USER MOD reduce.3.24.130724 H: found=0, std=0, add=404, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 404 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 Single : A 65 TYR OH : rot 173:sc= 0.24 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0123 USER MOD Single : A 77 SER OG : rot -10:sc= 0.272 USER MOD Single : A 78 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0872) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.25) USER MOD Single : A 83 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot -75:sc= 1.12 USER MOD Single : A 91 ASN : amide:sc= -2.9! C(o=-2.9!,f=-7.3!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HE2:sc= -2.85 K(o=-2.9,f=-5.3!) USER MOD Single : A 95 TYR OH : rot 129:sc= 0.221 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 136:sc= -0.166 (180deg=-1) USER MOD Single : A 102 MET CE :methyl 137:sc= -0.151 (180deg=-0.975) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= -0.271 K(o=-0.27,f=-2.8!) USER MOD Single : A 109 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 385 N LEU A 63 16.690 27.386 20.921 1.00 15.00 N ATOM 386 CA LEU A 63 16.166 26.518 21.973 1.00 15.00 C ATOM 387 C LEU A 63 14.648 26.425 21.876 1.00 15.00 C ATOM 388 O LEU A 63 13.956 27.443 21.879 1.00 15.00 O ATOM 389 CB LEU A 63 16.557 27.067 23.348 1.00 15.00 C ATOM 390 CG LEU A 63 18.080 27.196 23.448 1.00 15.00 C ATOM 391 CD1 LEU A 63 18.449 27.840 24.786 1.00 15.00 C ATOM 392 CD2 LEU A 63 18.723 25.810 23.364 1.00 15.00 C ATOM 0 HA LEU A 63 16.592 25.523 21.845 1.00 15.00 H new ATOM 0 HB2 LEU A 63 16.090 28.039 23.506 1.00 15.00 H new ATOM 0 HB3 LEU A 63 16.188 26.405 24.131 1.00 15.00 H new ATOM 0 HG LEU A 63 18.442 27.815 22.627 1.00 15.00 H new ATOM 0 HD11 LEU A 63 19.533 27.932 24.859 1.00 15.00 H new ATOM 0 HD12 LEU A 63 17.995 28.829 24.851 1.00 15.00 H new ATOM 0 HD13 LEU A 63 18.082 27.218 25.603 1.00 15.00 H new ATOM 0 HD21 LEU A 63 19.806 25.907 23.436 1.00 15.00 H new ATOM 0 HD22 LEU A 63 18.359 25.190 24.183 1.00 15.00 H new ATOM 0 HD23 LEU A 63 18.462 25.345 22.413 1.00 15.00 H new ATOM 404 N PHE A 64 14.138 25.204 21.759 1.00 15.00 N ATOM 405 CA PHE A 64 12.696 24.992 21.695 1.00 15.00 C ATOM 406 C PHE A 64 12.135 24.638 23.070 1.00 15.00 C ATOM 407 O PHE A 64 12.650 23.747 23.746 1.00 15.00 O ATOM 408 CB PHE A 64 12.380 23.868 20.707 1.00 15.00 C ATOM 409 CG PHE A 64 12.781 24.187 19.286 1.00 15.00 C ATOM 410 CD1 PHE A 64 11.910 24.905 18.458 1.00 15.00 C ATOM 411 CD2 PHE A 64 14.023 23.765 18.799 1.00 15.00 C ATOM 412 CE1 PHE A 64 12.282 25.202 17.141 1.00 15.00 C ATOM 413 CE2 PHE A 64 14.395 24.062 17.482 1.00 15.00 C ATOM 414 CZ PHE A 64 13.525 24.780 16.653 1.00 15.00 C ATOM 0 H PHE A 64 14.696 24.352 21.707 1.00 15.00 H new ATOM 0 HA PHE A 64 12.229 25.918 21.359 1.00 15.00 H new ATOM 0 HB2 PHE A 64 12.892 22.960 21.026 1.00 15.00 H new ATOM 0 HB3 PHE A 64 11.311 23.659 20.736 1.00 15.00 H new ATOM 0 HD1 PHE A 64 10.951 25.230 18.835 1.00 15.00 H new ATOM 0 HD2 PHE A 64 14.694 23.211 19.438 1.00 15.00 H new ATOM 0 HE1 PHE A 64 11.611 25.756 16.502 1.00 15.00 H new ATOM 0 HE2 PHE A 64 15.354 23.737 17.106 1.00 15.00 H new ATOM 0 HZ PHE A 64 13.812 25.008 15.637 1.00 15.00 H new ATOM 424 N TYR A 65 11.080 25.337 23.480 1.00 15.00 N ATOM 425 CA TYR A 65 10.391 25.014 24.728 1.00 15.00 C ATOM 426 C TYR A 65 8.915 24.757 24.440 1.00 15.00 C ATOM 427 O TYR A 65 8.327 25.410 23.581 1.00 15.00 O ATOM 428 CB TYR A 65 10.529 26.167 25.723 1.00 15.00 C ATOM 429 CG TYR A 65 10.125 25.795 27.131 1.00 15.00 C ATOM 430 CD1 TYR A 65 11.067 25.229 27.997 1.00 15.00 C ATOM 431 CD2 TYR A 65 8.813 26.014 27.570 1.00 15.00 C ATOM 432 CE1 TYR A 65 10.700 24.883 29.302 1.00 15.00 C ATOM 433 CE2 TYR A 65 8.445 25.667 28.876 1.00 15.00 C ATOM 434 CZ TYR A 65 9.389 25.100 29.742 1.00 15.00 C ATOM 435 OH TYR A 65 9.030 24.755 31.030 1.00 15.00 O ATOM 0 H TYR A 65 10.684 26.127 22.970 1.00 15.00 H new ATOM 0 HA TYR A 65 10.840 24.121 25.162 1.00 15.00 H new ATOM 0 HB2 TYR A 65 11.563 26.511 25.728 1.00 15.00 H new ATOM 0 HB3 TYR A 65 9.917 27.003 25.386 1.00 15.00 H new ATOM 0 HD1 TYR A 65 12.078 25.059 27.658 1.00 15.00 H new ATOM 0 HD2 TYR A 65 8.085 26.450 26.902 1.00 15.00 H new ATOM 0 HE1 TYR A 65 11.429 24.448 29.970 1.00 15.00 H new ATOM 0 HE2 TYR A 65 7.434 25.836 29.215 1.00 15.00 H new ATOM 0 HH TYR A 65 8.122 25.075 31.213 1.00 15.00 H new ATOM 445 N THR A 66 8.316 23.808 25.154 1.00 15.00 N ATOM 446 CA THR A 66 6.926 23.432 24.900 1.00 15.00 C ATOM 447 C THR A 66 6.024 23.843 26.060 1.00 15.00 C ATOM 448 O THR A 66 6.412 23.763 27.225 1.00 15.00 O ATOM 449 CB THR A 66 6.829 21.917 24.695 1.00 15.00 C ATOM 450 OG1 THR A 66 7.747 21.521 23.686 1.00 15.00 O ATOM 451 CG2 THR A 66 5.408 21.545 24.266 1.00 15.00 C ATOM 0 H THR A 66 8.766 23.288 25.908 1.00 15.00 H new ATOM 0 HA THR A 66 6.593 23.951 24.001 1.00 15.00 H new ATOM 0 HB THR A 66 7.068 21.408 25.629 1.00 15.00 H new ATOM 0 HG1 THR A 66 7.689 20.552 23.553 1.00 15.00 H new ATOM 0 HG21 THR A 66 5.342 20.467 24.121 1.00 15.00 H new ATOM 0 HG22 THR A 66 4.703 21.851 25.039 1.00 15.00 H new ATOM 0 HG23 THR A 66 5.165 22.052 23.332 1.00 15.00 H new ATOM 459 N LEU A 67 4.816 24.285 25.723 1.00 15.00 N ATOM 460 CA LEU A 67 3.837 24.677 26.729 1.00 15.00 C ATOM 461 C LEU A 67 3.039 23.469 27.205 1.00 15.00 C ATOM 462 O LEU A 67 2.464 22.738 26.398 1.00 15.00 O ATOM 463 CB LEU A 67 2.878 25.712 26.131 1.00 15.00 C ATOM 464 CG LEU A 67 3.636 27.007 25.829 1.00 15.00 C ATOM 465 CD1 LEU A 67 2.734 27.950 25.031 1.00 15.00 C ATOM 466 CD2 LEU A 67 4.037 27.681 27.144 1.00 15.00 C ATOM 0 H LEU A 67 4.492 24.380 24.760 1.00 15.00 H new ATOM 0 HA LEU A 67 4.366 25.105 27.580 1.00 15.00 H new ATOM 0 HB2 LEU A 67 2.430 25.321 25.218 1.00 15.00 H new ATOM 0 HB3 LEU A 67 2.063 25.911 26.827 1.00 15.00 H new ATOM 0 HG LEU A 67 4.530 26.778 25.249 1.00 15.00 H new ATOM 0 HD11 LEU A 67 3.273 28.873 24.815 1.00 15.00 H new ATOM 0 HD12 LEU A 67 2.445 27.472 24.095 1.00 15.00 H new ATOM 0 HD13 LEU A 67 1.841 28.179 25.613 1.00 15.00 H new ATOM 0 HD21 LEU A 67 4.577 28.603 26.930 1.00 15.00 H new ATOM 0 HD22 LEU A 67 3.142 27.910 27.723 1.00 15.00 H new ATOM 0 HD23 LEU A 67 4.678 27.010 27.716 1.00 15.00 H new ATOM 478 N LYS A 68 2.978 23.289 28.522 1.00 15.00 N ATOM 479 CA LYS A 68 2.260 22.162 29.110 1.00 15.00 C ATOM 480 C LYS A 68 1.275 22.650 30.168 1.00 15.00 C ATOM 481 O LYS A 68 1.550 23.601 30.901 1.00 15.00 O ATOM 482 CB LYS A 68 3.252 21.187 29.747 1.00 15.00 C ATOM 483 CG LYS A 68 2.508 19.935 30.213 1.00 15.00 C ATOM 484 CD LYS A 68 3.483 18.994 30.924 1.00 15.00 C ATOM 485 CE LYS A 68 2.777 17.678 31.252 1.00 15.00 C ATOM 486 NZ LYS A 68 2.774 16.802 30.046 1.00 15.00 N ATOM 0 H LYS A 68 3.417 23.909 29.202 1.00 15.00 H new ATOM 0 HA LYS A 68 1.707 21.654 28.320 1.00 15.00 H new ATOM 0 HB2 LYS A 68 4.026 20.917 29.028 1.00 15.00 H new ATOM 0 HB3 LYS A 68 3.753 21.661 30.591 1.00 15.00 H new ATOM 0 HG2 LYS A 68 1.697 20.211 30.887 1.00 15.00 H new ATOM 0 HG3 LYS A 68 2.056 19.430 29.360 1.00 15.00 H new ATOM 0 HD2 LYS A 68 4.350 18.806 30.291 1.00 15.00 H new ATOM 0 HD3 LYS A 68 3.851 19.459 31.839 1.00 15.00 H new ATOM 0 HE2 LYS A 68 3.283 17.177 32.077 1.00 15.00 H new ATOM 0 HE3 LYS A 68 1.755 17.872 31.576 1.00 15.00 H new ATOM 0 HZ1 LYS A 68 2.294 15.907 30.268 1.00 15.00 H new ATOM 0 HZ2 LYS A 68 2.272 17.280 29.271 1.00 15.00 H new ATOM 0 HZ3 LYS A 68 3.754 16.607 29.756 1.00 15.00 H new ATOM 500 N THR A 69 0.129 21.980 30.263 1.00 15.00 N ATOM 501 CA THR A 69 -0.910 22.379 31.211 1.00 15.00 C ATOM 502 C THR A 69 -0.352 22.528 32.625 1.00 15.00 C ATOM 503 O THR A 69 0.416 21.687 33.092 1.00 15.00 O ATOM 504 CB THR A 69 -2.036 21.342 31.214 1.00 15.00 C ATOM 505 OG1 THR A 69 -3.024 21.723 32.162 1.00 15.00 O ATOM 506 CG2 THR A 69 -1.473 19.969 31.583 1.00 15.00 C ATOM 0 H THR A 69 -0.104 21.163 29.699 1.00 15.00 H new ATOM 0 HA THR A 69 -1.297 23.348 30.894 1.00 15.00 H new ATOM 0 HB THR A 69 -2.483 21.290 30.221 1.00 15.00 H new ATOM 0 HG1 THR A 69 -3.747 21.062 32.165 1.00 15.00 H new ATOM 0 HG21 THR A 69 -2.278 19.234 31.584 1.00 15.00 H new ATOM 0 HG22 THR A 69 -0.717 19.678 30.854 1.00 15.00 H new ATOM 0 HG23 THR A 69 -1.023 20.015 32.574 1.00 15.00 H new ATOM 514 N GLY A 70 -0.746 23.605 33.297 1.00 15.00 N ATOM 515 CA GLY A 70 -0.266 23.881 34.649 1.00 15.00 C ATOM 516 C GLY A 70 0.692 25.074 34.686 1.00 15.00 C ATOM 517 O GLY A 70 0.781 25.768 35.699 1.00 15.00 O ATOM 0 H GLY A 70 -1.395 24.301 32.929 1.00 15.00 H new ATOM 0 HA2 GLY A 70 -1.116 24.079 35.302 1.00 15.00 H new ATOM 0 HA3 GLY A 70 0.239 22.998 35.041 1.00 15.00 H new ATOM 521 N GLU A 71 1.407 25.317 33.588 1.00 15.00 N ATOM 522 CA GLU A 71 2.340 26.438 33.520 1.00 15.00 C ATOM 523 C GLU A 71 1.784 27.535 32.616 1.00 15.00 C ATOM 524 O GLU A 71 1.112 27.250 31.624 1.00 15.00 O ATOM 525 CB GLU A 71 3.687 25.961 32.977 1.00 15.00 C ATOM 526 CG GLU A 71 4.723 27.083 33.121 1.00 15.00 C ATOM 527 CD GLU A 71 6.073 26.698 32.506 1.00 15.00 C ATOM 528 OE1 GLU A 71 6.188 25.623 31.934 1.00 15.00 O ATOM 529 OE2 GLU A 71 6.988 27.498 32.620 1.00 15.00 O ATOM 0 H GLU A 71 1.358 24.755 32.738 1.00 15.00 H new ATOM 0 HA GLU A 71 2.476 26.840 34.524 1.00 15.00 H new ATOM 0 HB2 GLU A 71 4.017 25.075 33.520 1.00 15.00 H new ATOM 0 HB3 GLU A 71 3.588 25.675 31.930 1.00 15.00 H new ATOM 0 HG2 GLU A 71 4.349 27.986 32.639 1.00 15.00 H new ATOM 0 HG3 GLU A 71 4.859 27.318 34.177 1.00 15.00 H new ATOM 536 N THR A 72 2.067 28.788 32.962 1.00 15.00 N ATOM 537 CA THR A 72 1.576 29.924 32.181 1.00 15.00 C ATOM 538 C THR A 72 2.737 30.668 31.530 1.00 15.00 C ATOM 539 O THR A 72 3.894 30.506 31.917 1.00 15.00 O ATOM 540 CB THR A 72 0.796 30.887 33.080 1.00 15.00 C ATOM 541 OG1 THR A 72 1.672 31.442 34.052 1.00 15.00 O ATOM 542 CG2 THR A 72 -0.348 30.144 33.776 1.00 15.00 C ATOM 0 H THR A 72 2.630 29.044 33.773 1.00 15.00 H new ATOM 0 HA THR A 72 0.917 29.542 31.402 1.00 15.00 H new ATOM 0 HB THR A 72 0.377 31.688 32.470 1.00 15.00 H new ATOM 0 HG1 THR A 72 1.174 32.060 34.627 1.00 15.00 H new ATOM 0 HG21 THR A 72 -0.897 30.837 34.413 1.00 15.00 H new ATOM 0 HG22 THR A 72 -1.022 29.729 33.026 1.00 15.00 H new ATOM 0 HG23 THR A 72 0.059 29.337 34.384 1.00 15.00 H new ATOM 550 N VAL A 73 2.420 31.510 30.550 1.00 15.00 N ATOM 551 CA VAL A 73 3.451 32.246 29.821 1.00 15.00 C ATOM 552 C VAL A 73 4.311 33.055 30.789 1.00 15.00 C ATOM 553 O VAL A 73 5.538 33.077 30.677 1.00 15.00 O ATOM 554 CB VAL A 73 2.796 33.177 28.790 1.00 15.00 C ATOM 555 CG1 VAL A 73 3.871 33.909 27.980 1.00 15.00 C ATOM 556 CG2 VAL A 73 1.926 32.355 27.835 1.00 15.00 C ATOM 0 H VAL A 73 1.466 31.699 30.244 1.00 15.00 H new ATOM 0 HA VAL A 73 4.092 31.534 29.301 1.00 15.00 H new ATOM 0 HB VAL A 73 2.182 33.907 29.318 1.00 15.00 H new ATOM 0 HG11 VAL A 73 3.394 34.566 27.253 1.00 15.00 H new ATOM 0 HG12 VAL A 73 4.492 34.502 28.652 1.00 15.00 H new ATOM 0 HG13 VAL A 73 4.493 33.181 27.459 1.00 15.00 H new ATOM 0 HG21 VAL A 73 1.462 33.017 27.104 1.00 15.00 H new ATOM 0 HG22 VAL A 73 2.545 31.622 27.318 1.00 15.00 H new ATOM 0 HG23 VAL A 73 1.150 31.840 28.402 1.00 15.00 H new ATOM 566 N ALA A 74 3.667 33.697 31.759 1.00 15.00 N ATOM 567 CA ALA A 74 4.395 34.498 32.737 1.00 15.00 C ATOM 568 C ALA A 74 5.384 33.631 33.515 1.00 15.00 C ATOM 569 O ALA A 74 6.500 34.062 33.805 1.00 15.00 O ATOM 570 CB ALA A 74 3.412 35.174 33.698 1.00 15.00 C ATOM 0 H ALA A 74 2.655 33.679 31.888 1.00 15.00 H new ATOM 0 HA ALA A 74 4.957 35.267 32.206 1.00 15.00 H new ATOM 0 HB1 ALA A 74 3.965 35.770 34.424 1.00 15.00 H new ATOM 0 HB2 ALA A 74 2.739 35.821 33.135 1.00 15.00 H new ATOM 0 HB3 ALA A 74 2.831 34.413 34.219 1.00 15.00 H new ATOM 576 N ASP A 75 4.988 32.398 33.831 1.00 15.00 N ATOM 577 CA ASP A 75 5.862 31.500 34.579 1.00 15.00 C ATOM 578 C ASP A 75 7.154 31.252 33.808 1.00 15.00 C ATOM 579 O ASP A 75 8.248 31.312 34.370 1.00 15.00 O ATOM 580 CB ASP A 75 5.155 30.166 34.838 1.00 15.00 C ATOM 581 CG ASP A 75 3.960 30.347 35.774 1.00 15.00 C ATOM 582 OD1 ASP A 75 3.943 31.309 36.528 1.00 15.00 O ATOM 583 OD2 ASP A 75 3.072 29.511 35.725 1.00 15.00 O ATOM 0 H ASP A 75 4.080 32.004 33.584 1.00 15.00 H new ATOM 0 HA ASP A 75 6.101 31.970 35.533 1.00 15.00 H new ATOM 0 HB2 ASP A 75 4.819 29.740 33.893 1.00 15.00 H new ATOM 0 HB3 ASP A 75 5.859 29.457 35.275 1.00 15.00 H new ATOM 588 N LEU A 76 7.024 31.002 32.509 1.00 15.00 N ATOM 589 CA LEU A 76 8.197 30.777 31.670 1.00 15.00 C ATOM 590 C LEU A 76 9.120 31.990 31.711 1.00 15.00 C ATOM 591 O LEU A 76 10.336 31.859 31.837 1.00 15.00 O ATOM 592 CB LEU A 76 7.777 30.513 30.222 1.00 15.00 C ATOM 593 CG LEU A 76 7.280 29.073 30.077 1.00 15.00 C ATOM 594 CD1 LEU A 76 5.815 28.989 30.504 1.00 15.00 C ATOM 595 CD2 LEU A 76 7.409 28.637 28.616 1.00 15.00 C ATOM 0 H LEU A 76 6.131 30.950 32.019 1.00 15.00 H new ATOM 0 HA LEU A 76 8.727 29.906 32.056 1.00 15.00 H new ATOM 0 HB2 LEU A 76 6.991 31.209 29.930 1.00 15.00 H new ATOM 0 HB3 LEU A 76 8.620 30.685 29.553 1.00 15.00 H new ATOM 0 HG LEU A 76 7.879 28.418 30.710 1.00 15.00 H new ATOM 0 HD11 LEU A 76 5.464 27.962 30.400 1.00 15.00 H new ATOM 0 HD12 LEU A 76 5.721 29.301 31.544 1.00 15.00 H new ATOM 0 HD13 LEU A 76 5.214 29.644 29.873 1.00 15.00 H new ATOM 0 HD21 LEU A 76 7.056 27.611 28.510 1.00 15.00 H new ATOM 0 HD22 LEU A 76 6.810 29.294 27.986 1.00 15.00 H new ATOM 0 HD23 LEU A 76 8.454 28.694 28.310 1.00 15.00 H new ATOM 607 N SER A 77 8.525 33.174 31.629 1.00 15.00 N ATOM 608 CA SER A 77 9.296 34.412 31.619 1.00 15.00 C ATOM 609 C SER A 77 10.142 34.540 32.881 1.00 15.00 C ATOM 610 O SER A 77 11.295 34.967 32.820 1.00 15.00 O ATOM 611 CB SER A 77 8.343 35.603 31.521 1.00 15.00 C ATOM 612 OG SER A 77 9.088 36.778 31.242 1.00 15.00 O ATOM 0 H SER A 77 7.515 33.303 31.569 1.00 15.00 H new ATOM 0 HA SER A 77 9.964 34.396 30.758 1.00 15.00 H new ATOM 0 HB2 SER A 77 7.607 35.431 30.736 1.00 15.00 H new ATOM 0 HB3 SER A 77 7.792 35.721 32.454 1.00 15.00 H new ATOM 0 HG SER A 77 10.045 36.587 31.330 1.00 15.00 H new ATOM 618 N LYS A 78 9.556 34.187 34.018 1.00 15.00 N ATOM 619 CA LYS A 78 10.252 34.296 35.297 1.00 15.00 C ATOM 620 C LYS A 78 11.466 33.372 35.340 1.00 15.00 C ATOM 621 O LYS A 78 12.555 33.784 35.741 1.00 15.00 O ATOM 622 CB LYS A 78 9.294 33.941 36.437 1.00 15.00 C ATOM 623 CG LYS A 78 9.963 34.195 37.791 1.00 15.00 C ATOM 624 CD LYS A 78 10.013 35.700 38.071 1.00 15.00 C ATOM 625 CE LYS A 78 10.597 35.941 39.464 1.00 15.00 C ATOM 626 NZ LYS A 78 12.062 35.664 39.444 1.00 15.00 N ATOM 0 H LYS A 78 8.605 33.824 34.083 1.00 15.00 H new ATOM 0 HA LYS A 78 10.598 35.323 35.413 1.00 15.00 H new ATOM 0 HB2 LYS A 78 8.384 34.536 36.356 1.00 15.00 H new ATOM 0 HB3 LYS A 78 8.998 32.895 36.360 1.00 15.00 H new ATOM 0 HG2 LYS A 78 9.410 33.687 38.581 1.00 15.00 H new ATOM 0 HG3 LYS A 78 10.972 33.782 37.792 1.00 15.00 H new ATOM 0 HD2 LYS A 78 10.622 36.201 37.318 1.00 15.00 H new ATOM 0 HD3 LYS A 78 9.012 36.126 38.006 1.00 15.00 H new ATOM 0 HE2 LYS A 78 10.415 36.970 39.773 1.00 15.00 H new ATOM 0 HE3 LYS A 78 10.104 35.297 40.193 1.00 15.00 H new ATOM 0 HZ1 LYS A 78 12.491 36.002 40.329 1.00 15.00 H new ATOM 0 HZ2 LYS A 78 12.221 34.640 39.351 1.00 15.00 H new ATOM 0 HZ3 LYS A 78 12.497 36.156 38.638 1.00 15.00 H new ATOM 640 N SER A 79 11.272 32.124 34.925 1.00 15.00 N ATOM 641 CA SER A 79 12.353 31.144 34.964 1.00 15.00 C ATOM 642 C SER A 79 13.529 31.603 34.110 1.00 15.00 C ATOM 643 O SER A 79 14.687 31.487 34.511 1.00 15.00 O ATOM 644 CB SER A 79 11.848 29.792 34.456 1.00 15.00 C ATOM 645 OG SER A 79 12.850 28.807 34.677 1.00 15.00 O ATOM 0 H SER A 79 10.387 31.770 34.562 1.00 15.00 H new ATOM 0 HA SER A 79 12.689 31.044 35.996 1.00 15.00 H new ATOM 0 HB2 SER A 79 10.929 29.516 34.973 1.00 15.00 H new ATOM 0 HB3 SER A 79 11.610 29.854 33.394 1.00 15.00 H new ATOM 0 HG SER A 79 12.531 27.938 34.355 1.00 15.00 H new ATOM 651 N GLN A 80 13.218 32.124 32.929 1.00 15.00 N ATOM 652 CA GLN A 80 14.250 32.630 32.023 1.00 15.00 C ATOM 653 C GLN A 80 14.813 33.989 32.460 1.00 15.00 C ATOM 654 O GLN A 80 15.857 34.407 31.960 1.00 15.00 O ATOM 655 CB GLN A 80 13.673 32.756 30.609 1.00 15.00 C ATOM 656 CG GLN A 80 13.156 31.398 30.120 1.00 15.00 C ATOM 657 CD GLN A 80 14.278 30.362 30.105 1.00 15.00 C ATOM 658 OE1 GLN A 80 15.356 30.623 29.572 1.00 15.00 O ATOM 659 NE2 GLN A 80 14.086 29.198 30.662 1.00 15.00 N ATOM 0 H GLN A 80 12.265 32.208 32.575 1.00 15.00 H new ATOM 0 HA GLN A 80 15.072 31.915 32.045 1.00 15.00 H new ATOM 0 HB2 GLN A 80 12.862 33.484 30.604 1.00 15.00 H new ATOM 0 HB3 GLN A 80 14.439 33.127 29.928 1.00 15.00 H new ATOM 0 HG2 GLN A 80 12.349 31.057 30.768 1.00 15.00 H new ATOM 0 HG3 GLN A 80 12.738 31.502 29.119 1.00 15.00 H new ATOM 0 HE21 GLN A 80 13.191 28.985 31.103 1.00 15.00 H new ATOM 0 HE22 GLN A 80 14.831 28.501 30.657 1.00 15.00 H new ATOM 668 N ASP A 81 14.135 34.682 33.375 1.00 15.00 N ATOM 669 CA ASP A 81 14.571 36.008 33.799 1.00 15.00 C ATOM 670 C ASP A 81 14.592 36.965 32.608 1.00 15.00 C ATOM 671 O ASP A 81 15.515 37.764 32.445 1.00 15.00 O ATOM 672 CB ASP A 81 15.960 35.924 34.437 1.00 15.00 C ATOM 673 CG ASP A 81 16.312 37.254 35.095 1.00 15.00 C ATOM 674 OD1 ASP A 81 15.897 37.463 36.222 1.00 15.00 O ATOM 675 OD2 ASP A 81 16.992 38.044 34.460 1.00 15.00 O ATOM 0 H ASP A 81 13.287 34.348 33.833 1.00 15.00 H new ATOM 0 HA ASP A 81 13.867 36.390 34.538 1.00 15.00 H new ATOM 0 HB2 ASP A 81 15.981 35.125 35.178 1.00 15.00 H new ATOM 0 HB3 ASP A 81 16.703 35.676 33.679 1.00 15.00 H new ATOM 680 N ILE A 82 13.554 36.879 31.779 1.00 15.00 N ATOM 681 CA ILE A 82 13.436 37.733 30.598 1.00 15.00 C ATOM 682 C ILE A 82 12.167 38.574 30.699 1.00 15.00 C ATOM 683 O ILE A 82 11.178 38.145 31.291 1.00 15.00 O ATOM 684 CB ILE A 82 13.396 36.875 29.327 1.00 15.00 C ATOM 685 CG1 ILE A 82 14.646 35.992 29.260 1.00 15.00 C ATOM 686 CG2 ILE A 82 13.356 37.779 28.091 1.00 15.00 C ATOM 687 CD1 ILE A 82 14.526 35.017 28.087 1.00 15.00 C ATOM 0 H ILE A 82 12.781 36.225 31.903 1.00 15.00 H new ATOM 0 HA ILE A 82 14.302 38.393 30.547 1.00 15.00 H new ATOM 0 HB ILE A 82 12.504 36.249 29.351 1.00 15.00 H new ATOM 0 HG12 ILE A 82 15.535 36.612 29.141 1.00 15.00 H new ATOM 0 HG13 ILE A 82 14.764 35.441 30.193 1.00 15.00 H new ATOM 0 HG21 ILE A 82 13.328 37.164 27.191 1.00 15.00 H new ATOM 0 HG22 ILE A 82 12.467 38.408 28.129 1.00 15.00 H new ATOM 0 HG23 ILE A 82 14.245 38.409 28.072 1.00 15.00 H new ATOM 0 HD11 ILE A 82 15.417 34.390 28.042 1.00 15.00 H new ATOM 0 HD12 ILE A 82 13.647 34.388 28.225 1.00 15.00 H new ATOM 0 HD13 ILE A 82 14.429 35.577 27.157 1.00 15.00 H new ATOM 699 N ASN A 83 12.205 39.776 30.133 1.00 15.00 N ATOM 700 CA ASN A 83 11.041 40.654 30.161 1.00 15.00 C ATOM 701 C ASN A 83 9.984 40.171 29.173 1.00 15.00 C ATOM 702 O ASN A 83 10.301 39.763 28.055 1.00 15.00 O ATOM 703 CB ASN A 83 11.457 42.085 29.807 1.00 15.00 C ATOM 704 CG ASN A 83 12.421 42.631 30.857 1.00 15.00 C ATOM 705 OD1 ASN A 83 12.446 42.154 31.992 1.00 15.00 O ATOM 706 ND2 ASN A 83 13.222 43.612 30.543 1.00 15.00 N ATOM 0 H ASN A 83 13.019 40.161 29.655 1.00 15.00 H new ATOM 0 HA ASN A 83 10.619 40.637 31.166 1.00 15.00 H new ATOM 0 HB2 ASN A 83 11.930 42.101 28.825 1.00 15.00 H new ATOM 0 HB3 ASN A 83 10.575 42.723 29.746 1.00 15.00 H new ATOM 0 HD21 ASN A 83 13.869 43.984 31.238 1.00 15.00 H new ATOM 0 HD22 ASN A 83 13.201 44.007 29.603 1.00 15.00 H new ATOM 713 N LEU A 84 8.721 40.229 29.585 1.00 15.00 N ATOM 714 CA LEU A 84 7.630 39.786 28.721 1.00 15.00 C ATOM 715 C LEU A 84 7.646 40.538 27.392 1.00 15.00 C ATOM 716 O LEU A 84 7.379 39.955 26.342 1.00 15.00 O ATOM 717 CB LEU A 84 6.283 39.997 29.422 1.00 15.00 C ATOM 718 CG LEU A 84 6.218 39.143 30.692 1.00 15.00 C ATOM 719 CD1 LEU A 84 4.953 39.490 31.479 1.00 15.00 C ATOM 720 CD2 LEU A 84 6.177 37.662 30.312 1.00 15.00 C ATOM 0 H LEU A 84 8.429 40.574 30.500 1.00 15.00 H new ATOM 0 HA LEU A 84 7.768 38.724 28.518 1.00 15.00 H new ATOM 0 HB2 LEU A 84 6.155 41.050 29.674 1.00 15.00 H new ATOM 0 HB3 LEU A 84 5.467 39.729 28.750 1.00 15.00 H new ATOM 0 HG LEU A 84 7.098 39.343 31.303 1.00 15.00 H new ATOM 0 HD11 LEU A 84 4.908 38.882 32.382 1.00 15.00 H new ATOM 0 HD12 LEU A 84 4.973 40.545 31.753 1.00 15.00 H new ATOM 0 HD13 LEU A 84 4.076 39.291 30.864 1.00 15.00 H new ATOM 0 HD21 LEU A 84 6.131 37.055 31.216 1.00 15.00 H new ATOM 0 HD22 LEU A 84 5.297 37.468 29.699 1.00 15.00 H new ATOM 0 HD23 LEU A 84 7.074 37.406 29.749 1.00 15.00 H new ATOM 732 N SER A 85 7.986 41.825 27.434 1.00 15.00 N ATOM 733 CA SER A 85 8.040 42.623 26.215 1.00 15.00 C ATOM 734 C SER A 85 9.039 42.023 25.231 1.00 15.00 C ATOM 735 O SER A 85 8.758 41.905 24.039 1.00 15.00 O ATOM 736 CB SER A 85 8.449 44.059 26.549 1.00 15.00 C ATOM 737 OG SER A 85 8.312 44.865 25.387 1.00 15.00 O ATOM 0 H SER A 85 8.225 42.330 28.287 1.00 15.00 H new ATOM 0 HA SER A 85 7.051 42.625 25.758 1.00 15.00 H new ATOM 0 HB2 SER A 85 7.826 44.450 27.353 1.00 15.00 H new ATOM 0 HB3 SER A 85 9.479 44.083 26.904 1.00 15.00 H new ATOM 0 HG SER A 85 8.571 45.787 25.596 1.00 15.00 H new ATOM 743 N THR A 86 10.197 41.616 25.740 1.00 15.00 N ATOM 744 CA THR A 86 11.231 41.037 24.888 1.00 15.00 C ATOM 745 C THR A 86 10.728 39.760 24.221 1.00 15.00 C ATOM 746 O THR A 86 10.916 39.550 23.021 1.00 15.00 O ATOM 747 CB THR A 86 12.477 40.724 25.722 1.00 15.00 C ATOM 748 OG1 THR A 86 12.882 41.892 26.420 1.00 15.00 O ATOM 749 CG2 THR A 86 13.607 40.260 24.801 1.00 15.00 C ATOM 0 H THR A 86 10.442 41.675 26.728 1.00 15.00 H new ATOM 0 HA THR A 86 11.483 41.760 24.112 1.00 15.00 H new ATOM 0 HB THR A 86 12.247 39.934 26.437 1.00 15.00 H new ATOM 0 HG1 THR A 86 13.678 41.693 26.956 1.00 15.00 H new ATOM 0 HG21 THR A 86 14.493 40.038 25.396 1.00 15.00 H new ATOM 0 HG22 THR A 86 13.295 39.363 24.266 1.00 15.00 H new ATOM 0 HG23 THR A 86 13.839 41.048 24.085 1.00 15.00 H new ATOM 757 N ILE A 87 10.050 38.919 24.998 1.00 15.00 N ATOM 758 CA ILE A 87 9.553 37.649 24.479 1.00 15.00 C ATOM 759 C ILE A 87 8.632 37.897 23.288 1.00 15.00 C ATOM 760 O ILE A 87 8.743 37.239 22.255 1.00 15.00 O ATOM 761 CB ILE A 87 8.798 36.891 25.581 1.00 15.00 C ATOM 762 CG1 ILE A 87 9.727 36.669 26.778 1.00 15.00 C ATOM 763 CG2 ILE A 87 8.333 35.529 25.055 1.00 15.00 C ATOM 764 CD1 ILE A 87 8.931 36.073 27.942 1.00 15.00 C ATOM 0 H ILE A 87 9.834 39.092 25.980 1.00 15.00 H new ATOM 0 HA ILE A 87 10.399 37.045 24.151 1.00 15.00 H new ATOM 0 HB ILE A 87 7.932 37.480 25.885 1.00 15.00 H new ATOM 0 HG12 ILE A 87 10.541 35.999 26.500 1.00 15.00 H new ATOM 0 HG13 ILE A 87 10.180 37.613 27.080 1.00 15.00 H new ATOM 0 HG21 ILE A 87 7.799 34.998 25.843 1.00 15.00 H new ATOM 0 HG22 ILE A 87 7.670 35.675 24.202 1.00 15.00 H new ATOM 0 HG23 ILE A 87 9.199 34.944 24.746 1.00 15.00 H new ATOM 0 HD11 ILE A 87 9.594 35.916 28.793 1.00 15.00 H new ATOM 0 HD12 ILE A 87 8.133 36.759 28.226 1.00 15.00 H new ATOM 0 HD13 ILE A 87 8.499 35.120 27.637 1.00 15.00 H new ATOM 776 N TRP A 88 7.736 38.864 23.435 1.00 15.00 N ATOM 777 CA TRP A 88 6.811 39.201 22.359 1.00 15.00 C ATOM 778 C TRP A 88 7.558 39.643 21.103 1.00 15.00 C ATOM 779 O TRP A 88 7.270 39.173 20.004 1.00 15.00 O ATOM 780 CB TRP A 88 5.866 40.318 22.806 1.00 15.00 C ATOM 781 CG TRP A 88 4.843 40.674 21.776 1.00 15.00 C ATOM 782 CD1 TRP A 88 3.710 39.977 21.530 1.00 15.00 C ATOM 783 CD2 TRP A 88 4.840 41.799 20.848 1.00 15.00 C ATOM 784 NE1 TRP A 88 3.011 40.601 20.515 1.00 15.00 N ATOM 785 CE2 TRP A 88 3.666 41.727 20.059 1.00 15.00 C ATOM 786 CE3 TRP A 88 5.731 42.861 20.616 1.00 15.00 C ATOM 787 CZ2 TRP A 88 3.387 42.681 19.076 1.00 15.00 C ATOM 788 CZ3 TRP A 88 5.454 43.818 19.629 1.00 15.00 C ATOM 789 CH2 TRP A 88 4.286 43.730 18.861 1.00 15.00 C ATOM 0 H TRP A 88 7.629 39.425 24.280 1.00 15.00 H new ATOM 0 HA TRP A 88 6.236 38.305 22.124 1.00 15.00 H new ATOM 0 HB2 TRP A 88 5.359 40.011 23.721 1.00 15.00 H new ATOM 0 HB3 TRP A 88 6.452 41.205 23.048 1.00 15.00 H new ATOM 0 HD1 TRP A 88 3.402 39.078 22.044 1.00 15.00 H new ATOM 0 HE1 TRP A 88 2.119 40.270 20.147 1.00 15.00 H new ATOM 0 HE3 TRP A 88 6.635 42.941 21.202 1.00 15.00 H new ATOM 0 HZ2 TRP A 88 2.484 42.608 18.487 1.00 15.00 H new ATOM 0 HZ3 TRP A 88 6.147 44.629 19.460 1.00 15.00 H new ATOM 0 HH2 TRP A 88 4.080 44.472 18.103 1.00 15.00 H new ATOM 800 N SER A 89 8.545 40.518 21.269 1.00 15.00 N ATOM 801 CA SER A 89 9.261 41.070 20.121 1.00 15.00 C ATOM 802 C SER A 89 9.825 39.963 19.231 1.00 15.00 C ATOM 803 O SER A 89 9.795 40.071 18.005 1.00 15.00 O ATOM 804 CB SER A 89 10.404 41.966 20.601 1.00 15.00 C ATOM 805 OG SER A 89 11.423 41.159 21.174 1.00 15.00 O ATOM 0 H SER A 89 8.866 40.858 22.176 1.00 15.00 H new ATOM 0 HA SER A 89 8.552 41.655 19.535 1.00 15.00 H new ATOM 0 HB2 SER A 89 10.806 42.541 19.767 1.00 15.00 H new ATOM 0 HB3 SER A 89 10.036 42.683 21.335 1.00 15.00 H new ATOM 0 HG SER A 89 11.135 40.846 22.057 1.00 15.00 H new ATOM 811 N LEU A 90 10.339 38.903 19.849 1.00 15.00 N ATOM 812 CA LEU A 90 10.876 37.779 19.085 1.00 15.00 C ATOM 813 C LEU A 90 9.763 36.941 18.454 1.00 15.00 C ATOM 814 O LEU A 90 9.769 36.690 17.248 1.00 15.00 O ATOM 815 CB LEU A 90 11.718 36.888 20.001 1.00 15.00 C ATOM 816 CG LEU A 90 12.868 37.699 20.606 1.00 15.00 C ATOM 817 CD1 LEU A 90 13.617 36.838 21.623 1.00 15.00 C ATOM 818 CD2 LEU A 90 13.834 38.123 19.498 1.00 15.00 C ATOM 0 H LEU A 90 10.395 38.798 20.862 1.00 15.00 H new ATOM 0 HA LEU A 90 11.492 38.187 18.284 1.00 15.00 H new ATOM 0 HB2 LEU A 90 11.095 36.476 20.795 1.00 15.00 H new ATOM 0 HB3 LEU A 90 12.114 36.044 19.437 1.00 15.00 H new ATOM 0 HG LEU A 90 12.466 38.584 21.099 1.00 15.00 H new ATOM 0 HD11 LEU A 90 14.436 37.414 22.054 1.00 15.00 H new ATOM 0 HD12 LEU A 90 12.933 36.531 22.414 1.00 15.00 H new ATOM 0 HD13 LEU A 90 14.017 35.954 21.127 1.00 15.00 H new ATOM 0 HD21 LEU A 90 14.652 38.700 19.929 1.00 15.00 H new ATOM 0 HD22 LEU A 90 14.235 37.237 19.006 1.00 15.00 H new ATOM 0 HD23 LEU A 90 13.304 38.735 18.768 1.00 15.00 H new ATOM 830 N ASN A 91 8.793 36.531 19.265 1.00 15.00 N ATOM 831 CA ASN A 91 7.753 35.612 18.799 1.00 15.00 C ATOM 832 C ASN A 91 6.551 36.317 18.163 1.00 15.00 C ATOM 833 O ASN A 91 5.528 35.678 17.912 1.00 15.00 O ATOM 834 CB ASN A 91 7.275 34.746 19.967 1.00 15.00 C ATOM 835 CG ASN A 91 8.405 33.831 20.428 1.00 15.00 C ATOM 836 OD1 ASN A 91 8.310 32.609 20.307 1.00 15.00 O ATOM 837 ND2 ASN A 91 9.482 34.349 20.952 1.00 15.00 N ATOM 0 H ASN A 91 8.703 36.816 20.240 1.00 15.00 H new ATOM 0 HA ASN A 91 8.206 35.000 18.019 1.00 15.00 H new ATOM 0 HB2 ASN A 91 6.948 35.380 20.792 1.00 15.00 H new ATOM 0 HB3 ASN A 91 6.414 34.151 19.662 1.00 15.00 H new ATOM 0 HD21 ASN A 91 10.242 33.742 21.260 1.00 15.00 H new ATOM 0 HD22 ASN A 91 9.564 35.361 21.054 1.00 15.00 H new ATOM 844 N LYS A 92 6.650 37.620 17.905 1.00 15.00 N ATOM 845 CA LYS A 92 5.573 38.343 17.228 1.00 15.00 C ATOM 846 C LYS A 92 5.128 37.644 15.939 1.00 15.00 C ATOM 847 O LYS A 92 3.983 37.799 15.516 1.00 15.00 O ATOM 848 CB LYS A 92 6.017 39.773 16.902 1.00 15.00 C ATOM 849 CG LYS A 92 7.238 39.745 15.977 1.00 15.00 C ATOM 850 CD LYS A 92 7.561 41.164 15.496 1.00 15.00 C ATOM 851 CE LYS A 92 8.222 41.967 16.618 1.00 15.00 C ATOM 852 NZ LYS A 92 7.917 43.414 16.437 1.00 15.00 N ATOM 0 H LYS A 92 7.457 38.193 18.152 1.00 15.00 H new ATOM 0 HA LYS A 92 4.724 38.363 17.911 1.00 15.00 H new ATOM 0 HB2 LYS A 92 5.201 40.316 16.425 1.00 15.00 H new ATOM 0 HB3 LYS A 92 6.259 40.306 17.822 1.00 15.00 H new ATOM 0 HG2 LYS A 92 8.095 39.327 16.505 1.00 15.00 H new ATOM 0 HG3 LYS A 92 7.043 39.098 15.122 1.00 15.00 H new ATOM 0 HD2 LYS A 92 8.224 41.120 14.632 1.00 15.00 H new ATOM 0 HD3 LYS A 92 6.647 41.662 15.172 1.00 15.00 H new ATOM 0 HE2 LYS A 92 7.858 41.626 17.587 1.00 15.00 H new ATOM 0 HE3 LYS A 92 9.300 41.807 16.608 1.00 15.00 H new ATOM 0 HZ1 LYS A 92 8.366 43.961 17.199 1.00 15.00 H new ATOM 0 HZ2 LYS A 92 8.285 43.734 15.518 1.00 15.00 H new ATOM 0 HZ3 LYS A 92 6.887 43.558 16.467 1.00 15.00 H new ATOM 866 N HIS A 93 6.032 36.899 15.306 1.00 15.00 N ATOM 867 CA HIS A 93 5.692 36.192 14.077 1.00 15.00 C ATOM 868 C HIS A 93 4.814 34.971 14.365 1.00 15.00 C ATOM 869 O HIS A 93 3.917 34.651 13.587 1.00 15.00 O ATOM 870 CB HIS A 93 6.967 35.777 13.334 1.00 15.00 C ATOM 871 CG HIS A 93 7.752 34.672 13.992 1.00 15.00 C ATOM 872 ND1 HIS A 93 8.680 34.908 14.995 1.00 15.00 N ATOM 873 CD2 HIS A 93 7.775 33.316 13.774 1.00 15.00 C ATOM 874 CE1 HIS A 93 9.220 33.724 15.336 1.00 15.00 C ATOM 875 NE2 HIS A 93 8.704 32.719 14.623 1.00 15.00 N ATOM 0 H HIS A 93 6.994 36.771 15.620 1.00 15.00 H new ATOM 0 HA HIS A 93 5.121 36.870 13.442 1.00 15.00 H new ATOM 0 HB2 HIS A 93 6.697 35.461 12.326 1.00 15.00 H new ATOM 0 HB3 HIS A 93 7.611 36.650 13.232 1.00 15.00 H new ATOM 0 HD1 HIS A 93 8.911 35.815 15.401 1.00 15.00 H new ATOM 0 HD2 HIS A 93 7.165 32.792 13.053 1.00 15.00 H new ATOM 0 HE1 HIS A 93 9.979 33.601 16.094 1.00 15.00 H new ATOM 883 N LEU A 94 5.075 34.294 15.481 1.00 15.00 N ATOM 884 CA LEU A 94 4.301 33.108 15.840 1.00 15.00 C ATOM 885 C LEU A 94 2.876 33.473 16.247 1.00 15.00 C ATOM 886 O LEU A 94 1.921 32.802 15.856 1.00 15.00 O ATOM 887 CB LEU A 94 4.977 32.371 17.000 1.00 15.00 C ATOM 888 CG LEU A 94 6.406 31.981 16.613 1.00 15.00 C ATOM 889 CD1 LEU A 94 7.100 31.339 17.815 1.00 15.00 C ATOM 890 CD2 LEU A 94 6.375 30.977 15.457 1.00 15.00 C ATOM 0 H LEU A 94 5.808 34.542 16.146 1.00 15.00 H new ATOM 0 HA LEU A 94 4.259 32.465 14.961 1.00 15.00 H new ATOM 0 HB2 LEU A 94 4.992 33.006 17.885 1.00 15.00 H new ATOM 0 HB3 LEU A 94 4.405 31.479 17.257 1.00 15.00 H new ATOM 0 HG LEU A 94 6.950 32.874 16.304 1.00 15.00 H new ATOM 0 HD11 LEU A 94 8.118 31.061 17.542 1.00 15.00 H new ATOM 0 HD12 LEU A 94 7.128 32.049 18.641 1.00 15.00 H new ATOM 0 HD13 LEU A 94 6.550 30.449 18.120 1.00 15.00 H new ATOM 0 HD21 LEU A 94 7.394 30.703 15.186 1.00 15.00 H new ATOM 0 HD22 LEU A 94 5.829 30.085 15.764 1.00 15.00 H new ATOM 0 HD23 LEU A 94 5.879 31.427 14.597 1.00 15.00 H new ATOM 902 N TYR A 95 2.737 34.539 17.032 1.00 15.00 N ATOM 903 CA TYR A 95 1.425 34.952 17.531 1.00 15.00 C ATOM 904 C TYR A 95 1.029 36.310 16.963 1.00 15.00 C ATOM 905 O TYR A 95 1.878 37.167 16.724 1.00 15.00 O ATOM 906 CB TYR A 95 1.458 35.027 19.058 1.00 15.00 C ATOM 907 CG TYR A 95 1.839 33.721 19.715 1.00 15.00 C ATOM 908 CD1 TYR A 95 0.879 32.719 19.889 1.00 15.00 C ATOM 909 CD2 TYR A 95 3.155 33.513 20.148 1.00 15.00 C ATOM 910 CE1 TYR A 95 1.232 31.509 20.497 1.00 15.00 C ATOM 911 CE2 TYR A 95 3.508 32.302 20.756 1.00 15.00 C ATOM 912 CZ TYR A 95 2.546 31.300 20.930 1.00 15.00 C ATOM 913 OH TYR A 95 2.892 30.107 21.531 1.00 15.00 O ATOM 0 H TYR A 95 3.511 35.130 17.336 1.00 15.00 H new ATOM 0 HA TYR A 95 0.688 34.215 17.212 1.00 15.00 H new ATOM 0 HB2 TYR A 95 2.166 35.798 19.361 1.00 15.00 H new ATOM 0 HB3 TYR A 95 0.477 35.335 19.420 1.00 15.00 H new ATOM 0 HD1 TYR A 95 -0.135 32.879 19.554 1.00 15.00 H new ATOM 0 HD2 TYR A 95 3.897 34.286 20.013 1.00 15.00 H new ATOM 0 HE1 TYR A 95 0.490 30.736 20.632 1.00 15.00 H new ATOM 0 HE2 TYR A 95 4.522 32.141 21.091 1.00 15.00 H new ATOM 0 HH TYR A 95 3.692 29.742 21.098 1.00 15.00 H new ATOM 923 N SER A 96 -0.270 36.503 16.765 1.00 15.00 N ATOM 924 CA SER A 96 -0.771 37.738 16.170 1.00 15.00 C ATOM 925 C SER A 96 -0.644 38.915 17.132 1.00 15.00 C ATOM 926 O SER A 96 -0.270 40.016 16.727 1.00 15.00 O ATOM 927 CB SER A 96 -2.237 37.564 15.770 1.00 15.00 C ATOM 928 OG SER A 96 -2.357 36.438 14.913 1.00 15.00 O ATOM 0 H SER A 96 -0.993 35.825 17.006 1.00 15.00 H new ATOM 0 HA SER A 96 -0.167 37.952 15.288 1.00 15.00 H new ATOM 0 HB2 SER A 96 -2.855 37.428 16.658 1.00 15.00 H new ATOM 0 HB3 SER A 96 -2.597 38.460 15.265 1.00 15.00 H new ATOM 0 HG SER A 96 -3.295 36.322 14.655 1.00 15.00 H new ATOM 934 N SER A 97 -0.956 38.681 18.403 1.00 15.00 N ATOM 935 CA SER A 97 -0.943 39.758 19.388 1.00 15.00 C ATOM 936 C SER A 97 -0.662 39.226 20.789 1.00 15.00 C ATOM 937 O SER A 97 -0.659 38.016 21.019 1.00 15.00 O ATOM 938 CB SER A 97 -2.290 40.484 19.380 1.00 15.00 C ATOM 939 OG SER A 97 -3.284 39.628 19.928 1.00 15.00 O ATOM 0 H SER A 97 -1.218 37.767 18.772 1.00 15.00 H new ATOM 0 HA SER A 97 -0.146 40.451 19.118 1.00 15.00 H new ATOM 0 HB2 SER A 97 -2.225 41.404 19.961 1.00 15.00 H new ATOM 0 HB3 SER A 97 -2.558 40.768 18.362 1.00 15.00 H new ATOM 0 HG SER A 97 -4.149 40.089 19.927 1.00 15.00 H new ATOM 945 N GLU A 98 -0.426 40.143 21.722 1.00 15.00 N ATOM 946 CA GLU A 98 -0.139 39.772 23.104 1.00 15.00 C ATOM 947 C GLU A 98 -1.303 39.011 23.734 1.00 15.00 C ATOM 948 O GLU A 98 -1.095 38.112 24.546 1.00 15.00 O ATOM 949 CB GLU A 98 0.146 41.028 23.931 1.00 15.00 C ATOM 950 CG GLU A 98 1.411 41.717 23.405 1.00 15.00 C ATOM 951 CD GLU A 98 1.786 42.939 24.249 1.00 15.00 C ATOM 952 OE1 GLU A 98 0.994 43.356 25.083 1.00 15.00 O ATOM 953 OE2 GLU A 98 2.876 43.448 24.046 1.00 15.00 O ATOM 0 H GLU A 98 -0.428 41.148 21.547 1.00 15.00 H new ATOM 0 HA GLU A 98 0.735 39.120 23.097 1.00 15.00 H new ATOM 0 HB2 GLU A 98 -0.701 41.711 23.876 1.00 15.00 H new ATOM 0 HB3 GLU A 98 0.274 40.763 24.980 1.00 15.00 H new ATOM 0 HG2 GLU A 98 2.238 41.007 23.405 1.00 15.00 H new ATOM 0 HG3 GLU A 98 1.255 42.024 22.371 1.00 15.00 H new ATOM 960 N SER A 99 -2.531 39.368 23.360 1.00 15.00 N ATOM 961 CA SER A 99 -3.710 38.735 23.947 1.00 15.00 C ATOM 962 C SER A 99 -3.657 37.220 23.772 1.00 15.00 C ATOM 963 O SER A 99 -3.909 36.465 24.712 1.00 15.00 O ATOM 964 CB SER A 99 -4.976 39.282 23.288 1.00 15.00 C ATOM 965 OG SER A 99 -6.113 38.806 23.996 1.00 15.00 O ATOM 0 H SER A 99 -2.734 40.083 22.662 1.00 15.00 H new ATOM 0 HA SER A 99 -3.725 38.962 25.013 1.00 15.00 H new ATOM 0 HB2 SER A 99 -4.960 40.372 23.291 1.00 15.00 H new ATOM 0 HB3 SER A 99 -5.023 38.967 22.246 1.00 15.00 H new ATOM 0 HG SER A 99 -6.928 39.155 23.579 1.00 15.00 H new ATOM 971 N GLU A 100 -3.289 36.778 22.574 1.00 15.00 N ATOM 972 CA GLU A 100 -3.206 35.348 22.295 1.00 15.00 C ATOM 973 C GLU A 100 -2.171 34.668 23.192 1.00 15.00 C ATOM 974 O GLU A 100 -2.359 33.519 23.594 1.00 15.00 O ATOM 975 CB GLU A 100 -2.859 35.124 20.822 1.00 15.00 C ATOM 976 CG GLU A 100 -4.022 35.618 19.954 1.00 15.00 C ATOM 977 CD GLU A 100 -3.772 35.358 18.467 1.00 15.00 C ATOM 978 OE1 GLU A 100 -2.641 35.081 18.093 1.00 15.00 O ATOM 979 OE2 GLU A 100 -4.721 35.470 17.710 1.00 15.00 O ATOM 0 H GLU A 100 -3.046 37.381 21.788 1.00 15.00 H new ATOM 0 HA GLU A 100 -4.178 34.902 22.507 1.00 15.00 H new ATOM 0 HB2 GLU A 100 -1.944 35.658 20.565 1.00 15.00 H new ATOM 0 HB3 GLU A 100 -2.673 34.066 20.636 1.00 15.00 H new ATOM 0 HG2 GLU A 100 -4.942 35.119 20.261 1.00 15.00 H new ATOM 0 HG3 GLU A 100 -4.169 36.686 20.117 1.00 15.00 H new ATOM 986 N MET A 101 -1.085 35.371 23.502 1.00 15.00 N ATOM 987 CA MET A 101 -0.055 34.814 24.374 1.00 15.00 C ATOM 988 C MET A 101 -0.607 34.573 25.776 1.00 15.00 C ATOM 989 O MET A 101 -0.441 33.494 26.342 1.00 15.00 O ATOM 990 CB MET A 101 1.137 35.770 24.452 1.00 15.00 C ATOM 991 CG MET A 101 1.780 35.901 23.070 1.00 15.00 C ATOM 992 SD MET A 101 3.315 36.851 23.206 1.00 15.00 S ATOM 993 CE MET A 101 4.304 35.577 24.026 1.00 15.00 C ATOM 0 H MET A 101 -0.896 36.316 23.167 1.00 15.00 H new ATOM 0 HA MET A 101 0.269 33.861 23.956 1.00 15.00 H new ATOM 0 HB2 MET A 101 0.810 36.747 24.806 1.00 15.00 H new ATOM 0 HB3 MET A 101 1.868 35.399 25.171 1.00 15.00 H new ATOM 0 HG2 MET A 101 1.986 34.913 22.658 1.00 15.00 H new ATOM 0 HG3 MET A 101 1.093 36.396 22.383 1.00 15.00 H new ATOM 0 HE1 MET A 101 5.292 35.532 23.568 1.00 15.00 H new ATOM 0 HE2 MET A 101 4.406 35.820 25.084 1.00 15.00 H new ATOM 0 HE3 MET A 101 3.811 34.610 23.921 1.00 15.00 H new ATOM 1003 N MET A 102 -1.315 35.561 26.312 1.00 15.00 N ATOM 1004 CA MET A 102 -1.874 35.447 27.656 1.00 15.00 C ATOM 1005 C MET A 102 -2.831 34.261 27.762 1.00 15.00 C ATOM 1006 O MET A 102 -2.871 33.574 28.782 1.00 15.00 O ATOM 1007 CB MET A 102 -2.618 36.734 28.021 1.00 15.00 C ATOM 1008 CG MET A 102 -1.631 37.901 28.065 1.00 15.00 C ATOM 1009 SD MET A 102 -2.464 39.372 28.712 1.00 15.00 S ATOM 1010 CE MET A 102 -2.576 38.830 30.435 1.00 15.00 C ATOM 0 H MET A 102 -1.515 36.444 25.842 1.00 15.00 H new ATOM 0 HA MET A 102 -1.048 35.286 28.349 1.00 15.00 H new ATOM 0 HB2 MET A 102 -3.401 36.934 27.289 1.00 15.00 H new ATOM 0 HB3 MET A 102 -3.107 36.621 28.988 1.00 15.00 H new ATOM 0 HG2 MET A 102 -0.778 37.646 28.694 1.00 15.00 H new ATOM 0 HG3 MET A 102 -1.242 38.100 27.066 1.00 15.00 H new ATOM 0 HE1 MET A 102 -2.319 39.659 31.095 1.00 15.00 H new ATOM 0 HE2 MET A 102 -3.593 38.499 30.647 1.00 15.00 H new ATOM 0 HE3 MET A 102 -1.884 38.005 30.603 1.00 15.00 H new ATOM 1020 N LYS A 103 -3.598 34.026 26.702 1.00 15.00 N ATOM 1021 CA LYS A 103 -4.565 32.929 26.689 1.00 15.00 C ATOM 1022 C LYS A 103 -3.975 31.623 26.136 1.00 15.00 C ATOM 1023 O LYS A 103 -4.724 30.706 25.798 1.00 15.00 O ATOM 1024 CB LYS A 103 -5.774 33.326 25.839 1.00 15.00 C ATOM 1025 CG LYS A 103 -6.478 34.525 26.477 1.00 15.00 C ATOM 1026 CD LYS A 103 -7.746 34.853 25.685 1.00 15.00 C ATOM 1027 CE LYS A 103 -8.385 36.125 26.246 1.00 15.00 C ATOM 1028 NZ LYS A 103 -9.387 36.647 25.274 1.00 15.00 N ATOM 0 H LYS A 103 -3.571 34.576 25.844 1.00 15.00 H new ATOM 0 HA LYS A 103 -4.856 32.747 27.723 1.00 15.00 H new ATOM 0 HB2 LYS A 103 -5.454 33.575 24.827 1.00 15.00 H new ATOM 0 HB3 LYS A 103 -6.465 32.487 25.757 1.00 15.00 H new ATOM 0 HG2 LYS A 103 -6.731 34.302 27.514 1.00 15.00 H new ATOM 0 HG3 LYS A 103 -5.811 35.387 26.490 1.00 15.00 H new ATOM 0 HD2 LYS A 103 -7.504 34.990 24.631 1.00 15.00 H new ATOM 0 HD3 LYS A 103 -8.450 34.023 25.745 1.00 15.00 H new ATOM 0 HE2 LYS A 103 -8.865 35.913 27.201 1.00 15.00 H new ATOM 0 HE3 LYS A 103 -7.619 36.877 26.434 1.00 15.00 H new ATOM 0 HZ1 LYS A 103 -9.822 37.512 25.654 1.00 15.00 H new ATOM 0 HZ2 LYS A 103 -8.916 36.864 24.373 1.00 15.00 H new ATOM 0 HZ3 LYS A 103 -10.123 35.930 25.116 1.00 15.00 H new ATOM 1042 N ALA A 104 -2.648 31.529 26.039 1.00 15.00 N ATOM 1043 CA ALA A 104 -2.007 30.335 25.501 1.00 15.00 C ATOM 1044 C ALA A 104 -2.465 29.081 26.240 1.00 15.00 C ATOM 1045 O ALA A 104 -2.751 29.118 27.436 1.00 15.00 O ATOM 1046 CB ALA A 104 -0.487 30.466 25.616 1.00 15.00 C ATOM 0 H ALA A 104 -2.001 32.264 26.325 1.00 15.00 H new ATOM 0 HA ALA A 104 -2.293 30.242 24.453 1.00 15.00 H new ATOM 0 HB1 ALA A 104 -0.013 29.571 25.213 1.00 15.00 H new ATOM 0 HB2 ALA A 104 -0.153 31.338 25.054 1.00 15.00 H new ATOM 0 HB3 ALA A 104 -0.210 30.582 26.664 1.00 15.00 H new ATOM 1052 N ALA A 105 -2.530 27.972 25.509 1.00 15.00 N ATOM 1053 CA ALA A 105 -2.960 26.698 26.080 1.00 15.00 C ATOM 1054 C ALA A 105 -1.940 25.599 25.766 1.00 15.00 C ATOM 1055 O ALA A 105 -1.043 25.811 24.949 1.00 15.00 O ATOM 1056 CB ALA A 105 -4.325 26.308 25.510 1.00 15.00 C ATOM 0 H ALA A 105 -2.290 27.929 24.519 1.00 15.00 H new ATOM 0 HA ALA A 105 -3.036 26.810 27.162 1.00 15.00 H new ATOM 0 HB1 ALA A 105 -4.640 25.357 25.939 1.00 15.00 H new ATOM 0 HB2 ALA A 105 -5.056 27.078 25.757 1.00 15.00 H new ATOM 0 HB3 ALA A 105 -4.253 26.211 24.427 1.00 15.00 H new ATOM 1062 N PRO A 106 -2.048 24.439 26.382 1.00 15.00 N ATOM 1063 CA PRO A 106 -1.074 23.330 26.137 1.00 15.00 C ATOM 1064 C PRO A 106 -1.007 22.926 24.666 1.00 15.00 C ATOM 1065 O PRO A 106 -2.009 22.972 23.953 1.00 15.00 O ATOM 1066 CB PRO A 106 -1.582 22.166 26.998 1.00 15.00 C ATOM 1067 CG PRO A 106 -2.475 22.783 28.019 1.00 15.00 C ATOM 1068 CD PRO A 106 -3.071 24.027 27.367 1.00 15.00 C ATOM 0 HA PRO A 106 -0.060 23.635 26.395 1.00 15.00 H new ATOM 0 HB2 PRO A 106 -2.122 21.438 26.393 1.00 15.00 H new ATOM 0 HB3 PRO A 106 -0.754 21.637 27.470 1.00 15.00 H new ATOM 0 HG2 PRO A 106 -3.259 22.088 28.321 1.00 15.00 H new ATOM 0 HG3 PRO A 106 -1.916 23.044 28.918 1.00 15.00 H new ATOM 0 HD2 PRO A 106 -4.024 23.808 26.885 1.00 15.00 H new ATOM 0 HD3 PRO A 106 -3.258 24.811 28.100 1.00 15.00 H new ATOM 1076 N GLY A 107 0.183 22.529 24.222 1.00 15.00 N ATOM 1077 CA GLY A 107 0.368 22.069 22.846 1.00 15.00 C ATOM 1078 C GLY A 107 1.072 23.097 21.953 1.00 15.00 C ATOM 1079 O GLY A 107 1.560 22.741 20.881 1.00 15.00 O ATOM 0 H GLY A 107 1.030 22.516 24.790 1.00 15.00 H new ATOM 0 HA2 GLY A 107 0.948 21.146 22.854 1.00 15.00 H new ATOM 0 HA3 GLY A 107 -0.605 21.830 22.416 1.00 15.00 H new ATOM 1083 N GLN A 108 1.130 24.359 22.380 1.00 15.00 N ATOM 1084 CA GLN A 108 1.773 25.394 21.577 1.00 15.00 C ATOM 1085 C GLN A 108 3.271 25.451 21.861 1.00 15.00 C ATOM 1086 O GLN A 108 3.726 25.027 22.922 1.00 15.00 O ATOM 1087 CB GLN A 108 1.130 26.754 21.850 1.00 15.00 C ATOM 1088 CG GLN A 108 -0.311 26.738 21.340 1.00 15.00 C ATOM 1089 CD GLN A 108 -0.960 28.100 21.552 1.00 15.00 C ATOM 1090 OE1 GLN A 108 -1.469 28.379 22.637 1.00 15.00 O ATOM 1091 NE2 GLN A 108 -0.971 28.969 20.578 1.00 15.00 N ATOM 0 H GLN A 108 0.744 24.684 23.266 1.00 15.00 H new ATOM 0 HA GLN A 108 1.634 25.144 20.525 1.00 15.00 H new ATOM 0 HB2 GLN A 108 1.148 26.971 22.918 1.00 15.00 H new ATOM 0 HB3 GLN A 108 1.695 27.543 21.355 1.00 15.00 H new ATOM 0 HG2 GLN A 108 -0.327 26.481 20.281 1.00 15.00 H new ATOM 0 HG3 GLN A 108 -0.881 25.970 21.863 1.00 15.00 H new ATOM 0 HE21 GLN A 108 -0.548 28.734 19.680 1.00 15.00 H new ATOM 0 HE22 GLN A 108 -1.403 29.883 20.715 1.00 15.00 H new ATOM 1100 N GLN A 109 4.034 25.967 20.902 1.00 15.00 N ATOM 1101 CA GLN A 109 5.488 26.022 21.031 1.00 15.00 C ATOM 1102 C GLN A 109 5.976 27.460 21.187 1.00 15.00 C ATOM 1103 O GLN A 109 5.330 28.405 20.732 1.00 15.00 O ATOM 1104 CB GLN A 109 6.139 25.399 19.795 1.00 15.00 C ATOM 1105 CG GLN A 109 5.778 23.913 19.718 1.00 15.00 C ATOM 1106 CD GLN A 109 6.345 23.288 18.445 1.00 15.00 C ATOM 1107 OE1 GLN A 109 6.690 23.995 17.496 1.00 15.00 O ATOM 1108 NE2 GLN A 109 6.464 21.992 18.368 1.00 15.00 N ATOM 0 H GLN A 109 3.672 26.352 20.030 1.00 15.00 H new ATOM 0 HA GLN A 109 5.769 25.463 21.924 1.00 15.00 H new ATOM 0 HB2 GLN A 109 5.801 25.913 18.895 1.00 15.00 H new ATOM 0 HB3 GLN A 109 7.221 25.519 19.842 1.00 15.00 H new ATOM 0 HG2 GLN A 109 6.170 23.392 20.591 1.00 15.00 H new ATOM 0 HG3 GLN A 109 4.695 23.795 19.736 1.00 15.00 H new ATOM 0 HE21 GLN A 109 6.179 21.406 19.153 1.00 15.00 H new ATOM 0 HE22 GLN A 109 6.842 21.564 17.523 1.00 15.00 H new ATOM 1117 N ILE A 110 7.099 27.609 21.883 1.00 15.00 N ATOM 1118 CA ILE A 110 7.751 28.905 22.039 1.00 15.00 C ATOM 1119 C ILE A 110 9.204 28.793 21.581 1.00 15.00 C ATOM 1120 O ILE A 110 9.895 27.838 21.934 1.00 15.00 O ATOM 1121 CB ILE A 110 7.693 29.344 23.509 1.00 15.00 C ATOM 1122 CG1 ILE A 110 6.232 29.425 23.961 1.00 15.00 C ATOM 1123 CG2 ILE A 110 8.349 30.719 23.670 1.00 15.00 C ATOM 1124 CD1 ILE A 110 6.165 29.560 25.484 1.00 15.00 C ATOM 0 H ILE A 110 7.580 26.841 22.352 1.00 15.00 H new ATOM 0 HA ILE A 110 7.237 29.650 21.432 1.00 15.00 H new ATOM 0 HB ILE A 110 8.228 28.616 24.119 1.00 15.00 H new ATOM 0 HG12 ILE A 110 5.743 30.278 23.490 1.00 15.00 H new ATOM 0 HG13 ILE A 110 5.694 28.533 23.642 1.00 15.00 H new ATOM 0 HG21 ILE A 110 8.304 31.023 24.716 1.00 15.00 H new ATOM 0 HG22 ILE A 110 9.390 30.665 23.353 1.00 15.00 H new ATOM 0 HG23 ILE A 110 7.820 31.448 23.057 1.00 15.00 H new ATOM 0 HD11 ILE A 110 5.123 29.617 25.799 1.00 15.00 H new ATOM 0 HD12 ILE A 110 6.637 28.694 25.947 1.00 15.00 H new ATOM 0 HD13 ILE A 110 6.687 30.466 25.792 1.00 15.00 H new ATOM 1136 N ILE A 111 9.668 29.769 20.803 1.00 15.00 N ATOM 1137 CA ILE A 111 11.046 29.754 20.314 1.00 15.00 C ATOM 1138 C ILE A 111 11.883 30.800 21.044 1.00 15.00 C ATOM 1139 O ILE A 111 11.465 31.947 21.205 1.00 15.00 O ATOM 1140 CB ILE A 111 11.085 30.022 18.803 1.00 15.00 C ATOM 1141 CG1 ILE A 111 10.198 29.009 18.073 1.00 15.00 C ATOM 1142 CG2 ILE A 111 12.524 29.880 18.293 1.00 15.00 C ATOM 1143 CD1 ILE A 111 10.104 29.381 16.591 1.00 15.00 C ATOM 0 H ILE A 111 9.117 30.572 20.500 1.00 15.00 H new ATOM 0 HA ILE A 111 11.464 28.766 20.509 1.00 15.00 H new ATOM 0 HB ILE A 111 10.722 31.032 18.613 1.00 15.00 H new ATOM 0 HG12 ILE A 111 10.610 28.006 18.181 1.00 15.00 H new ATOM 0 HG13 ILE A 111 9.203 28.994 18.518 1.00 15.00 H new ATOM 0 HG21 ILE A 111 12.550 30.071 17.220 1.00 15.00 H new ATOM 0 HG22 ILE A 111 13.164 30.599 18.805 1.00 15.00 H new ATOM 0 HG23 ILE A 111 12.882 28.870 18.491 1.00 15.00 H new ATOM 0 HD11 ILE A 111 9.472 28.659 16.074 1.00 15.00 H new ATOM 0 HD12 ILE A 111 9.672 30.377 16.493 1.00 15.00 H new ATOM 0 HD13 ILE A 111 11.101 29.373 16.150 1.00 15.00 H new ATOM 1155 N LEU A 112 13.064 30.386 21.489 1.00 15.00 N ATOM 1156 CA LEU A 112 14.016 31.296 22.116 1.00 15.00 C ATOM 1157 C LEU A 112 15.280 31.393 21.255 1.00 15.00 C ATOM 1158 O LEU A 112 16.148 30.523 21.363 1.00 15.00 O ATOM 1159 CB LEU A 112 14.393 30.767 23.501 1.00 15.00 C ATOM 1160 CG LEU A 112 13.183 30.863 24.432 1.00 15.00 C ATOM 1161 CD1 LEU A 112 13.392 29.942 25.636 1.00 15.00 C ATOM 1162 CD2 LEU A 112 13.027 32.305 24.917 1.00 15.00 C ATOM 0 H LEU A 112 13.387 29.420 21.427 1.00 15.00 H new ATOM 0 HA LEU A 112 13.561 32.282 22.210 1.00 15.00 H new ATOM 0 HB2 LEU A 112 14.727 29.732 23.428 1.00 15.00 H new ATOM 0 HB3 LEU A 112 15.224 31.343 23.908 1.00 15.00 H new ATOM 0 HG LEU A 112 12.285 30.560 23.893 1.00 15.00 H new ATOM 0 HD11 LEU A 112 12.530 30.010 26.300 1.00 15.00 H new ATOM 0 HD12 LEU A 112 13.505 28.914 25.292 1.00 15.00 H new ATOM 0 HD13 LEU A 112 14.290 30.245 26.175 1.00 15.00 H new ATOM 0 HD21 LEU A 112 12.165 32.374 25.580 1.00 15.00 H new ATOM 0 HD22 LEU A 112 13.925 32.607 25.456 1.00 15.00 H new ATOM 0 HD23 LEU A 112 12.880 32.963 24.061 1.00 15.00 H new ATOM 1174 N PRO A 113 15.394 32.370 20.376 1.00 15.00 N ATOM 1175 CA PRO A 113 16.600 32.495 19.505 1.00 15.00 C ATOM 1176 C PRO A 113 17.791 33.103 20.241 1.00 15.00 C ATOM 1177 O PRO A 113 17.654 34.100 20.951 1.00 15.00 O ATOM 1178 CB PRO A 113 16.140 33.407 18.367 1.00 15.00 C ATOM 1179 CG PRO A 113 15.074 34.261 18.961 1.00 15.00 C ATOM 1180 CD PRO A 113 14.423 33.444 20.078 1.00 15.00 C ATOM 0 HA PRO A 113 16.951 31.522 19.162 1.00 15.00 H new ATOM 0 HB2 PRO A 113 16.964 34.012 17.989 1.00 15.00 H new ATOM 0 HB3 PRO A 113 15.758 32.827 17.527 1.00 15.00 H new ATOM 0 HG2 PRO A 113 15.495 35.187 19.354 1.00 15.00 H new ATOM 0 HG3 PRO A 113 14.338 34.540 18.207 1.00 15.00 H new ATOM 0 HD2 PRO A 113 14.231 34.059 20.957 1.00 15.00 H new ATOM 0 HD3 PRO A 113 13.464 33.034 19.761 1.00 15.00 H new