256 1.00 0.00 C ATOM 315 C LEU A 616 169.416 -2.977 3.418 1.00 0.00 C ATOM 316 O LEU A 616 169.770 -2.751 4.573 1.00 0.00 O ATOM 317 CB LEU A 616 171.233 -2.774 1.706 1.00 0.00 C ATOM 318 CG LEU A 616 171.344 -2.757 0.182 1.00 0.00 C ATOM 319 CD1 LEU A 616 172.708 -3.256 -0.271 1.00 0.00 C ATOM 320 CD2 LEU A 616 170.241 -3.597 -0.431 1.00 0.00 C ATOM 0 H LEU A 616 170.847 -0.661 3.434 1.00 0.00 H new ATOM 0 HA LEU A 616 169.189 -2.141 1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 616 172.089 -2.246 2.126 1.00 0.00 H new ATOM 0 HB3 LEU A 616 171.295 -3.806 2.051 1.00 0.00 H new ATOM 0 HG LEU A 616 171.233 -1.727 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 616 172.760 -3.234 -1.360 1.00 0.00 H new ATOM 0 HD12 LEU A 616 173.486 -2.615 0.143 1.00 0.00 H new ATOM 0 HD13 LEU A 616 172.856 -4.278 0.079 1.00 0.00 H new ATOM 0 HD21 LEU A 616 170.330 -3.578 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 616 170.327 -4.625 -0.078 1.00 0.00 H new ATOM 0 HD23 LEU A 616 169.271 -3.194 -0.139 1.00 0.00 H new ATOM 332 N ASN A 617 168.564 -3.943 3.095 1.00 0.00 N ATOM 333 CA ASN A 617 167.977 -4.820 4.099 1.00 0.00 C ATOM 334 C ASN A 617 168.350 -6.272 3.823 1.00 0.00 C ATOM 335 O ASN A 617 168.114 -6.786 2.729 1.00 0.00 O ATOM 336 CB ASN A 617 166.455 -4.664 4.117 1.00 0.00 C ATOM 337 CG ASN A 617 165.895 -4.603 5.524 1.00 0.00 C ATOM 338 OD1 ASN A 617 165.942 -3.562 6.180 1.00 0.00 O ATOM 339 ND2 ASN A 617 165.361 -5.724 5.997 1.00 0.00 N ATOM 0 H ASN A 617 168.264 -4.139 2.140 1.00 0.00 H new ATOM 0 HA ASN A 617 168.372 -4.537 5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 617 166.180 -3.756 3.580 1.00 0.00 H new ATOM 0 HB3 ASN A 617 166.001 -5.500 3.584 1.00 0.00 H new ATOM 0 HD21 ASN A 617 164.969 -5.745 6.938 1.00 0.00 H new ATOM 0 HD22 ASN A 617 165.343 -6.564 5.419 1.00 0.00 H new ATOM 346 N LYS A 618 168.936 -6.927 4.817 1.00 0.00 N ATOM 347 CA LYS A 618 169.346 -8.320 4.680 1.00 0.00 C ATOM 348 C LYS A 618 168.564 -9.207 5.644 1.00 0.00 C ATOM 349 O LYS A 618 169.087 -10.196 6.157 1.00 0.00 O ATOM 350 CB LYS A 618 170.847 -8.454 4.950 1.00 0.00 C ATOM 351 CG LYS A 618 171.256 -7.950 6.326 1.00 0.00 C ATOM 352 CD LYS A 618 172.726 -7.552 6.394 1.00 0.00 C ATOM 353 CE LYS A 618 173.646 -8.668 5.923 1.00 0.00 C ATOM 354 NZ LYS A 618 174.965 -8.148 5.466 1.00 0.00 N ATOM 0 H LYS A 618 169.139 -6.516 5.728 1.00 0.00 H new ATOM 0 HA LYS A 618 169.135 -8.643 3.661 1.00 0.00 H new ATOM 0 HB2 LYS A 618 171.135 -9.501 4.853 1.00 0.00 H new ATOM 0 HB3 LYS A 618 171.397 -7.900 4.189 1.00 0.00 H new ATOM 0 HG2 LYS A 618 170.639 -7.092 6.592 1.00 0.00 H new ATOM 0 HG3 LYS A 618 171.059 -8.726 7.066 1.00 0.00 H new ATOM 0 HD2 LYS A 618 172.889 -6.666 5.781 1.00 0.00 H new ATOM 0 HD3 LYS A 618 172.980 -7.282 7.419 1.00 0.00 H new ATOM 0 HE2 LYS A 618 173.798 -9.379 6.735 1.00 0.00 H new ATOM 0 HE3 LYS A 618 173.169 -9.212 5.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 618 175.054 -8.282 4.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 618 175.035 -7.135 5.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 618 175.728 -8.663 5.950 1.00 0.00 H new ATOM 516 N LEU A 629 172.710 -12.289 1.780 1.00 0.00 N ATOM 517 CA LEU A 629 172.730 -11.199 2.752 1.00 0.00 C ATOM 518 C LEU A 629 171.760 -10.092 2.331 1.00 0.00 C ATOM 519 O LEU A 629 170.609 -10.070 2.766 1.00 0.00 O ATOM 520 CB LEU A 629 174.151 -10.636 2.926 1.00 0.00 C ATOM 521 CG LEU A 629 175.305 -11.610 2.658 1.00 0.00 C ATOM 522 CD1 LEU A 629 175.146 -12.887 3.464 1.00 0.00 C ATOM 523 CD2 LEU A 629 175.428 -11.922 1.173 1.00 0.00 C ATOM 0 HA LEU A 629 172.409 -11.598 3.714 1.00 0.00 H new ATOM 0 HB2 LEU A 629 174.264 -9.780 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A 629 174.249 -10.262 3.945 1.00 0.00 H new ATOM 0 HG LEU A 629 176.226 -11.123 2.978 1.00 0.00 H new ATOM 0 HD11 LEU A 629 175.979 -13.557 3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 629 175.134 -12.647 4.527 1.00 0.00 H new ATOM 0 HD13 LEU A 629 174.210 -13.375 3.192 1.00 0.00 H new ATOM 0 HD21 LEU A 629 176.254 -12.615 1.014 1.00 0.00 H new ATOM 0 HD22 LEU A 629 174.502 -12.374 0.818 1.00 0.00 H new ATOM 0 HD23 LEU A 629 175.616 -11.001 0.622 1.00 0.00 H new ATOM 535 N LEU A 630 172.221 -9.191 1.466 1.00 0.00 N ATOM 536 CA LEU A 630 171.381 -8.103 0.971 1.00 0.00 C ATOM 537 C LEU A 630 171.380 -8.107 -0.555 1.00 0.00 C ATOM 538 O LEU A 630 170.328 -8.254 -1.178 1.00 0.00 O ATOM 539 CB LEU A 630 171.848 -6.740 1.498 1.00 0.00 C ATOM 540 CG LEU A 630 173.312 -6.673 1.918 1.00 0.00 C ATOM 541 CD1 LEU A 630 173.924 -5.332 1.549 1.00 0.00 C ATOM 542 CD2 LEU A 630 173.453 -6.928 3.403 1.00 0.00 C ATOM 0 H LEU A 630 173.171 -9.193 1.094 1.00 0.00 H new ATOM 0 HA LEU A 630 170.367 -8.266 1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 630 171.674 -5.991 0.726 1.00 0.00 H new ATOM 0 HB3 LEU A 630 171.229 -6.467 2.352 1.00 0.00 H new ATOM 0 HG LEU A 630 173.852 -7.452 1.380 1.00 0.00 H new ATOM 0 HD11 LEU A 630 174.969 -5.311 1.860 1.00 0.00 H new ATOM 0 HD12 LEU A 630 173.863 -5.189 0.470 1.00 0.00 H new ATOM 0 HD13 LEU A 630 173.380 -4.533 2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 630 174.505 -6.876 3.683 1.00 0.00 H new ATOM 0 HD22 LEU A 630 172.893 -6.174 3.956 1.00 0.00 H new ATOM 0 HD23 LEU A 630 173.063 -7.918 3.641 1.00 0.00 H new ATOM 554 N GLY A 631 172.564 -7.966 -1.162 1.00 0.00 N ATOM 555 CA GLY A 631 172.642 -7.983 -2.614 1.00 0.00 C ATOM 556 C GLY A 631 173.955 -7.460 -3.188 1.00 0.00 C ATOM 557 O GLY A 631 173.992 -7.044 -4.346 1.00 0.00 O ATOM 0 H GLY A 631 173.455 -7.842 -0.680 1.00 0.00 H new ATOM 0 HA2 GLY A 631 172.491 -9.005 -2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 631 171.823 -7.387 -3.015 1.00 0.00 H new ATOM 561 N LEU A 632 175.036 -7.470 -2.405 1.00 0.00 N ATOM 562 CA LEU A 632 176.321 -6.978 -2.901 1.00 0.00 C ATOM 563 C LEU A 632 177.493 -7.496 -2.062 1.00 0.00 C ATOM 564 O LEU A 632 177.343 -7.801 -0.888 1.00 0.00 O ATOM 565 CB LEU A 632 176.297 -5.441 -2.937 1.00 0.00 C ATOM 566 CG LEU A 632 177.367 -4.714 -2.115 1.00 0.00 C ATOM 567 CD1 LEU A 632 177.302 -3.224 -2.390 1.00 0.00 C ATOM 568 CD2 LEU A 632 177.190 -4.982 -0.628 1.00 0.00 C ATOM 0 H LEU A 632 175.048 -7.807 -1.442 1.00 0.00 H new ATOM 0 HA LEU A 632 176.472 -7.358 -3.911 1.00 0.00 H new ATOM 0 HB2 LEU A 632 176.393 -5.124 -3.975 1.00 0.00 H new ATOM 0 HB3 LEU A 632 175.318 -5.108 -2.591 1.00 0.00 H new ATOM 0 HG LEU A 632 178.345 -5.093 -2.411 1.00 0.00 H new ATOM 0 HD11 LEU A 632 178.065 -2.712 -1.803 1.00 0.00 H new ATOM 0 HD12 LEU A 632 177.477 -3.042 -3.450 1.00 0.00 H new ATOM 0 HD13 LEU A 632 176.318 -2.846 -2.114 1.00 0.00 H new ATOM 0 HD21 LEU A 632 177.962 -4.454 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 632 176.208 -4.632 -0.310 1.00 0.00 H new ATOM 0 HD23 LEU A 632 177.273 -6.052 -0.439 1.00 0.00 H new ATOM 580 N LYS A 633 178.667 -7.576 -2.670 1.00 0.00 N ATOM 581 CA LYS A 633 179.855 -8.037 -1.960 1.00 0.00 C ATOM 582 C LYS A 633 180.881 -6.915 -1.890 1.00 0.00 C ATOM 583 O LYS A 633 181.162 -6.262 -2.895 1.00 0.00 O ATOM 584 CB LYS A 633 180.453 -9.265 -2.649 1.00 0.00 C ATOM 585 CG LYS A 633 180.662 -10.444 -1.713 1.00 0.00 C ATOM 586 CD LYS A 633 182.114 -10.558 -1.276 1.00 0.00 C ATOM 587 CE LYS A 633 182.296 -11.645 -0.229 1.00 0.00 C ATOM 588 NZ LYS A 633 182.591 -12.968 -0.846 1.00 0.00 N ATOM 0 H LYS A 633 178.824 -7.330 -3.647 1.00 0.00 H new ATOM 0 HA LYS A 633 179.570 -8.322 -0.947 1.00 0.00 H new ATOM 0 HB2 LYS A 633 179.797 -9.570 -3.464 1.00 0.00 H new ATOM 0 HB3 LYS A 633 181.409 -8.992 -3.095 1.00 0.00 H new ATOM 0 HG2 LYS A 633 180.025 -10.331 -0.836 1.00 0.00 H new ATOM 0 HG3 LYS A 633 180.358 -11.364 -2.212 1.00 0.00 H new ATOM 0 HD2 LYS A 633 182.740 -10.776 -2.141 1.00 0.00 H new ATOM 0 HD3 LYS A 633 182.450 -9.603 -0.873 1.00 0.00 H new ATOM 0 HE2 LYS A 633 183.108 -11.369 0.443 1.00 0.00 H new ATOM 0 HE3 LYS A 633 181.393 -11.720 0.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 633 183.350 -13.438 -0.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 633 181.736 -13.559 -0.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 633 182.894 -12.832 -1.831 1.00 0.00 H new ATOM 602 N VAL A 634 181.428 -6.678 -0.703 1.00 0.00 N ATOM 603 CA VAL A 634 182.406 -5.614 -0.523 1.00 0.00 C ATOM 604 C VAL A 634 183.695 -6.127 0.088 1.00 0.00 C ATOM 605 O VAL A 634 183.719 -7.156 0.757 1.00 0.00 O ATOM 606 CB VAL A 634 181.847 -4.479 0.363 1.00 0.00 C ATOM 607 CG1 VAL A 634 182.970 -3.657 0.987 1.00 0.00 C ATOM 608 CG2 VAL A 634 180.925 -3.591 -0.449 1.00 0.00 C ATOM 0 H VAL A 634 181.212 -7.205 0.143 1.00 0.00 H new ATOM 0 HA VAL A 634 182.620 -5.224 -1.518 1.00 0.00 H new ATOM 0 HB VAL A 634 181.278 -4.931 1.175 1.00 0.00 H new ATOM 0 HG11 VAL A 634 182.543 -2.867 1.604 1.00 0.00 H new ATOM 0 HG12 VAL A 634 183.594 -4.303 1.605 1.00 0.00 H new ATOM 0 HG13 VAL A 634 183.577 -3.213 0.198 1.00 0.00 H new ATOM 0 HG21 VAL A 634 180.536 -2.794 0.185 1.00 0.00 H new ATOM 0 HG22 VAL A 634 181.479 -3.156 -1.281 1.00 0.00 H new ATOM 0 HG23 VAL A 634 180.096 -4.184 -0.836 1.00 0.00 H new ATOM 618 N VAL A 635 184.764 -5.383 -0.147 1.00 0.00 N ATOM 619 CA VAL A 635 186.069 -5.731 0.375 1.00 0.00 C ATOM 620 C VAL A 635 186.512 -4.723 1.435 1.00 0.00 C ATOM 621 O VAL A 635 185.986 -3.612 1.507 1.00 0.00 O ATOM 622 CB VAL A 635 187.100 -5.815 -0.771 1.00 0.00 C ATOM 623 CG1 VAL A 635 188.421 -5.155 -0.408 1.00 0.00 C ATOM 624 CG2 VAL A 635 187.303 -7.264 -1.160 1.00 0.00 C ATOM 0 H VAL A 635 184.749 -4.527 -0.702 1.00 0.00 H new ATOM 0 HA VAL A 635 186.004 -6.710 0.849 1.00 0.00 H new ATOM 0 HB VAL A 635 186.705 -5.263 -1.624 1.00 0.00 H new ATOM 0 HG11 VAL A 635 189.113 -5.240 -1.246 1.00 0.00 H new ATOM 0 HG12 VAL A 635 188.252 -4.102 -0.183 1.00 0.00 H new ATOM 0 HG13 VAL A 635 188.847 -5.649 0.465 1.00 0.00 H new ATOM 0 HG21 VAL A 635 188.031 -7.325 -1.969 1.00 0.00 H new ATOM 0 HG22 VAL A 635 187.669 -7.824 -0.299 1.00 0.00 H new ATOM 0 HG23 VAL A 635 186.355 -7.688 -1.492 1.00 0.00 H new ATOM 634 N GLY A 636 187.479 -5.118 2.255 1.00 0.00 N ATOM 635 CA GLY A 636 187.973 -4.239 3.298 1.00 0.00 C ATOM 636 C GLY A 636 189.481 -4.090 3.268 1.00 0.00 C ATOM 637 O GLY A 636 190.196 -5.022 2.900 1.00 0.00 O ATOM 0 H GLY A 636 187.930 -6.032 2.216 1.00 0.00 H new ATOM 0 HA2 GLY A 636 187.512 -3.257 3.189 1.00 0.00 H new ATOM 0 HA3 GLY A 636 187.669 -4.628 4.270 1.00 0.00 H new ATOM 641 N GLY A 637 189.966 -2.915 3.654 1.00 0.00 N ATOM 642 CA GLY A 637 191.395 -2.669 3.662 1.00 0.00 C ATOM 643 C GLY A 637 191.950 -2.419 2.274 1.00 0.00 C ATOM 644 O GLY A 637 192.790 -3.176 1.787 1.00 0.00 O ATOM 0 H GLY A 637 189.394 -2.128 3.962 1.00 0.00 H new ATOM 0 HA2 GLY A 637 191.608 -1.808 4.295 1.00 0.00 H new ATOM 0 HA3 GLY A 637 191.905 -3.525 4.105 1.00 0.00 H new ATOM 648 N LYS A 638 191.481 -1.352 1.634 1.00 0.00 N ATOM 649 CA LYS A 638 191.937 -1.002 0.294 1.00 0.00 C ATOM 650 C LYS A 638 192.580 0.380 0.281 1.00 0.00 C ATOM 651 O LYS A 638 191.916 1.383 0.015 1.00 0.00 O ATOM 652 CB LYS A 638 190.766 -1.043 -0.691 1.00 0.00 C ATOM 653 CG LYS A 638 190.300 -2.451 -1.024 1.00 0.00 C ATOM 654 CD LYS A 638 191.359 -3.222 -1.797 1.00 0.00 C ATOM 655 CE LYS A 638 191.525 -4.635 -1.261 1.00 0.00 C ATOM 656 NZ LYS A 638 192.956 -5.044 -1.208 1.00 0.00 N ATOM 0 H LYS A 638 190.785 -0.715 2.022 1.00 0.00 H new ATOM 0 HA LYS A 638 192.686 -1.733 -0.011 1.00 0.00 H new ATOM 0 HB2 LYS A 638 189.930 -0.482 -0.273 1.00 0.00 H new ATOM 0 HB3 LYS A 638 191.059 -0.539 -1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 638 190.061 -2.983 -0.103 1.00 0.00 H new ATOM 0 HG3 LYS A 638 189.383 -2.402 -1.611 1.00 0.00 H new ATOM 0 HD2 LYS A 638 191.084 -3.262 -2.851 1.00 0.00 H new ATOM 0 HD3 LYS A 638 192.311 -2.695 -1.736 1.00 0.00 H new ATOM 0 HE2 LYS A 638 191.092 -4.698 -0.263 1.00 0.00 H new ATOM 0 HE3 LYS A 638 190.972 -5.330 -1.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 638 193.027 -6.013 -0.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 638 193.363 -5.009 -2.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 638 193.479 -4.396 -0.585 1.00 0.00 H new ATOM 763 N LEU A 645 192.431 3.651 4.322 1.00 0.00 N ATOM 764 CA LEU A 645 191.808 2.395 3.926 1.00 0.00 C ATOM 765 C LEU A 645 190.302 2.564 3.758 1.00 0.00 C ATOM 766 O LEU A 645 189.687 3.413 4.404 1.00 0.00 O ATOM 767 CB LEU A 645 192.100 1.308 4.961 1.00 0.00 C ATOM 768 CG LEU A 645 193.573 0.919 5.090 1.00 0.00 C ATOM 769 CD1 LEU A 645 193.747 -0.180 6.126 1.00 0.00 C ATOM 770 CD2 LEU A 645 194.124 0.477 3.743 1.00 0.00 C ATOM 0 HA LEU A 645 192.230 2.095 2.967 1.00 0.00 H new ATOM 0 HB2 LEU A 645 191.743 1.647 5.933 1.00 0.00 H new ATOM 0 HB3 LEU A 645 191.526 0.418 4.703 1.00 0.00 H new ATOM 0 HG LEU A 645 194.133 1.793 5.422 1.00 0.00 H new ATOM 0 HD11 LEU A 645 194.802 -0.443 6.203 1.00 0.00 H new ATOM 0 HD12 LEU A 645 193.389 0.172 7.093 1.00 0.00 H new ATOM 0 HD13 LEU A 645 193.175 -1.058 5.825 1.00 0.00 H new ATOM 0 HD21 LEU A 645 195.174 0.203 3.851 1.00 0.00 H new ATOM 0 HD22 LEU A 645 193.560 -0.384 3.384 1.00 0.00 H new ATOM 0 HD23 LEU A 645 194.034 1.294 3.027 1.00 0.00 H new ATOM 782 N GLY A 646 189.713 1.754 2.885 1.00 0.00 N ATOM 783 CA GLY A 646 188.282 1.834 2.648 1.00 0.00 C ATOM 784 C GLY A 646 187.689 0.512 2.203 1.00 0.00 C ATOM 785 O GLY A 646 188.292 -0.544 2.394 1.00 0.00 O ATOM 0 H GLY A 646 190.199 1.044 2.337 1.00 0.00 H new ATOM 0 HA2 GLY A 646 187.784 2.162 3.561 1.00 0.00 H new ATOM 0 HA3 GLY A 646 188.085 2.590 1.888 1.00 0.00 H new ATOM 789 N ALA A 647 186.500 0.571 1.611 1.00 0.00 N ATOM 790 CA ALA A 647 185.820 -0.630 1.139 1.00 0.00 C ATOM 791 C ALA A 647 185.436 -0.505 -0.333 1.00 0.00 C ATOM 792 O ALA A 647 185.121 0.583 -0.813 1.00 0.00 O ATOM 793 CB ALA A 647 184.586 -0.904 1.986 1.00 0.00 C ATOM 0 H ALA A 647 185.988 1.438 1.447 1.00 0.00 H new ATOM 0 HA ALA A 647 186.510 -1.469 1.236 1.00 0.00 H new ATOM 0 HB1 ALA A 647 184.088 -1.803 1.623 1.00 0.00 H new ATOM 0 HB2 ALA A 647 184.882 -1.048 3.025 1.00 0.00 H new ATOM 0 HB3 ALA A 647 183.902 -0.058 1.918 1.00 0.00 H new ATOM 799 N PHE A 648 185.462 -1.630 -1.041 1.00 0.00 N ATOM 800 CA PHE A 648 185.115 -1.651 -2.457 1.00 0.00 C ATOM 801 C PHE A 648 184.245 -2.860 -2.783 1.00 0.00 C ATOM 802 O PHE A 648 184.486 -3.960 -2.286 1.00 0.00 O ATOM 803 CB PHE A 648 186.382 -1.675 -3.315 1.00 0.00 C ATOM 804 CG PHE A 648 187.058 -0.338 -3.427 1.00 0.00 C ATOM 805 CD1 PHE A 648 187.894 0.117 -2.421 1.00 0.00 C ATOM 806 CD2 PHE A 648 186.858 0.461 -4.541 1.00 0.00 C ATOM 807 CE1 PHE A 648 188.518 1.346 -2.522 1.00 0.00 C ATOM 808 CE2 PHE A 648 187.479 1.691 -4.648 1.00 0.00 C ATOM 809 CZ PHE A 648 188.310 2.135 -3.637 1.00 0.00 C ATOM 0 H PHE A 648 185.720 -2.539 -0.657 1.00 0.00 H new ATOM 0 HA PHE A 648 184.551 -0.746 -2.681 1.00 0.00 H new ATOM 0 HB2 PHE A 648 187.084 -2.393 -2.891 1.00 0.00 H new ATOM 0 HB3 PHE A 648 186.128 -2.029 -4.314 1.00 0.00 H new ATOM 0 HD1 PHE A 648 188.060 -0.496 -1.547 1.00 0.00 H new ATOM 0 HD2 PHE A 648 186.210 0.119 -5.334 1.00 0.00 H new ATOM 0 HE1 PHE A 648 189.167 1.689 -1.730 1.00 0.00 H new ATOM 0 HE2 PHE A 648 187.315 2.305 -5.521 1.00 0.00 H new ATOM 0 HZ PHE A 648 188.796 3.096 -3.718 1.00 0.00 H new ATOM 819 N ILE A 649 183.234 -2.654 -3.622 1.00 0.00 N ATOM 820 CA ILE A 649 182.336 -3.735 -4.009 1.00 0.00 C ATOM 821 C ILE A 649 182.992 -4.639 -5.050 1.00 0.00 C ATOM 822 O ILE A 649 183.353 -4.190 -6.137 1.00 0.00 O ATOM 823 CB ILE A 649 181.004 -3.191 -4.571 1.00 0.00 C ATOM 824 CG1 ILE A 649 180.279 -2.358 -3.512 1.00 0.00 C ATOM 825 CG2 ILE A 649 180.114 -4.331 -5.048 1.00 0.00 C ATOM 826 CD1 ILE A 649 179.288 -1.372 -4.095 1.00 0.00 C ATOM 0 H ILE A 649 183.017 -1.752 -4.045 1.00 0.00 H new ATOM 0 HA ILE A 649 182.125 -4.313 -3.110 1.00 0.00 H new ATOM 0 HB ILE A 649 181.229 -2.552 -5.425 1.00 0.00 H new ATOM 0 HG12 ILE A 649 179.755 -3.028 -2.830 1.00 0.00 H new ATOM 0 HG13 ILE A 649 181.016 -1.814 -2.921 1.00 0.00 H new ATOM 0 HG21 ILE A 649 179.181 -3.925 -5.440 1.00 0.00 H new ATOM 0 HG22 ILE A 649 180.625 -4.888 -5.833 1.00 0.00 H new ATOM 0 HG23 ILE A 649 179.897 -4.997 -4.213 1.00 0.00 H new ATOM 0 HD11 ILE A 649 178.811 -0.816 -3.288 1.00 0.00 H new ATOM 0 HD12 ILE A 649 179.810 -0.679 -4.755 1.00 0.00 H new ATOM 0 HD13 ILE A 649 178.529 -1.911 -4.662 1.00 0.00 H new ATOM 838 N THR A 650 183.154 -5.911 -4.705 1.00 0.00 N ATOM 839 CA THR A 650 183.777 -6.871 -5.609 1.00 0.00 C ATOM 840 C THR A 650 182.772 -7.427 -6.615 1.00 0.00 C ATOM 841 O THR A 650 183.137 -7.770 -7.739 1.00 0.00 O ATOM 842 CB THR A 650 184.417 -8.019 -4.818 1.00 0.00 C ATOM 843 OG1 THR A 650 183.452 -9.000 -4.476 1.00 0.00 O ATOM 844 CG2 THR A 650 185.087 -7.567 -3.538 1.00 0.00 C ATOM 0 H THR A 650 182.864 -6.301 -3.808 1.00 0.00 H new ATOM 0 HA THR A 650 184.553 -6.343 -6.163 1.00 0.00 H new ATOM 0 HB THR A 650 185.178 -8.431 -5.481 1.00 0.00 H new ATOM 0 HG1 THR A 650 183.884 -9.722 -3.974 1.00 0.00 H new ATOM 0 HG21 THR A 650 185.518 -8.429 -3.029 1.00 0.00 H new ATOM 0 HG22 THR A 650 185.876 -6.852 -3.773 1.00 0.00 H new ATOM 0 HG23 THR A 650 184.350 -7.094 -2.889 1.00 0.00 H new ATOM 852 N LYS A 651 181.506 -7.519 -6.212 1.00 0.00 N ATOM 853 CA LYS A 651 180.472 -8.040 -7.100 1.00 0.00 C ATOM 854 C LYS A 651 179.071 -7.726 -6.581 1.00 0.00 C ATOM 855 O LYS A 651 178.861 -7.551 -5.380 1.00 0.00 O ATOM 856 CB LYS A 651 180.638 -9.554 -7.275 1.00 0.00 C ATOM 857 CG LYS A 651 180.284 -10.362 -6.035 1.00 0.00 C ATOM 858 CD LYS A 651 180.143 -11.841 -6.356 1.00 0.00 C ATOM 859 CE LYS A 651 178.777 -12.156 -6.942 1.00 0.00 C ATOM 860 NZ LYS A 651 178.335 -13.539 -6.611 1.00 0.00 N ATOM 0 H LYS A 651 181.175 -7.243 -5.287 1.00 0.00 H new ATOM 0 HA LYS A 651 180.589 -7.548 -8.066 1.00 0.00 H new ATOM 0 HB2 LYS A 651 180.011 -9.885 -8.103 1.00 0.00 H new ATOM 0 HB3 LYS A 651 181.671 -9.766 -7.552 1.00 0.00 H new ATOM 0 HG2 LYS A 651 181.056 -10.225 -5.277 1.00 0.00 H new ATOM 0 HG3 LYS A 651 179.351 -9.990 -5.611 1.00 0.00 H new ATOM 0 HD2 LYS A 651 180.920 -12.137 -7.061 1.00 0.00 H new ATOM 0 HD3 LYS A 651 180.295 -12.427 -5.450 1.00 0.00 H new ATOM 0 HE2 LYS A 651 178.046 -11.441 -6.564 1.00 0.00 H new ATOM 0 HE3 LYS A 651 178.810 -12.035 -8.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 651 177.992 -14.010 -7.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 651 179.136 -14.075 -6.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 651 177.568 -13.500 -5.910 1.00 0.00 H new ATOM 874 N VAL A 652 178.116 -7.665 -7.503 1.00 0.00 N ATOM 875 CA VAL A 652 176.725 -7.382 -7.160 1.00 0.00 C ATOM 876 C VAL A 652 175.791 -8.419 -7.775 1.00 0.00 C ATOM 877 O VAL A 652 175.905 -8.746 -8.956 1.00 0.00 O ATOM 878 CB VAL A 652 176.276 -5.977 -7.629 1.00 0.00 C ATOM 879 CG1 VAL A 652 176.127 -5.036 -6.444 1.00 0.00 C ATOM 880 CG2 VAL A 652 177.242 -5.399 -8.653 1.00 0.00 C ATOM 0 H VAL A 652 178.280 -7.809 -8.499 1.00 0.00 H new ATOM 0 HA VAL A 652 176.667 -7.421 -6.072 1.00 0.00 H new ATOM 0 HB VAL A 652 175.304 -6.084 -8.110 1.00 0.00 H new ATOM 0 HG11 VAL A 652 175.811 -4.054 -6.797 1.00 0.00 H new ATOM 0 HG12 VAL A 652 175.380 -5.432 -5.756 1.00 0.00 H new ATOM 0 HG13 VAL A 652 177.083 -4.946 -5.929 1.00 0.00 H new ATOM 0 HG21 VAL A 652 176.898 -4.412 -8.962 1.00 0.00 H new ATOM 0 HG22 VAL A 652 178.234 -5.315 -8.210 1.00 0.00 H new ATOM 0 HG23 VAL A 652 177.287 -6.056 -9.522 1.00 0.00 H new ATOM 890 N LYS A 653 174.863 -8.927 -6.972 1.00 0.00 N ATOM 891 CA LYS A 653 173.907 -9.918 -7.447 1.00 0.00 C ATOM 892 C LYS A 653 172.745 -9.237 -8.165 1.00 0.00 C ATOM 893 O LYS A 653 171.888 -8.621 -7.532 1.00 0.00 O ATOM 894 CB LYS A 653 173.386 -10.759 -6.279 1.00 0.00 C ATOM 895 CG LYS A 653 173.749 -12.231 -6.382 1.00 0.00 C ATOM 896 CD LYS A 653 172.615 -13.121 -5.899 1.00 0.00 C ATOM 897 CE LYS A 653 173.116 -14.504 -5.517 1.00 0.00 C ATOM 898 NZ LYS A 653 173.572 -14.559 -4.101 1.00 0.00 N ATOM 0 H LYS A 653 174.753 -8.669 -5.991 1.00 0.00 H new ATOM 0 HA LYS A 653 174.415 -10.576 -8.152 1.00 0.00 H new ATOM 0 HB2 LYS A 653 173.785 -10.359 -5.347 1.00 0.00 H new ATOM 0 HB3 LYS A 653 172.301 -10.663 -6.228 1.00 0.00 H new ATOM 0 HG2 LYS A 653 173.989 -12.476 -7.417 1.00 0.00 H new ATOM 0 HG3 LYS A 653 174.644 -12.428 -5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 653 172.129 -12.659 -5.040 1.00 0.00 H new ATOM 0 HD3 LYS A 653 171.862 -13.209 -6.682 1.00 0.00 H new ATOM 0 HE2 LYS A 653 172.321 -15.233 -5.671 1.00 0.00 H new ATOM 0 HE3 LYS A 653 173.938 -14.786 -6.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 173.906 -15.519 -3.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 174.348 -13.882 -3.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 172.781 -14.315 -3.472 1.00 0.00 H new ATOM 912 N LYS A 654 172.726 -9.349 -9.490 1.00 0.00 N ATOM 913 CA LYS A 654 171.672 -8.740 -10.294 1.00 0.00 C ATOM 914 C LYS A 654 170.298 -9.259 -9.884 1.00 0.00 C ATOM 915 O LYS A 654 169.928 -10.388 -10.207 1.00 0.00 O ATOM 916 CB LYS A 654 171.912 -9.016 -11.780 1.00 0.00 C ATOM 917 CG LYS A 654 171.602 -7.828 -12.676 1.00 0.00 C ATOM 918 CD LYS A 654 171.497 -8.243 -14.135 1.00 0.00 C ATOM 919 CE LYS A 654 170.131 -8.831 -14.450 1.00 0.00 C ATOM 920 NZ LYS A 654 169.653 -8.431 -15.802 1.00 0.00 N ATOM 0 H LYS A 654 173.428 -9.856 -10.029 1.00 0.00 H new ATOM 0 HA LYS A 654 171.697 -7.664 -10.121 1.00 0.00 H new ATOM 0 HB2 LYS A 654 172.952 -9.307 -11.924 1.00 0.00 H new ATOM 0 HB3 LYS A 654 171.298 -9.863 -12.088 1.00 0.00 H new ATOM 0 HG2 LYS A 654 170.667 -7.367 -12.360 1.00 0.00 H new ATOM 0 HG3 LYS A 654 172.382 -7.075 -12.566 1.00 0.00 H new ATOM 0 HD2 LYS A 654 171.678 -7.379 -14.774 1.00 0.00 H new ATOM 0 HD3 LYS A 654 172.271 -8.976 -14.363 1.00 0.00 H new ATOM 0 HE2 LYS A 654 170.181 -9.918 -14.390 1.00 0.00 H new ATOM 0 HE3 LYS A 654 169.412 -8.503 -13.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 654 168.719 -8.852 -15.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 654 169.581 -7.395 -15.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 654 170.325 -8.766 -16.521 1.00 0.00 H new ATOM 934 N GLY A 655 169.546 -8.426 -9.170 1.00 0.00 N ATOM 935 CA GLY A 655 168.222 -8.820 -8.727 1.00 0.00 C ATOM 936 C GLY A 655 168.043 -8.663 -7.230 1.00 0.00 C ATOM 937 O GLY A 655 166.920 -8.522 -6.744 1.00 0.00 O ATOM 0 H GLY A 655 169.830 -7.487 -8.891 1.00 0.00 H new ATOM 0 HA2 GLY A 655 167.475 -8.218 -9.245 1.00 0.00 H new ATOM 0 HA3 GLY A 655 168.043 -9.859 -9.005 1.00 0.00 H new ATOM 941 N SER A 656 169.150 -8.688 -6.496 1.00 0.00 N ATOM 942 CA SER A 656 169.107 -8.549 -5.046 1.00 0.00 C ATOM 943 C SER A 656 168.748 -7.122 -4.645 1.00 0.00 C ATOM 944 O SER A 656 168.658 -6.232 -5.491 1.00 0.00 O ATOM 945 CB SER A 656 170.452 -8.942 -4.432 1.00 0.00 C ATOM 946 OG SER A 656 170.740 -10.311 -4.664 1.00 0.00 O ATOM 0 H SER A 656 170.087 -8.803 -6.881 1.00 0.00 H new ATOM 0 HA SER A 656 168.335 -9.218 -4.667 1.00 0.00 H new ATOM 0 HB2 SER A 656 171.243 -8.324 -4.856 1.00 0.00 H new ATOM 0 HB3 SER A 656 170.436 -8.747 -3.360 1.00 0.00 H new ATOM 0 HG SER A 656 171.520 -10.576 -4.133 1.00 0.00 H new ATOM 952 N LEU A 657 168.540 -6.915 -3.349 1.00 0.00 N ATOM 953 CA LEU A 657 168.184 -5.599 -2.828 1.00 0.00 C ATOM 954 C LEU A 657 169.216 -4.547 -3.217 1.00 0.00 C ATOM 955 O LEU A 657 168.878 -3.496 -3.760 1.00 0.00 O ATOM 956 CB LEU A 657 168.054 -5.650 -1.305 1.00 0.00 C ATOM 957 CG LEU A 657 167.103 -6.723 -0.766 1.00 0.00 C ATOM 958 CD1 LEU A 657 167.851 -7.705 0.126 1.00 0.00 C ATOM 959 CD2 LEU A 657 165.952 -6.083 -0.004 1.00 0.00 C ATOM 0 H LEU A 657 168.612 -7.643 -2.638 1.00 0.00 H new ATOM 0 HA LEU A 657 167.227 -5.319 -3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 657 169.043 -5.816 -0.878 1.00 0.00 H new ATOM 0 HB3 LEU A 657 167.714 -4.676 -0.953 1.00 0.00 H new ATOM 0 HG LEU A 657 166.693 -7.272 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 657 167.158 -8.459 0.499 1.00 0.00 H new ATOM 0 HD12 LEU A 657 168.640 -8.190 -0.449 1.00 0.00 H new ATOM 0 HD13 LEU A 657 168.291 -7.170 0.967 1.00 0.00 H new ATOM 0 HD21 LEU A 657 165.287 -6.861 0.371 1.00 0.00 H new ATOM 0 HD22 LEU A 657 166.346 -5.507 0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 657 165.398 -5.422 -0.670 1.00 0.00 H new ATOM 971 N ALA A 658 170.477 -4.836 -2.921 1.00 0.00 N ATOM 972 CA ALA A 658 171.575 -3.917 -3.216 1.00 0.00 C ATOM 973 C ALA A 658 171.490 -3.363 -4.635 1.00 0.00 C ATOM 974 O ALA A 658 171.889 -2.228 -4.890 1.00 0.00 O ATOM 975 CB ALA A 658 172.911 -4.611 -3.001 1.00 0.00 C ATOM 0 H ALA A 658 170.768 -5.705 -2.474 1.00 0.00 H new ATOM 0 HA ALA A 658 171.491 -3.074 -2.530 1.00 0.00 H new ATOM 0 HB1 ALA A 658 173.721 -3.917 -3.224 1.00 0.00 H new ATOM 0 HB2 ALA A 658 172.988 -4.938 -1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 658 172.982 -5.476 -3.661 1.00 0.00 H new ATOM 981 N ASP A 659 170.984 -4.172 -5.554 1.00 0.00 N ATOM 982 CA ASP A 659 170.865 -3.760 -6.949 1.00 0.00 C ATOM 983 C ASP A 659 169.594 -2.954 -7.195 1.00 0.00 C ATOM 984 O ASP A 659 169.634 -1.883 -7.803 1.00 0.00 O ATOM 985 CB ASP A 659 170.886 -4.986 -7.865 1.00 0.00 C ATOM 986 CG ASP A 659 171.093 -4.616 -9.321 1.00 0.00 C ATOM 987 OD1 ASP A 659 172.261 -4.449 -9.731 1.00 0.00 O ATOM 988 OD2 ASP A 659 170.087 -4.492 -10.051 1.00 0.00 O ATOM 0 H ASP A 659 170.649 -5.116 -5.362 1.00 0.00 H new ATOM 0 HA ASP A 659 171.717 -3.119 -7.175 1.00 0.00 H new ATOM 0 HB2 ASP A 659 171.682 -5.660 -7.547 1.00 0.00 H new ATOM 0 HB3 ASP A 659 169.947 -5.530 -7.761 1.00 0.00 H new ATOM 993 N VAL A 660 168.468 -3.482 -6.737 1.00 0.00 N ATOM 994 CA VAL A 660 167.178 -2.817 -6.926 1.00 0.00 C ATOM 995 C VAL A 660 167.039 -1.561 -6.067 1.00 0.00 C ATOM 996 O VAL A 660 166.662 -0.502 -6.569 1.00 0.00 O ATOM 997 CB VAL A 660 165.989 -3.760 -6.636 1.00 0.00 C ATOM 998 CG1 VAL A 660 165.620 -4.550 -7.882 1.00 0.00 C ATOM 999 CG2 VAL A 660 166.296 -4.700 -5.477 1.00 0.00 C ATOM 0 H VAL A 660 168.417 -4.367 -6.232 1.00 0.00 H new ATOM 0 HA VAL A 660 167.153 -2.527 -7.976 1.00 0.00 H new ATOM 0 HB VAL A 660 165.137 -3.145 -6.348 1.00 0.00 H new ATOM 0 HG11 VAL A 660 164.781 -5.209 -7.660 1.00 0.00 H new ATOM 0 HG12 VAL A 660 165.340 -3.862 -8.679 1.00 0.00 H new ATOM 0 HG13 VAL A 660 166.475 -5.146 -8.201 1.00 0.00 H new ATOM 0 HG21 VAL A 660 165.439 -5.350 -5.299 1.00 0.00 H new ATOM 0 HG22 VAL A 660 167.167 -5.307 -5.722 1.00 0.00 H new ATOM 0 HG23 VAL A 660 166.501 -4.116 -4.580 1.00 0.00 H new ATOM 1009 N VAL A 661 167.329 -1.676 -4.773 1.00 0.00 N ATOM 1010 CA VAL A 661 167.214 -0.534 -3.870 1.00 0.00 C ATOM 1011 C VAL A 661 168.516 0.262 -3.795 1.00 0.00 C ATOM 1012 O VAL A 661 168.500 1.468 -3.544 1.00 0.00 O ATOM 1013 CB VAL A 661 166.800 -0.971 -2.449 1.00 0.00 C ATOM 1014 CG1 VAL A 661 167.852 -1.880 -1.831 1.00 0.00 C ATOM 1015 CG2 VAL A 661 166.549 0.244 -1.568 1.00 0.00 C ATOM 0 H VAL A 661 167.642 -2.540 -4.330 1.00 0.00 H new ATOM 0 HA VAL A 661 166.435 0.106 -4.284 1.00 0.00 H new ATOM 0 HB VAL A 661 165.871 -1.537 -2.524 1.00 0.00 H new ATOM 0 HG11 VAL A 661 167.536 -2.174 -0.830 1.00 0.00 H new ATOM 0 HG12 VAL A 661 167.973 -2.770 -2.449 1.00 0.00 H new ATOM 0 HG13 VAL A 661 168.802 -1.349 -1.771 1.00 0.00 H new ATOM 0 HG21 VAL A 661 166.258 -0.084 -0.570 1.00 0.00 H new ATOM 0 HG22 VAL A 661 167.459 0.841 -1.503 1.00 0.00 H new ATOM 0 HG23 VAL A 661 165.750 0.847 -1.999 1.00 0.00 H new ATOM 1025 N GLY A 662 169.639 -0.412 -4.018 1.00 0.00 N ATOM 1026 CA GLY A 662 170.925 0.260 -3.973 1.00 0.00 C ATOM 1027 C GLY A 662 171.355 0.765 -5.336 1.00 0.00 C ATOM 1028 O GLY A 662 171.664 1.945 -5.502 1.00 0.00 O ATOM 0 H GLY A 662 169.682 -1.409 -4.229 1.00 0.00 H new ATOM 0 HA2 GLY A 662 170.871 1.098 -3.277 1.00 0.00 H new ATOM 0 HA3 GLY A 662 171.679 -0.427 -3.587 1.00 0.00 H new ATOM 1032 N HIS A 663 171.366 -0.133 -6.314 1.00 0.00 N ATOM 1033 CA HIS A 663 171.749 0.213 -7.677 1.00 0.00 C ATOM 1034 C HIS A 663 173.221 0.614 -7.766 1.00 0.00 C ATOM 1035 O HIS A 663 173.546 1.747 -8.123 1.00 0.00 O ATOM 1036 CB HIS A 663 170.868 1.349 -8.206 1.00 0.00 C ATOM 1037 CG HIS A 663 170.702 1.333 -9.694 1.00 0.00 C ATOM 1038 ND1 HIS A 663 171.508 2.055 -10.548 1.00 0.00 N ATOM 1039 CD2 HIS A 663 169.816 0.677 -10.480 1.00 0.00 C ATOM 1040 CE1 HIS A 663 171.126 1.843 -11.795 1.00 0.00 C ATOM 1041 NE2 HIS A 663 170.101 1.011 -11.781 1.00 0.00 N ATOM 0 H HIS A 663 171.112 -1.113 -6.187 1.00 0.00 H new ATOM 0 HA HIS A 663 171.604 -0.675 -8.293 1.00 0.00 H new ATOM 0 HB2 HIS A 663 169.886 1.284 -7.738 1.00 0.00 H new ATOM 0 HB3 HIS A 663 171.301 2.303 -7.907 1.00 0.00 H new ATOM 0 HD2 HIS A 663 169.031 0.014 -10.146 1.00 0.00 H new ATOM 0 HE1 HIS A 663 171.576 2.277 -12.676 1.00 0.00 H new ATOM 0 HE2 HIS A 663 169.602 0.671 -12.603 1.00 0.00 H new ATOM 1050 N LEU A 664 174.111 -0.329 -7.465 1.00 0.00 N ATOM 1051 CA LEU A 664 175.544 -0.074 -7.541 1.00 0.00 C ATOM 1052 C LEU A 664 176.233 -1.211 -8.283 1.00 0.00 C ATOM 1053 O LEU A 664 175.591 -2.191 -8.663 1.00 0.00 O ATOM 1054 CB LEU A 664 176.164 0.115 -6.147 1.00 0.00 C ATOM 1055 CG LEU A 664 175.511 -0.667 -5.006 1.00 0.00 C ATOM 1056 CD1 LEU A 664 174.126 -0.123 -4.700 1.00 0.00 C ATOM 1057 CD2 LEU A 664 175.447 -2.147 -5.341 1.00 0.00 C ATOM 0 H LEU A 664 173.864 -1.273 -7.167 1.00 0.00 H new ATOM 0 HA LEU A 664 175.692 0.856 -8.090 1.00 0.00 H new ATOM 0 HB2 LEU A 664 177.215 -0.168 -6.198 1.00 0.00 H new ATOM 0 HB3 LEU A 664 176.131 1.176 -5.898 1.00 0.00 H new ATOM 0 HG LEU A 664 176.125 -0.544 -4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 664 173.682 -0.695 -3.885 1.00 0.00 H new ATOM 0 HD12 LEU A 664 174.203 0.924 -4.408 1.00 0.00 H new ATOM 0 HD13 LEU A 664 173.498 -0.207 -5.587 1.00 0.00 H new ATOM 0 HD21 LEU A 664 174.979 -2.687 -4.517 1.00 0.00 H new ATOM 0 HD22 LEU A 664 174.860 -2.290 -6.248 1.00 0.00 H new ATOM 0 HD23 LEU A 664 176.456 -2.528 -5.498 1.00 0.00 H new ATOM 1069 N ARG A 665 177.533 -1.077 -8.502 1.00 0.00 N ATOM 1070 CA ARG A 665 178.287 -2.098 -9.216 1.00 0.00 C ATOM 1071 C ARG A 665 179.652 -2.321 -8.583 1.00 0.00 C ATOM 1072 O ARG A 665 180.152 -1.474 -7.843 1.00 0.00 O ATOM 1073 CB ARG A 665 178.453 -1.704 -10.684 1.00 0.00 C ATOM 1074 CG ARG A 665 177.231 -2.003 -11.538 1.00 0.00 C ATOM 1075 CD ARG A 665 177.052 -0.969 -12.639 1.00 0.00 C ATOM 1076 NE ARG A 665 176.945 -1.588 -13.958 1.00 0.00 N ATOM 1077 CZ ARG A 665 177.969 -2.146 -14.600 1.00 0.00 C ATOM 1078 NH1 ARG A 665 179.176 -2.165 -14.048 1.00 0.00 N ATOM 1079 NH2 ARG A 665 177.785 -2.689 -15.796 1.00 0.00 N ATOM 0 H ARG A 665 178.086 -0.276 -8.197 1.00 0.00 H new ATOM 0 HA ARG A 665 177.726 -3.031 -9.154 1.00 0.00 H new ATOM 0 HB2 ARG A 665 178.674 -0.638 -10.742 1.00 0.00 H new ATOM 0 HB3 ARG A 665 179.313 -2.231 -11.098 1.00 0.00 H new ATOM 0 HG2 ARG A 665 177.329 -2.994 -11.981 1.00 0.00 H new ATOM 0 HG3 ARG A 665 176.342 -2.022 -10.908 1.00 0.00 H new ATOM 0 HD2 ARG A 665 176.157 -0.380 -12.441 1.00 0.00 H new ATOM 0 HD3 ARG A 665 177.896 -0.279 -12.629 1.00 0.00 H new ATOM 0 HE ARG A 665 176.032 -1.593 -14.414 1.00 0.00 H new ATOM 0 HH11 ARG A 665 179.322 -1.751 -13.127 1.00 0.00 H new ATOM 0 HH12 ARG A 665 179.957 -2.594 -14.544 1.00 0.00 H new ATOM 0 HH21 ARG A 665 176.859 -2.679 -16.224 1.00 0.00 H new ATOM 0 HH22 ARG A 665 178.569 -3.117 -16.288 1.00 0.00 H new ATOM 1093 N ALA A 666 180.254 -3.466 -8.887 1.00 0.00 N ATOM 1094 CA ALA A 666 181.565 -3.802 -8.355 1.00 0.00 C ATOM 1095 C ALA A 666 182.588 -2.737 -8.728 1.00 0.00 C ATOM 1096 O ALA A 666 182.782 -2.431 -9.904 1.00 0.00 O ATOM 1097 CB ALA A 666 182.007 -5.165 -8.862 1.00 0.00 C ATOM 0 H ALA A 666 179.853 -4.176 -9.500 1.00 0.00 H new ATOM 0 HA ALA A 666 181.495 -3.841 -7.268 1.00 0.00 H new ATOM 0 HB1 ALA A 666 182.990 -5.403 -8.456 1.00 0.00 H new ATOM 0 HB2 ALA A 666 181.290 -5.922 -8.544 1.00 0.00 H new ATOM 0 HB3 ALA A 666 182.059 -5.149 -9.951 1.00 0.00 H new ATOM 1103 N GLY A 667 183.231 -2.168 -7.717 1.00 0.00 N ATOM 1104 CA GLY A 667 184.218 -1.132 -7.952 1.00 0.00 C ATOM 1105 C GLY A 667 183.928 0.120 -7.148 1.00 0.00 C ATOM 1106 O GLY A 667 184.823 0.924 -6.892 1.00 0.00 O ATOM 0 H GLY A 667 183.086 -2.406 -6.736 1.00 0.00 H new ATOM 0 HA2 GLY A 667 185.208 -1.508 -7.693 1.00 0.00 H new ATOM 0 HA3 GLY A 667 184.239 -0.885 -9.013 1.00 0.00 H new ATOM 1110 N ASP A 668 182.670 0.278 -6.745 1.00 0.00 N ATOM 1111 CA ASP A 668 182.259 1.435 -5.958 1.00 0.00 C ATOM 1112 C ASP A 668 182.933 1.416 -4.591 1.00 0.00 C ATOM 1113 O ASP A 668 183.133 0.354 -4.003 1.00 0.00 O ATOM 1114 CB ASP A 668 180.739 1.455 -5.794 1.00 0.00 C ATOM 1115 CG ASP A 668 180.065 2.414 -6.758 1.00 0.00 C ATOM 1116 OD1 ASP A 668 180.668 3.462 -7.069 1.00 0.00 O ATOM 1117 OD2 ASP A 668 178.936 2.116 -7.200 1.00 0.00 O ATOM 0 H ASP A 668 181.919 -0.381 -6.951 1.00 0.00 H new ATOM 0 HA ASP A 668 182.566 2.337 -6.487 1.00 0.00 H new ATOM 0 HB2 ASP A 668 180.346 0.450 -5.951 1.00 0.00 H new ATOM 0 HB3 ASP A 668 180.490 1.738 -4.771 1.00 0.00 H new ATOM 1122 N GLU A 669 183.285 2.595 -4.091 1.00 0.00 N ATOM 1123 CA GLU A 669 183.940 2.704 -2.795 1.00 0.00 C ATOM 1124 C GLU A 669 182.960 3.159 -1.719 1.00 0.00 C ATOM 1125 O GLU A 669 182.483 4.294 -1.740 1.00 0.00 O ATOM 1126 CB GLU A 669 185.116 3.679 -2.874 1.00 0.00 C ATOM 1127 CG GLU A 669 186.115 3.521 -1.738 1.00 0.00 C ATOM 1128 CD GLU A 669 187.325 4.420 -1.896 1.00 0.00 C ATOM 1129 OE1 GLU A 669 187.585 4.873 -3.030 1.00 0.00 O ATOM 1130 OE2 GLU A 669 188.012 4.673 -0.884 1.00 0.00 O ATOM 0 H GLU A 669 183.128 3.486 -4.562 1.00 0.00 H new ATOM 0 HA GLU A 669 184.312 1.716 -2.524 1.00 0.00 H new ATOM 0 HB2 GLU A 669 185.632 3.536 -3.823 1.00 0.00 H new ATOM 0 HB3 GLU A 669 184.732 4.699 -2.870 1.00 0.00 H new ATOM 0 HG2 GLU A 669 185.622 3.745 -0.792 1.00 0.00 H new ATOM 0 HG3 GLU A 669 186.443 2.483 -1.689 1.00 0.00 H new ATOM 1137 N VAL A 670 182.670 2.269 -0.776 1.00 0.00 N ATOM 1138 CA VAL A 670 181.754 2.584 0.313 1.00 0.00 C ATOM 1139 C VAL A 670 182.518 3.124 1.517 1.00 0.00 C ATOM 1140 O VAL A 670 183.179 2.372 2.233 1.00 0.00 O ATOM 1141 CB VAL A 670 180.928 1.349 0.739 1.00 0.00 C ATOM 1142 CG1 VAL A 670 180.166 1.616 2.033 1.00 0.00 C ATOM 1143 CG2 VAL A 670 179.968 0.942 -0.368 1.00 0.00 C ATOM 0 H VAL A 670 183.056 1.325 -0.744 1.00 0.00 H new ATOM 0 HA VAL A 670 181.067 3.347 -0.054 1.00 0.00 H new ATOM 0 HB VAL A 670 181.621 0.528 0.919 1.00 0.00 H new ATOM 0 HG11 VAL A 670 179.594 0.730 2.308 1.00 0.00 H new ATOM 0 HG12 VAL A 670 180.872 1.853 2.829 1.00 0.00 H new ATOM 0 HG13 VAL A 670 179.486 2.456 1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 670 179.395 0.071 -0.051 1.00 0.00 H new ATOM 0 HG22 VAL A 670 179.287 1.766 -0.581 1.00 0.00 H new ATOM 0 HG23 VAL A 670 180.533 0.697 -1.267 1.00 0.00 H new ATOM 1153 N LEU A 671 182.420 4.429 1.735 1.00 0.00 N ATOM 1154 CA LEU A 671 183.102 5.066 2.856 1.00 0.00 C ATOM 1155 C LEU A 671 182.276 4.962 4.138 1.00 0.00 C ATOM 1156 O LEU A 671 182.668 5.488 5.179 1.00 0.00 O ATOM 1157 CB LEU A 671 183.390 6.537 2.540 1.00 0.00 C ATOM 1158 CG LEU A 671 183.972 6.815 1.148 1.00 0.00 C ATOM 1159 CD1 LEU A 671 184.909 5.696 0.713 1.00 0.00 C ATOM 1160 CD2 LEU A 671 182.856 7.003 0.131 1.00 0.00 C ATOM 0 H LEU A 671 181.877 5.066 1.153 1.00 0.00 H new ATOM 0 HA LEU A 671 184.045 4.542 3.013 1.00 0.00 H new ATOM 0 HB2 LEU A 671 182.463 7.101 2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 671 184.084 6.921 3.288 1.00 0.00 H new ATOM 0 HG LEU A 671 184.551 7.737 1.202 1.00 0.00 H new ATOM 0 HD11 LEU A 671 185.307 5.919 -0.277 1.00 0.00 H new ATOM 0 HD12 LEU A 671 185.731 5.612 1.424 1.00 0.00 H new ATOM 0 HD13 LEU A 671 184.361 4.755 0.680 1.00 0.00 H new ATOM 0 HD21 LEU A 671 183.287 7.199 -0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 671 182.248 6.099 0.086 1.00 0.00 H new ATOM 0 HD23 LEU A 671 182.231 7.846 0.428 1.00 0.00 H new ATOM 1172 N GLU A 672 181.128 4.292 4.059 1.00 0.00 N ATOM 1173 CA GLU A 672 180.257 4.139 5.217 1.00 0.00 C ATOM 1174 C GLU A 672 179.482 2.827 5.163 1.00 0.00 C ATOM 1175 O GLU A 672 178.802 2.539 4.179 1.00 0.00 O ATOM 1176 CB GLU A 672 179.278 5.307 5.285 1.00 0.00 C ATOM 1177 CG GLU A 672 179.931 6.625 5.664 1.00 0.00 C ATOM 1178 CD GLU A 672 178.919 7.712 5.966 1.00 0.00 C ATOM 1179 OE1 GLU A 672 178.304 7.665 7.053 1.00 0.00 O ATOM 1180 OE2 GLU A 672 178.739 8.610 5.116 1.00 0.00 O ATOM 0 H GLU A 672 180.782 3.849 3.208 1.00 0.00 H new ATOM 0 HA GLU A 672 180.884 4.127 6.109 1.00 0.00 H new ATOM 0 HB2 GLU A 672 178.790 5.418 4.317 1.00 0.00 H new ATOM 0 HB3 GLU A 672 178.498 5.075 6.011 1.00 0.00 H new ATOM 0 HG2 GLU A 672 180.567 6.473 6.536 1.00 0.00 H new ATOM 0 HG3 GLU A 672 180.578 6.952 4.851 1.00 0.00 H new ATOM 1187 N TRP A 673 179.577 2.042 6.230 1.00 0.00 N ATOM 1188 CA TRP A 673 178.873 0.769 6.311 1.00 0.00 C ATOM 1189 C TRP A 673 178.124 0.657 7.634 1.00 0.00 C ATOM 1190 O TRP A 673 178.727 0.732 8.706 1.00 0.00 O ATOM 1191 CB TRP A 673 179.853 -0.395 6.170 1.00 0.00 C ATOM 1192 CG TRP A 673 179.179 -1.693 5.854 1.00 0.00 C ATOM 1193 CD1 TRP A 673 178.541 -2.521 6.733 1.00 0.00 C ATOM 1194 CD2 TRP A 673 179.072 -2.310 4.568 1.00 0.00 C ATOM 1195 NE1 TRP A 673 178.046 -3.618 6.069 1.00 0.00 N ATOM 1196 CE2 TRP A 673 178.359 -3.510 4.739 1.00 0.00 C ATOM 1197 CE3 TRP A 673 179.510 -1.963 3.287 1.00 0.00 C ATOM 1198 CZ2 TRP A 673 178.078 -4.365 3.678 1.00 0.00 C ATOM 1199 CZ3 TRP A 673 179.228 -2.812 2.236 1.00 0.00 C ATOM 1200 CH2 TRP A 673 178.517 -4.003 2.437 1.00 0.00 C ATOM 0 H TRP A 673 180.137 2.266 7.053 1.00 0.00 H new ATOM 0 HA TRP A 673 178.154 0.725 5.493 1.00 0.00 H new ATOM 0 HB2 TRP A 673 180.571 -0.164 5.383 1.00 0.00 H new ATOM 0 HB3 TRP A 673 180.418 -0.501 7.096 1.00 0.00 H new ATOM 0 HD1 TRP A 673 178.440 -2.341 7.793 1.00 0.00 H new ATOM 0 HE1 TRP A 673 177.530 -4.387 6.496 1.00 0.00 H new ATOM 0 HE3 TRP A 673 180.059 -1.048 3.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 673 177.531 -5.284 3.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 673 179.561 -2.554 1.241 1.00 0.00 H new ATOM 0 HH2 TRP A 673 178.313 -4.647 1.594 1.00 0.00 H new ATOM 1211 N ASN A 674 176.812 0.479 7.558 1.00 0.00 N ATOM 1212 CA ASN A 674 175.989 0.359 8.756 1.00 0.00 C ATOM 1213 C ASN A 674 176.071 1.626 9.600 1.00 0.00 C ATOM 1214 O ASN A 674 176.080 1.568 10.830 1.00 0.00 O ATOM 1215 CB ASN A 674 176.426 -0.852 9.584 1.00 0.00 C ATOM 1216 CG ASN A 674 175.508 -1.110 10.762 1.00 0.00 C ATOM 1217 OD1 ASN A 674 174.265 -1.477 10.475 1.00 0.00 O flip ATOM 1218 ND2 ASN A 674 175.912 -0.981 11.918 1.00 0.00 N flip ATOM 0 H ASN A 674 176.295 0.414 6.681 1.00 0.00 H new ATOM 0 HA ASN A 674 174.954 0.219 8.443 1.00 0.00 H new ATOM 0 HB2 ASN A 674 176.450 -1.735 8.946 1.00 0.00 H new ATOM 0 HB3 ASN A 674 177.442 -0.693 9.947 1.00 0.00 H new ATOM 0 HD21 ASN A 674 176.876 -0.697 12.093 1.00 0.00 H new ATOM 0 HD22 ASN A 674 175.283 -1.158 12.701 1.00 0.00 H new ATOM 1225 N GLY A 675 176.123 2.771 8.928 1.00 0.00 N ATOM 1226 CA GLY A 675 176.194 4.043 9.624 1.00 0.00 C ATOM 1227 C GLY A 675 177.516 4.262 10.341 1.00 0.00 C ATOM 1228 O GLY A 675 177.630 5.164 11.170 1.00 0.00 O ATOM 0 H GLY A 675 176.117 2.841 7.910 1.00 0.00 H new ATOM 0 HA2 GLY A 675 176.039 4.850 8.908 1.00 0.00 H new ATOM 0 HA3 GLY A 675 175.382 4.099 10.349 1.00 0.00 H new ATOM 1232 N LYS A 676 178.517 3.445 10.026 1.00 0.00 N ATOM 1233 CA LYS A 676 179.826 3.571 10.654 1.00 0.00 C ATOM 1234 C LYS A 676 180.858 4.067 9.656 1.00 0.00 C ATOM 1235 O LYS A 676 180.799 3.729 8.473 1.00 0.00 O ATOM 1236 CB LYS A 676 180.269 2.216 11.235 1.00 0.00 C ATOM 1237 CG LYS A 676 181.618 1.693 10.715 1.00 0.00 C ATOM 1238 CD LYS A 676 182.671 1.664 11.814 1.00 0.00 C ATOM 1239 CE LYS A 676 182.198 0.878 13.028 1.00 0.00 C ATOM 1240 NZ LYS A 676 181.955 1.761 14.202 1.00 0.00 N ATOM 0 H LYS A 676 178.446 2.692 9.342 1.00 0.00 H new ATOM 0 HA LYS A 676 179.748 4.299 11.462 1.00 0.00 H new ATOM 0 HB2 LYS A 676 180.325 2.304 12.320 1.00 0.00 H new ATOM 0 HB3 LYS A 676 179.500 1.475 11.015 1.00 0.00 H new ATOM 0 HG2 LYS A 676 181.488 0.690 10.309 1.00 0.00 H new ATOM 0 HG3 LYS A 676 181.963 2.325 9.897 1.00 0.00 H new ATOM 0 HD2 LYS A 676 183.588 1.219 11.427 1.00 0.00 H new ATOM 0 HD3 LYS A 676 182.913 2.684 12.113 1.00 0.00 H new ATOM 0 HE2 LYS A 676 181.281 0.344 12.780 1.00 0.00 H new ATOM 0 HE3 LYS A 676 182.944 0.127 13.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 181.127 1.417 14.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 182.790 1.751 14.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 181.778 2.732 13.875 1.00 0.00 H new ATOM 1254 N PRO A 677 181.844 4.848 10.117 1.00 0.00 N ATOM 1255 CA PRO A 677 182.893 5.336 9.243 1.00 0.00 C ATOM 1256 C PRO A 677 183.970 4.276 9.041 1.00 0.00 C ATOM 1257 O PRO A 677 184.617 3.837 9.991 1.00 0.00 O ATOM 1258 CB PRO A 677 183.449 6.528 10.017 1.00 0.00 C ATOM 1259 CG PRO A 677 183.258 6.164 11.452 1.00 0.00 C ATOM 1260 CD PRO A 677 182.028 5.291 11.513 1.00 0.00 C ATOM 0 HA PRO A 677 182.538 5.592 8.245 1.00 0.00 H new ATOM 0 HB2 PRO A 677 184.501 6.695 9.787 1.00 0.00 H new ATOM 0 HB3 PRO A 677 182.918 7.446 9.766 1.00 0.00 H new ATOM 0 HG2 PRO A 677 184.129 5.634 11.837 1.00 0.00 H new ATOM 0 HG3 PRO A 677 183.131 7.056 12.065 1.00 0.00 H new ATOM 0 HD2 PRO A 677 182.170 4.445 12.186 1.00 0.00 H new ATOM 0 HD3 PRO A 677 181.162 5.845 11.875 1.00 0.00 H new ATOM 1268 N LEU A 678 184.145 3.870 7.794 1.00 0.00 N ATOM 1269 CA LEU A 678 185.131 2.858 7.436 1.00 0.00 C ATOM 1270 C LEU A 678 186.504 3.467 7.131 1.00 0.00 C ATOM 1271 O LEU A 678 187.528 2.873 7.467 1.00 0.00 O ATOM 1272 CB LEU A 678 184.642 2.049 6.235 1.00 0.00 C ATOM 1273 CG LEU A 678 183.221 1.495 6.367 1.00 0.00 C ATOM 1274 CD1 LEU A 678 182.683 1.067 5.009 1.00 0.00 C ATOM 1275 CD2 LEU A 678 183.190 0.333 7.353 1.00 0.00 C ATOM 0 H LEU A 678 183.611 4.230 7.003 1.00 0.00 H new ATOM 0 HA LEU A 678 185.248 2.202 8.298 1.00 0.00 H new ATOM 0 HB2 LEU A 678 184.690 2.679 5.347 1.00 0.00 H new ATOM 0 HB3 LEU A 678 185.327 1.217 6.072 1.00 0.00 H new ATOM 0 HG LEU A 678 182.577 2.286 6.752 1.00 0.00 H new ATOM 0 HD11 LEU A 678 181.672 0.676 5.125 1.00 0.00 H new ATOM 0 HD12 LEU A 678 182.665 1.925 4.338 1.00 0.00 H new ATOM 0 HD13 LEU A 678 183.326 0.292 4.591 1.00 0.00 H new ATOM 0 HD21 LEU A 678 182.172 -0.048 7.434 1.00 0.00 H new ATOM 0 HD22 LEU A 678 183.848 -0.461 7.000 1.00 0.00 H new ATOM 0 HD23 LEU A 678 183.528 0.676 8.331 1.00 0.00 H new ATOM 1287 N PRO A 679 186.560 4.655 6.487 1.00 0.00 N ATOM 1288 CA PRO A 679 187.832 5.304 6.152 1.00 0.00 C ATOM 1289 C PRO A 679 188.852 5.211 7.282 1.00 0.00 C ATOM 1290 O PRO A 679 188.667 5.789 8.354 1.00 0.00 O ATOM 1291 CB PRO A 679 187.418 6.752 5.907 1.00 0.00 C ATOM 1292 CG PRO A 679 186.042 6.644 5.348 1.00 0.00 C ATOM 1293 CD PRO A 679 185.406 5.458 6.030 1.00 0.00 C ATOM 0 HA PRO A 679 188.326 4.835 5.301 1.00 0.00 H new ATOM 0 HB2 PRO A 679 187.429 7.332 6.830 1.00 0.00 H new ATOM 0 HB3 PRO A 679 188.094 7.248 5.210 1.00 0.00 H new ATOM 0 HG2 PRO A 679 185.472 7.554 5.536 1.00 0.00 H new ATOM 0 HG3 PRO A 679 186.070 6.504 4.267 1.00 0.00 H new ATOM 0 HD2 PRO A 679 184.777 5.766 6.865 1.00 0.00 H new ATOM 0 HD3 PRO A 679 184.772 4.895 5.345 1.00 0.00 H new ATOM 1301 N GLY A 680 189.925 4.469 7.033 1.00 0.00 N ATOM 1302 CA GLY A 680 190.961 4.296 8.034 1.00 0.00 C ATOM 1303 C GLY A 680 190.989 2.890 8.604 1.00 0.00 C ATOM 1304 O GLY A 680 191.945 2.510 9.281 1.00 0.00 O ATOM 0 H GLY A 680 190.096 3.983 6.153 1.00 0.00 H new ATOM 0 HA2 GLY A 680 191.931 4.525 7.592 1.00 0.00 H new ATOM 0 HA3 GLY A 680 190.803 5.009 8.843 1.00 0.00 H new ATOM 1308 N ALA A 681 189.942 2.114 8.332 1.00 0.00 N ATOM 1309 CA ALA A 681 189.858 0.745 8.825 1.00 0.00 C ATOM 1310 C ALA A 681 190.307 -0.247 7.758 1.00 0.00 C ATOM 1311 O ALA A 681 189.893 -0.162 6.602 1.00 0.00 O ATOM 1312 CB ALA A 681 188.437 0.438 9.278 1.00 0.00 C ATOM 0 H ALA A 681 189.142 2.411 7.773 1.00 0.00 H new ATOM 0 HA ALA A 681 190.528 0.645 9.679 1.00 0.00 H new ATOM 0 HB1 ALA A 681 188.385 -0.587 9.644 1.00 0.00 H new ATOM 0 HB2 ALA A 681 188.154 1.123 10.077 1.00 0.00 H new ATOM 0 HB3 ALA A 681 187.753 0.558 8.438 1.00 0.00 H new ATOM 1318 N THR A 682 191.153 -1.191 8.155 1.00 0.00 N ATOM 1319 CA THR A 682 191.659 -2.202 7.235 1.00 0.00 C ATOM 1320 C THR A 682 190.643 -3.326 7.056 1.00 0.00 C ATOM 1321 O THR A 682 189.502 -3.221 7.502 1.00 0.00 O ATOM 1322 CB THR A 682 192.987 -2.766 7.747 1.00 0.00 C ATOM 1323 OG1 THR A 682 193.472 -3.784 6.889 1.00 0.00 O ATOM 1324 CG2 THR A 682 192.892 -3.344 9.140 1.00 0.00 C ATOM 0 H THR A 682 191.503 -1.277 9.109 1.00 0.00 H new ATOM 0 HA THR A 682 191.825 -1.732 6.266 1.00 0.00 H new ATOM 0 HB THR A 682 193.669 -1.916 7.768 1.00 0.00 H new ATOM 0 HG1 THR A 682 194.322 -4.127 7.236 1.00 0.00 H new ATOM 0 HG21 THR A 682 193.867 -3.726 9.443 1.00 0.00 H new ATOM 0 HG22 THR A 682 192.575 -2.567 9.836 1.00 0.00 H new ATOM 0 HG23 THR A 682 192.165 -4.156 9.148 1.00 0.00 H new ATOM 1332 N ASN A 683 191.066 -4.400 6.397 1.00 0.00 N ATOM 1333 CA ASN A 683 190.193 -5.544 6.154 1.00 0.00 C ATOM 1334 C ASN A 683 189.604 -6.079 7.456 1.00 0.00 C ATOM 1335 O ASN A 683 188.392 -6.258 7.571 1.00 0.00 O ATOM 1336 CB ASN A 683 190.964 -6.655 5.438 1.00 0.00 C ATOM 1337 CG ASN A 683 192.310 -6.931 6.080 1.00 0.00 C ATOM 1338 OD1 ASN A 683 193.285 -6.223 5.831 1.00 0.00 O ATOM 1339 ND2 ASN A 683 192.369 -7.966 6.911 1.00 0.00 N ATOM 0 H ASN A 683 192.009 -4.502 6.021 1.00 0.00 H new ATOM 0 HA ASN A 683 189.372 -5.208 5.521 1.00 0.00 H new ATOM 0 HB2 ASN A 683 190.368 -7.568 5.442 1.00 0.00 H new ATOM 0 HB3 ASN A 683 191.112 -6.376 4.395 1.00 0.00 H new ATOM 0 HD21 ASN A 683 193.248 -8.201 7.372 1.00 0.00 H new ATOM 0 HD22 ASN A 683 191.535 -8.526 7.088 1.00 0.00 H new ATOM 1346 N GLU A 684 190.469 -6.339 8.431 1.00 0.00 N ATOM 1347 CA GLU A 684 190.029 -6.863 9.720 1.00 0.00 C ATOM 1348 C GLU A 684 189.031 -5.924 10.386 1.00 0.00 C ATOM 1349 O GLU A 684 188.090 -6.373 11.040 1.00 0.00 O ATOM 1350 CB GLU A 684 191.230 -7.098 10.639 1.00 0.00 C ATOM 1351 CG GLU A 684 191.375 -8.542 11.092 1.00 0.00 C ATOM 1352 CD GLU A 684 192.043 -8.664 12.447 1.00 0.00 C ATOM 1353 OE1 GLU A 684 192.979 -7.882 12.720 1.00 0.00 O ATOM 1354 OE2 GLU A 684 191.632 -9.541 13.236 1.00 0.00 O ATOM 0 H GLU A 684 191.476 -6.196 8.354 1.00 0.00 H new ATOM 0 HA GLU A 684 189.529 -7.815 9.541 1.00 0.00 H new ATOM 0 HB2 GLU A 684 192.139 -6.796 10.120 1.00 0.00 H new ATOM 0 HB3 GLU A 684 191.136 -6.458 11.516 1.00 0.00 H new ATOM 0 HG2 GLU A 684 190.390 -9.006 11.134 1.00 0.00 H new ATOM 0 HG3 GLU A 684 191.956 -9.094 10.353 1.00 0.00 H new ATOM 1361 N GLU A 685 189.230 -4.625 10.211 1.00 0.00 N ATOM 1362 CA GLU A 685 188.326 -3.644 10.791 1.00 0.00 C ATOM 1363 C GLU A 685 186.942 -3.803 10.182 1.00 0.00 C ATOM 1364 O GLU A 685 185.974 -4.107 10.879 1.00 0.00 O ATOM 1365 CB GLU A 685 188.846 -2.225 10.559 1.00 0.00 C ATOM 1366 CG GLU A 685 189.973 -1.830 11.500 1.00 0.00 C ATOM 1367 CD GLU A 685 189.517 -0.879 12.589 1.00 0.00 C ATOM 1368 OE1 GLU A 685 189.075 -1.364 13.653 1.00 0.00 O ATOM 1369 OE2 GLU A 685 189.601 0.349 12.380 1.00 0.00 O ATOM 0 H GLU A 685 190.003 -4.229 9.676 1.00 0.00 H new ATOM 0 HA GLU A 685 188.268 -3.813 11.866 1.00 0.00 H new ATOM 0 HB2 GLU A 685 189.195 -2.138 9.530 1.00 0.00 H new ATOM 0 HB3 GLU A 685 188.022 -1.521 10.676 1.00 0.00 H new ATOM 0 HG2 GLU A 685 190.391 -2.727 11.957 1.00 0.00 H new ATOM 0 HG3 GLU A 685 190.773 -1.363 10.926 1.00 0.00 H new ATOM 1376 N VAL A 686 186.862 -3.618 8.866 1.00 0.00 N ATOM 1377 CA VAL A 686 185.605 -3.757 8.144 1.00 0.00 C ATOM 1378 C VAL A 686 184.891 -5.047 8.539 1.00 0.00 C ATOM 1379 O VAL A 686 183.675 -5.062 8.731 1.00 0.00 O ATOM 1380 CB VAL A 686 185.839 -3.746 6.618 1.00 0.00 C ATOM 1381 CG1 VAL A 686 184.548 -4.036 5.867 1.00 0.00 C ATOM 1382 CG2 VAL A 686 186.432 -2.413 6.182 1.00 0.00 C ATOM 0 H VAL A 686 187.658 -3.370 8.278 1.00 0.00 H new ATOM 0 HA VAL A 686 184.978 -2.906 8.412 1.00 0.00 H new ATOM 0 HB VAL A 686 186.550 -4.535 6.375 1.00 0.00 H new ATOM 0 HG11 VAL A 686 184.740 -4.022 4.794 1.00 0.00 H new ATOM 0 HG12 VAL A 686 184.172 -5.017 6.156 1.00 0.00 H new ATOM 0 HG13 VAL A 686 183.806 -3.276 6.112 1.00 0.00 H new ATOM 0 HG21 VAL A 686 186.591 -2.421 5.104 1.00 0.00 H new ATOM 0 HG22 VAL A 686 185.746 -1.607 6.442 1.00 0.00 H new ATOM 0 HG23 VAL A 686 187.384 -2.255 6.688 1.00 0.00 H new ATOM 1392 N TYR A 687 185.659 -6.127 8.668 1.00 0.00 N ATOM 1393 CA TYR A 687 185.100 -7.421 9.050 1.00 0.00 C ATOM 1394 C TYR A 687 184.206 -7.283 10.275 1.00 0.00 C ATOM 1395 O TYR A 687 183.081 -7.775 10.295 1.00 0.00 O ATOM 1396 CB TYR A 687 186.222 -8.426 9.338 1.00 0.00 C ATOM 1397 CG TYR A 687 186.931 -8.944 8.102 1.00 0.00 C ATOM 1398 CD1 TYR A 687 186.770 -8.328 6.868 1.00 0.00 C ATOM 1399 CD2 TYR A 687 187.768 -10.052 8.174 1.00 0.00 C ATOM 1400 CE1 TYR A 687 187.418 -8.799 5.741 1.00 0.00 C ATOM 1401 CE2 TYR A 687 188.420 -10.529 7.053 1.00 0.00 C ATOM 1402 CZ TYR A 687 188.241 -9.899 5.839 1.00 0.00 C ATOM 1403 OH TYR A 687 188.890 -10.371 4.721 1.00 0.00 O ATOM 0 H TYR A 687 186.667 -6.131 8.514 1.00 0.00 H new ATOM 0 HA TYR A 687 184.499 -7.787 8.217 1.00 0.00 H new ATOM 0 HB2 TYR A 687 186.956 -7.955 9.992 1.00 0.00 H new ATOM 0 HB3 TYR A 687 185.804 -9.272 9.884 1.00 0.00 H new ATOM 0 HD1 TYR A 687 186.126 -7.465 6.787 1.00 0.00 H new ATOM 0 HD2 TYR A 687 187.911 -10.548 9.122 1.00 0.00 H new ATOM 0 HE1 TYR A 687 187.280 -8.307 4.789 1.00 0.00 H new ATOM 0 HE2 TYR A 687 189.067 -11.391 7.127 1.00 0.00 H new ATOM 0 HH TYR A 687 189.432 -11.151 4.962 1.00 0.00 H new ATOM 1413 N ASN A 688 184.718 -6.605 11.293 1.00 0.00 N ATOM 1414 CA ASN A 688 183.972 -6.393 12.528 1.00 0.00 C ATOM 1415 C ASN A 688 182.732 -5.540 12.278 1.00 0.00 C ATOM 1416 O ASN A 688 181.650 -5.836 12.786 1.00 0.00 O ATOM 1417 CB ASN A 688 184.861 -5.724 13.578 1.00 0.00 C ATOM 1418 CG ASN A 688 185.710 -6.725 14.336 1.00 0.00 C ATOM 1419 OD1 ASN A 688 185.485 -6.976 15.521 1.00 0.00 O ATOM 1420 ND2 ASN A 688 186.694 -7.302 13.656 1.00 0.00 N ATOM 0 H ASN A 688 185.650 -6.191 11.289 1.00 0.00 H new ATOM 0 HA ASN A 688 183.652 -7.367 12.899 1.00 0.00 H new ATOM 0 HB2 ASN A 688 185.510 -4.996 13.091 1.00 0.00 H new ATOM 0 HB3 ASN A 688 184.237 -5.174 14.282 1.00 0.00 H new ATOM 0 HD21 ASN A 688 187.299 -7.983 14.114 1.00 0.00 H new ATOM 0 HD22 ASN A 688 186.844 -7.064 12.676 1.00 0.00 H new ATOM 1427 N ILE A 689 182.896 -4.481 11.492 1.00 0.00 N ATOM 1428 CA ILE A 689 181.790 -3.583 11.176 1.00 0.00 C ATOM 1429 C ILE A 689 180.641 -4.341 10.512 1.00 0.00 C ATOM 1430 O ILE A 689 179.546 -4.436 11.068 1.00 0.00 O ATOM 1431 CB ILE A 689 182.250 -2.430 10.253 1.00 0.00 C ATOM 1432 CG1 ILE A 689 183.110 -1.438 11.036 1.00 0.00 C ATOM 1433 CG2 ILE A 689 181.056 -1.715 9.632 1.00 0.00 C ATOM 1434 CD1 ILE A 689 184.561 -1.847 11.155 1.00 0.00 C ATOM 0 H ILE A 689 183.784 -4.223 11.062 1.00 0.00 H new ATOM 0 HA ILE A 689 181.439 -3.160 12.117 1.00 0.00 H new ATOM 0 HB ILE A 689 182.846 -2.858 9.447 1.00 0.00 H new ATOM 0 HG12 ILE A 689 183.056 -0.463 10.551 1.00 0.00 H new ATOM 0 HG13 ILE A 689 182.693 -1.320 12.036 1.00 0.00 H new ATOM 0 HG21 ILE A 689 181.409 -0.909 8.988 1.00 0.00 H new ATOM 0 HG22 ILE A 689 180.475 -2.423 9.042 1.00 0.00 H new ATOM 0 HG23 ILE A 689 180.429 -1.300 10.422 1.00 0.00 H new ATOM 0 HD11 ILE A 689 185.106 -1.093 11.723 1.00 0.00 H new ATOM 0 HD12 ILE A 689 184.628 -2.807 11.668 1.00 0.00 H new ATOM 0 HD13 ILE A 689 184.997 -1.936 10.160 1.00 0.00 H new ATOM 1446 N ILE A 690 180.894 -4.873 9.321 1.00 0.00 N ATOM 1447 CA ILE A 690 179.878 -5.613 8.583 1.00 0.00 C ATOM 1448 C ILE A 690 179.323 -6.769 9.409 1.00 0.00 C ATOM 1449 O ILE A 690 178.112 -6.870 9.605 1.00 0.00 O ATOM 1450 CB ILE A 690 180.431 -6.152 7.251 1.00 0.00 C ATOM 1451 CG1 ILE A 690 181.060 -5.005 6.450 1.00 0.00 C ATOM 1452 CG2 ILE A 690 179.325 -6.836 6.455 1.00 0.00 C ATOM 1453 CD1 ILE A 690 181.229 -5.300 4.975 1.00 0.00 C ATOM 0 H ILE A 690 181.794 -4.805 8.846 1.00 0.00 H new ATOM 0 HA ILE A 690 179.070 -4.913 8.370 1.00 0.00 H new ATOM 0 HB ILE A 690 181.202 -6.894 7.456 1.00 0.00 H new ATOM 0 HG12 ILE A 690 180.441 -4.115 6.563 1.00 0.00 H new ATOM 0 HG13 ILE A 690 182.035 -4.771 6.877 1.00 0.00 H new ATOM 0 HG21 ILE A 690 179.732 -7.212 5.516 1.00 0.00 H new ATOM 0 HG22 ILE A 690 178.921 -7.667 7.034 1.00 0.00 H new ATOM 0 HG23 ILE A 690 178.531 -6.119 6.246 1.00 0.00 H new ATOM 0 HD11 ILE A 690 181.680 -4.439 4.481 1.00 0.00 H new ATOM 0 HD12 ILE A 690 181.874 -6.170 4.849 1.00 0.00 H new ATOM 0 HD13 ILE A 690 180.255 -5.504 4.531 1.00 0.00 H new ATOM 1465 N LEU A 691 180.208 -7.639 9.893 1.00 0.00 N ATOM 1466 CA LEU A 691 179.788 -8.785 10.703 1.00 0.00 C ATOM 1467 C LEU A 691 178.781 -8.363 11.766 1.00 0.00 C ATOM 1468 O LEU A 691 177.719 -8.967 11.910 1.00 0.00 O ATOM 1469 CB LEU A 691 180.999 -9.440 11.369 1.00 0.00 C ATOM 1470 CG LEU A 691 181.749 -10.464 10.509 1.00 0.00 C ATOM 1471 CD1 LEU A 691 181.654 -10.113 9.029 1.00 0.00 C ATOM 1472 CD2 LEU A 691 183.204 -10.555 10.943 1.00 0.00 C ATOM 0 H LEU A 691 181.214 -7.575 9.741 1.00 0.00 H new ATOM 0 HA LEU A 691 179.310 -9.506 10.040 1.00 0.00 H new ATOM 0 HB2 LEU A 691 181.698 -8.657 11.664 1.00 0.00 H new ATOM 0 HB3 LEU A 691 180.667 -9.932 12.283 1.00 0.00 H new ATOM 0 HG LEU A 691 181.279 -11.437 10.654 1.00 0.00 H new ATOM 0 HD11 LEU A 691 182.195 -10.856 8.443 1.00 0.00 H new ATOM 0 HD12 LEU A 691 180.608 -10.102 8.724 1.00 0.00 H new ATOM 0 HD13 LEU A 691 182.091 -9.129 8.860 1.00 0.00 H new ATOM 0 HD21 LEU A 691 183.723 -11.286 10.323 1.00 0.00 H new ATOM 0 HD22 LEU A 691 183.679 -9.580 10.830 1.00 0.00 H new ATOM 0 HD23 LEU A 691 183.254 -10.864 11.987 1.00 0.00 H new ATOM 1484 N GLU A 692 179.125 -7.318 12.501 1.00 0.00 N ATOM 1485 CA GLU A 692 178.253 -6.802 13.549 1.00 0.00 C ATOM 1486 C GLU A 692 176.918 -6.346 12.964 1.00 0.00 C ATOM 1487 O GLU A 692 175.894 -6.361 13.647 1.00 0.00 O ATOM 1488 CB GLU A 692 178.930 -5.639 14.278 1.00 0.00 C ATOM 1489 CG GLU A 692 179.621 -6.050 15.568 1.00 0.00 C ATOM 1490 CD GLU A 692 178.645 -6.285 16.704 1.00 0.00 C ATOM 1491 OE1 GLU A 692 178.059 -7.387 16.764 1.00 0.00 O ATOM 1492 OE2 GLU A 692 178.465 -5.369 17.532 1.00 0.00 O ATOM 0 H GLU A 692 180.002 -6.809 12.393 1.00 0.00 H new ATOM 0 HA GLU A 692 178.063 -7.605 14.262 1.00 0.00 H new ATOM 0 HB2 GLU A 692 179.662 -5.181 13.613 1.00 0.00 H new ATOM 0 HB3 GLU A 692 178.183 -4.877 14.502 1.00 0.00 H new ATOM 0 HG2 GLU A 692 180.196 -6.960 15.394 1.00 0.00 H new ATOM 0 HG3 GLU A 692 180.331 -5.275 15.858 1.00 0.00 H new ATOM 1499 N SER A 693 176.938 -5.938 11.698 1.00 0.00 N ATOM 1500 CA SER A 693 175.731 -5.474 11.023 1.00 0.00 C ATOM 1501 C SER A 693 175.061 -6.597 10.229 1.00 0.00 C ATOM 1502 O SER A 693 173.941 -6.437 9.746 1.00 0.00 O ATOM 1503 CB SER A 693 176.065 -4.308 10.091 1.00 0.00 C ATOM 1504 OG SER A 693 174.910 -3.858 9.402 1.00 0.00 O ATOM 0 H SER A 693 177.778 -5.920 11.119 1.00 0.00 H new ATOM 0 HA SER A 693 175.031 -5.140 11.789 1.00 0.00 H new ATOM 0 HB2 SER A 693 176.491 -3.487 10.668 1.00 0.00 H new ATOM 0 HB3 SER A 693 176.823 -4.619 9.372 1.00 0.00 H new ATOM 0 HG SER A 693 174.450 -3.181 9.941 1.00 0.00 H new ATOM 1510 N LYS A 694 175.746 -7.731 10.093 1.00 0.00 N ATOM 1511 CA LYS A 694 175.198 -8.865 9.354 1.00 0.00 C ATOM 1512 C LYS A 694 173.857 -9.304 9.936 1.00 0.00 C ATOM 1513 O LYS A 694 173.018 -9.865 9.232 1.00 0.00 O ATOM 1514 CB LYS A 694 176.178 -10.041 9.367 1.00 0.00 C ATOM 1515 CG LYS A 694 177.155 -10.033 8.202 1.00 0.00 C ATOM 1516 CD LYS A 694 177.391 -11.435 7.661 1.00 0.00 C ATOM 1517 CE LYS A 694 178.317 -12.234 8.564 1.00 0.00 C ATOM 1518 NZ LYS A 694 177.849 -13.637 8.737 1.00 0.00 N ATOM 0 H LYS A 694 176.676 -7.888 10.482 1.00 0.00 H new ATOM 0 HA LYS A 694 175.041 -8.544 8.324 1.00 0.00 H new ATOM 0 HB2 LYS A 694 176.739 -10.025 10.301 1.00 0.00 H new ATOM 0 HB3 LYS A 694 175.614 -10.973 9.351 1.00 0.00 H new ATOM 0 HG2 LYS A 694 176.769 -9.395 7.407 1.00 0.00 H new ATOM 0 HG3 LYS A 694 178.103 -9.602 8.524 1.00 0.00 H new ATOM 0 HD2 LYS A 694 176.437 -11.954 7.566 1.00 0.00 H new ATOM 0 HD3 LYS A 694 177.821 -11.372 6.661 1.00 0.00 H new ATOM 0 HE2 LYS A 694 179.322 -12.236 8.143 1.00 0.00 H new ATOM 0 HE3 LYS A 694 178.381 -11.750 9.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 694 178.507 -14.148 9.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 694 176.900 -13.636 9.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 694 177.812 -14.108 7.810 1.00 0.00 H new ATOM 1532 N SER A 695 173.662 -9.048 11.227 1.00 0.00 N ATOM 1533 CA SER A 695 172.423 -9.422 11.900 1.00 0.00 C ATOM 1534 C SER A 695 171.504 -8.216 12.099 1.00 0.00 C ATOM 1535 O SER A 695 170.490 -8.312 12.791 1.00 0.00 O ATOM 1536 CB SER A 695 172.732 -10.067 13.253 1.00 0.00 C ATOM 1537 OG SER A 695 173.380 -11.316 13.088 1.00 0.00 O ATOM 0 H SER A 695 174.345 -8.584 11.826 1.00 0.00 H new ATOM 0 HA SER A 695 171.905 -10.140 11.264 1.00 0.00 H new ATOM 0 HB2 SER A 695 173.364 -9.401 13.841 1.00 0.00 H new ATOM 0 HB3 SER A 695 171.807 -10.205 13.813 1.00 0.00 H new ATOM 0 HG SER A 695 173.568 -11.706 13.967 1.00 0.00 H new ATOM 1543 N GLU A 696 171.857 -7.085 11.494 1.00 0.00 N ATOM 1544 CA GLU A 696 171.053 -5.876 11.617 1.00 0.00 C ATOM 1545 C GLU A 696 169.866 -5.913 10.657 1.00 0.00 C ATOM 1546 O GLU A 696 170.027 -6.211 9.473 1.00 0.00 O ATOM 1547 CB GLU A 696 171.908 -4.637 11.339 1.00 0.00 C ATOM 1548 CG GLU A 696 172.742 -4.194 12.529 1.00 0.00 C ATOM 1549 CD GLU A 696 172.021 -3.189 13.405 1.00 0.00 C ATOM 1550 OE1 GLU A 696 170.883 -3.480 13.829 1.00 0.00 O ATOM 1551 OE2 GLU A 696 172.594 -2.111 13.668 1.00 0.00 O ATOM 0 H GLU A 696 172.691 -6.982 10.916 1.00 0.00 H new ATOM 0 HA GLU A 696 170.673 -5.825 12.637 1.00 0.00 H new ATOM 0 HB2 GLU A 696 172.571 -4.844 10.499 1.00 0.00 H new ATOM 0 HB3 GLU A 696 171.257 -3.817 11.037 1.00 0.00 H new ATOM 0 HG2 GLU A 696 173.008 -5.066 13.126 1.00 0.00 H new ATOM 0 HG3 GLU A 696 173.674 -3.756 12.172 1.00 0.00 H new ATOM 1558 N PRO A 697 168.651 -5.610 11.151 1.00 0.00 N ATOM 1559 CA PRO A 697 167.441 -5.613 10.321 1.00 0.00 C ATOM 1560 C PRO A 697 167.565 -4.701 9.103 1.00 0.00 C ATOM 1561 O PRO A 697 166.816 -4.838 8.137 1.00 0.00 O ATOM 1562 CB PRO A 697 166.352 -5.093 11.264 1.00 0.00 C ATOM 1563 CG PRO A 697 166.865 -5.373 12.634 1.00 0.00 C ATOM 1564 CD PRO A 697 168.359 -5.242 12.549 1.00 0.00 C ATOM 0 HA PRO A 697 167.235 -6.604 9.916 1.00 0.00 H new ATOM 0 HB2 PRO A 697 166.179 -4.027 11.117 1.00 0.00 H new ATOM 0 HB3 PRO A 697 165.402 -5.598 11.087 1.00 0.00 H new ATOM 0 HG2 PRO A 697 166.452 -4.670 13.357 1.00 0.00 H new ATOM 0 HG3 PRO A 697 166.579 -6.372 12.962 1.00 0.00 H new ATOM 0 HD2 PRO A 697 168.688 -4.228 12.775 1.00 0.00 H new ATOM 0 HD3 PRO A 697 168.862 -5.905 13.253 1.00 0.00 H new ATOM 1572 N GLN A 698 168.511 -3.766 9.156 1.00 0.00 N ATOM 1573 CA GLN A 698 168.721 -2.833 8.056 1.00 0.00 C ATOM 1574 C GLN A 698 170.176 -2.379 7.988 1.00 0.00 C ATOM 1575 O GLN A 698 170.901 -2.431 8.981 1.00 0.00 O ATOM 1576 CB GLN A 698 167.802 -1.619 8.210 1.00 0.00 C ATOM 1577 CG GLN A 698 167.756 -0.730 6.978 1.00 0.00 C ATOM 1578 CD GLN A 698 166.974 0.548 7.212 1.00 0.00 C ATOM 1579 OE1 GLN A 698 167.271 1.313 8.130 1.00 0.00 O ATOM 1580 NE2 GLN A 698 165.966 0.786 6.380 1.00 0.00 N ATOM 0 H GLN A 698 169.142 -3.636 9.947 1.00 0.00 H new ATOM 0 HA GLN A 698 168.481 -3.350 7.127 1.00 0.00 H new ATOM 0 HB2 GLN A 698 166.793 -1.964 8.437 1.00 0.00 H new ATOM 0 HB3 GLN A 698 168.135 -1.027 9.062 1.00 0.00 H new ATOM 0 HG2 GLN A 698 168.773 -0.480 6.677 1.00 0.00 H new ATOM 0 HG3 GLN A 698 167.306 -1.282 6.153 1.00 0.00 H new ATOM 0 HE21 GLN A 698 165.755 0.125 5.633 1.00 0.00 H new ATOM 0 HE22 GLN A 698 165.403 1.630 6.489 1.00 0.00 H new ATOM 1589 N VAL A 699 170.593 -1.936 6.807 1.00 0.00 N ATOM 1590 CA VAL A 699 171.959 -1.473 6.596 1.00 0.00 C ATOM 1591 C VAL A 699 171.977 -0.163 5.813 1.00 0.00 C ATOM 1592 O VAL A 699 171.182 0.037 4.895 1.00 0.00 O ATOM 1593 CB VAL A 699 172.796 -2.533 5.842 1.00 0.00 C ATOM 1594 CG1 VAL A 699 174.131 -1.961 5.374 1.00 0.00 C ATOM 1595 CG2 VAL A 699 173.017 -3.756 6.721 1.00 0.00 C ATOM 0 H VAL A 699 170.001 -1.888 5.978 1.00 0.00 H new ATOM 0 HA VAL A 699 172.400 -1.307 7.579 1.00 0.00 H new ATOM 0 HB VAL A 699 172.236 -2.833 4.956 1.00 0.00 H new ATOM 0 HG11 VAL A 699 174.693 -2.733 4.848 1.00 0.00 H new ATOM 0 HG12 VAL A 699 173.952 -1.121 4.702 1.00 0.00 H new ATOM 0 HG13 VAL A 699 174.703 -1.620 6.237 1.00 0.00 H new ATOM 0 HG21 VAL A 699 173.607 -4.493 6.177 1.00 0.00 H new ATOM 0 HG22 VAL A 699 173.548 -3.462 7.626 1.00 0.00 H new ATOM 0 HG23 VAL A 699 172.054 -4.190 6.990 1.00 0.00 H new ATOM 1605 N GLU A 700 172.901 0.719 6.175 1.00 0.00 N ATOM 1606 CA GLU A 700 173.043 2.004 5.504 1.00 0.00 C ATOM 1607 C GLU A 700 174.471 2.177 5.005 1.00 0.00 C ATOM 1608 O GLU A 700 175.396 2.353 5.798 1.00 0.00 O ATOM 1609 CB GLU A 700 172.675 3.147 6.452 1.00 0.00 C ATOM 1610 CG GLU A 700 172.798 4.525 5.820 1.00 0.00 C ATOM 1611 CD GLU A 700 172.036 5.588 6.587 1.00 0.00 C ATOM 1612 OE1 GLU A 700 170.809 5.429 6.760 1.00 0.00 O ATOM 1613 OE2 GLU A 700 172.665 6.578 7.014 1.00 0.00 O ATOM 0 H GLU A 700 173.566 0.566 6.933 1.00 0.00 H new ATOM 0 HA GLU A 700 172.364 2.028 4.652 1.00 0.00 H new ATOM 0 HB2 GLU A 700 171.651 3.005 6.798 1.00 0.00 H new ATOM 0 HB3 GLU A 700 173.318 3.101 7.331 1.00 0.00 H new ATOM 0 HG2 GLU A 700 173.850 4.804 5.768 1.00 0.00 H new ATOM 0 HG3 GLU A 700 172.427 4.485 4.796 1.00 0.00 H new ATOM 1620 N ILE A 701 174.653 2.111 3.690 1.00 0.00 N ATOM 1621 CA ILE A 701 175.980 2.246 3.102 1.00 0.00 C ATOM 1622 C ILE A 701 176.069 3.451 2.177 1.00 0.00 C ATOM 1623 O ILE A 701 175.163 3.714 1.386 1.00 0.00 O ATOM 1624 CB ILE A 701 176.389 0.981 2.319 1.00 0.00 C ATOM 1625 CG1 ILE A 701 175.162 0.323 1.675 1.00 0.00 C ATOM 1626 CG2 ILE A 701 177.106 0.007 3.241 1.00 0.00 C ATOM 1627 CD1 ILE A 701 175.464 -0.998 0.999 1.00 0.00 C ATOM 0 H ILE A 701 173.902 1.966 3.015 1.00 0.00 H new ATOM 0 HA ILE A 701 176.667 2.387 3.936 1.00 0.00 H new ATOM 0 HB ILE A 701 177.072 1.268 1.520 1.00 0.00 H new ATOM 0 HG12 ILE A 701 174.402 0.164 2.440 1.00 0.00 H new ATOM 0 HG13 ILE A 701 174.737 1.008 0.941 1.00 0.00 H new ATOM 0 HG21 ILE A 701 177.391 -0.883 2.680 1.00 0.00 H new ATOM 0 HG22 ILE A 701 177.999 0.481 3.647 1.00 0.00 H new ATOM 0 HG23 ILE A 701 176.442 -0.276 4.058 1.00 0.00 H new ATOM 0 HD11 ILE A 701 174.549 -1.403 0.567 1.00 0.00 H new ATOM 0 HD12 ILE A 701 176.200 -0.843 0.210 1.00 0.00 H new ATOM 0 HD13 ILE A 701 175.861 -1.700 1.733 1.00 0.00 H new ATOM 1639 N ILE A 702 177.176 4.176 2.283 1.00 0.00 N ATOM 1640 CA ILE A 702 177.405 5.356 1.461 1.00 0.00 C ATOM 1641 C ILE A 702 178.615 5.153 0.557 1.00 0.00 C ATOM 1642 O ILE A 702 179.585 4.507 0.947 1.00 0.00 O ATOM 1643 CB ILE A 702 177.626 6.611 2.329 1.00 0.00 C ATOM 1644 CG1 ILE A 702 176.644 6.634 3.504 1.00 0.00 C ATOM 1645 CG2 ILE A 702 177.485 7.872 1.489 1.00 0.00 C ATOM 1646 CD1 ILE A 702 175.194 6.488 3.092 1.00 0.00 C ATOM 0 H ILE A 702 177.932 3.965 2.934 1.00 0.00 H new ATOM 0 HA ILE A 702 176.514 5.504 0.851 1.00 0.00 H new ATOM 0 HB ILE A 702 178.639 6.577 2.730 1.00 0.00 H new ATOM 0 HG12 ILE A 702 176.899 5.830 4.194 1.00 0.00 H new ATOM 0 HG13 ILE A 702 176.765 7.571 4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 702 177.644 8.748 2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 702 178.225 7.861 0.689 1.00 0.00 H new ATOM 0 HG23 ILE A 702 176.485 7.912 1.058 1.00 0.00 H new ATOM 0 HD11 ILE A 702 174.560 6.513 3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 702 174.921 7.307 2.426 1.00 0.00 H new ATOM 0 HD13 ILE A 702 175.057 5.539 2.575 1.00 0.00 H new ATOM 1658 N VAL A 703 178.553 5.702 -0.652 1.00 0.00 N ATOM 1659 CA VAL A 703 179.650 5.565 -1.603 1.00 0.00 C ATOM 1660 C VAL A 703 180.052 6.908 -2.197 1.00 0.00 C ATOM 1661 O VAL A 703 179.464 7.943 -1.883 1.00 0.00 O ATOM 1662 CB VAL A 703 179.282 4.604 -2.748 1.00 0.00 C ATOM 1663 CG1 VAL A 703 179.284 3.166 -2.259 1.00 0.00 C ATOM 1664 CG2 VAL A 703 177.932 4.974 -3.342 1.00 0.00 C ATOM 0 H VAL A 703 177.759 6.243 -0.995 1.00 0.00 H new ATOM 0 HA VAL A 703 180.493 5.157 -1.045 1.00 0.00 H new ATOM 0 HB VAL A 703 180.034 4.696 -3.532 1.00 0.00 H new ATOM 0 HG11 VAL A 703 179.022 2.501 -3.082 1.00 0.00 H new ATOM 0 HG12 VAL A 703 180.276 2.909 -1.888 1.00 0.00 H new ATOM 0 HG13 VAL A 703 178.556 3.054 -1.456 1.00 0.00 H new ATOM 0 HG21 VAL A 703 177.688 4.284 -4.150 1.00 0.00 H new ATOM 0 HG22 VAL A 703 177.166 4.913 -2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 703 177.973 5.991 -3.733 1.00 0.00 H new ATOM 1674 N SER A 704 181.062 6.879 -3.062 1.00 0.00 N ATOM 1675 CA SER A 704 181.553 8.091 -3.709 1.00 0.00 C ATOM 1676 C SER A 704 182.047 7.790 -5.120 1.00 0.00 C ATOM 1677 O SER A 704 183.076 7.141 -5.302 1.00 0.00 O ATOM 1678 CB SER A 704 182.680 8.715 -2.883 1.00 0.00 C ATOM 1679 OG SER A 704 183.402 9.667 -3.644 1.00 0.00 O ATOM 0 H SER A 704 181.556 6.028 -3.331 1.00 0.00 H new ATOM 0 HA SER A 704 180.727 8.799 -3.775 1.00 0.00 H new ATOM 0 HB2 SER A 704 182.264 9.193 -1.997 1.00 0.00 H new ATOM 0 HB3 SER A 704 183.356 7.934 -2.536 1.00 0.00 H new ATOM 0 HG SER A 704 184.115 10.053 -3.094 1.00 0.00 H new ATOM 1741 N GLY B 945 186.047 -9.799 0.341 1.00 0.00 N ATOM 1742 CA GLY B 945 186.376 -9.581 1.737 1.00 0.00 C ATOM 1743 C GLY B 945 185.210 -9.853 2.670 1.00 0.00 C ATOM 1744 O GLY B 945 185.390 -10.433 3.741 1.00 0.00 O ATOM 0 HA2 GLY B 945 187.212 -10.224 2.012 1.00 0.00 H new ATOM 0 HA3 GLY B 945 186.708 -8.551 1.870 1.00 0.00 H new ATOM 1748 N ILE B 946 184.014 -9.425 2.274 1.00 0.00 N ATOM 1749 CA ILE B 946 182.825 -9.621 3.095 1.00 0.00 C ATOM 1750 C ILE B 946 181.607 -9.950 2.242 1.00 0.00 C ATOM 1751 O ILE B 946 181.443 -9.419 1.143 1.00 0.00 O ATOM 1752 CB ILE B 946 182.488 -8.375 3.954 1.00 0.00 C ATOM 1753 CG1 ILE B 946 183.613 -7.329 3.896 1.00 0.00 C ATOM 1754 CG2 ILE B 946 182.207 -8.786 5.394 1.00 0.00 C ATOM 1755 CD1 ILE B 946 184.681 -7.521 4.948 1.00 0.00 C ATOM 0 H ILE B 946 183.844 -8.942 1.392 1.00 0.00 H new ATOM 0 HA ILE B 946 183.059 -10.457 3.754 1.00 0.00 H new ATOM 0 HB ILE B 946 181.591 -7.914 3.540 1.00 0.00 H new ATOM 0 HG12 ILE B 946 184.077 -7.363 2.910 1.00 0.00 H new ATOM 0 HG13 ILE B 946 183.179 -6.336 4.010 1.00 0.00 H new ATOM 0 HG21 ILE B 946 181.972 -7.901 5.986 1.00 0.00 H new ATOM 0 HG22 ILE B 946 181.362 -9.474 5.418 1.00 0.00 H new ATOM 0 HG23 ILE B 946 183.086 -9.278 5.810 1.00 0.00 H new ATOM 0 HD11 ILE B 946 185.439 -6.745 4.843 1.00 0.00 H new ATOM 0 HD12 ILE B 946 184.231 -7.457 5.939 1.00 0.00 H new ATOM 0 HD13 ILE B 946 185.144 -8.500 4.822 1.00 0.00 H new ATOM 1767 N TRP B 947 180.743 -10.806 2.770 1.00 0.00 N ATOM 1768 CA TRP B 947 179.521 -11.180 2.073 1.00 0.00 C ATOM 1769 C TRP B 947 178.371 -10.318 2.569 1.00 0.00 C ATOM 1770 O TRP B 947 178.027 -10.347 3.751 1.00 0.00 O ATOM 1771 CB TRP B 947 179.209 -12.664 2.277 1.00 0.00 C ATOM 1772 CG TRP B 947 179.379 -13.476 1.028 1.00 0.00 C ATOM 1773 CD1 TRP B 947 179.989 -14.693 0.917 1.00 0.00 C ATOM 1774 CD2 TRP B 947 178.935 -13.129 -0.290 1.00 0.00 C ATOM 1775 NE1 TRP B 947 179.952 -15.123 -0.388 1.00 0.00 N ATOM 1776 CE2 TRP B 947 179.311 -14.180 -1.149 1.00 0.00 C ATOM 1777 CE3 TRP B 947 178.256 -12.031 -0.829 1.00 0.00 C ATOM 1778 CZ2 TRP B 947 179.031 -14.165 -2.513 1.00 0.00 C ATOM 1779 CZ3 TRP B 947 177.979 -12.017 -2.184 1.00 0.00 C ATOM 1780 CH2 TRP B 947 178.365 -13.078 -3.012 1.00 0.00 C ATOM 0 H TRP B 947 180.866 -11.254 3.678 1.00 0.00 H new ATOM 0 HA TRP B 947 179.659 -11.014 1.005 1.00 0.00 H new ATOM 0 HB2 TRP B 947 179.861 -13.063 3.054 1.00 0.00 H new ATOM 0 HB3 TRP B 947 178.185 -12.768 2.635 1.00 0.00 H new ATOM 0 HD1 TRP B 947 180.435 -15.238 1.735 1.00 0.00 H new ATOM 0 HE1 TRP B 947 180.339 -16.001 -0.734 1.00 0.00 H new ATOM 0 HE3 TRP B 947 177.953 -11.208 -0.198 1.00 0.00 H new ATOM 0 HZ2 TRP B 947 179.329 -14.982 -3.154 1.00 0.00 H new ATOM 0 HZ3 TRP B 947 177.456 -11.174 -2.610 1.00 0.00 H new ATOM 0 HH2 TRP B 947 178.133 -13.038 -4.066 1.00 0.00 H new ATOM 1791 N ALA B 948 177.790 -9.537 1.666 1.00 0.00 N ATOM 1792 CA ALA B 948 176.689 -8.654 2.021 1.00 0.00 C ATOM 1793 C ALA B 948 175.759 -8.425 0.836 1.00 0.00 C ATOM 1794 O ALA B 948 175.247 -9.418 0.284 1.00 0.00 O ATOM 1795 CB ALA B 948 177.236 -7.330 2.529 1.00 0.00 C ATOM 1796 OXT ALA B 948 175.553 -7.250 0.463 1.00 0.00 O ATOM 0 H ALA B 948 178.064 -9.498 0.684 1.00 0.00 H new ATOM 0 HA ALA B 948 176.108 -9.130 2.811 1.00 0.00 H new ATOM 0 HB1 ALA B 948 176.408 -6.672 2.794 1.00 0.00 H new ATOM 0 HB2 ALA B 948 177.855 -7.506 3.409 1.00 0.00 H new ATOM 0 HB3 ALA B 948 177.837 -6.862 1.750 1.00 0.00 H new