USER MOD reduce.3.24.130724 H: found=0, std=0, add=585, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 586 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 63 THR OG1 : rot -65:sc= 1.27 USER MOD Set 1.2: A 66 THR OG1 : rot 180:sc= 1.11 USER MOD Set 2.1: A 56 GLN : amide:sc= 1.2 X(o=2.2,f=1.9) USER MOD Set 2.2: A 97 SER OG : rot 160:sc= 1.01 USER MOD Set 3.1: A 55 TYR OH : rot 180:sc= 0.623 USER MOD Set 3.2: A 75 SER OG : rot -115:sc= 0.751 USER MOD Set 3.3: A 77 MET CE :methyl -174:sc= -0.163 (180deg=-0.405) USER MOD Single : A 53 TYR OH : rot 30:sc= 0.493 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot -57:sc= 1.14 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -152:sc= -2.52 (180deg=-4.02!) USER MOD Single : A 76 ASN : amide:sc= -0.0786 K(o=-0.079,f=-1.2) USER MOD Single : A 78 GLN : amide:sc= -0.219 K(o=-0.22,f=-3!) USER MOD Single : A 80 SER OG : rot 180:sc= -0.0728 USER MOD Single : A 81 TYR OH : rot -149:sc= -1.52! USER MOD Single : A 82 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 30:sc= -0.281 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0395 USER MOD Single : A 94 SER OG : rot -75:sc= 0.854 USER MOD Single : A 98 THR OG1 : rot 110:sc= 0.0297 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0602 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 106 THR OG1 : rot 79:sc= 1.21 USER MOD Single : A 109 SER OG : rot 81:sc= 2.11 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : A 118 SER OG : rot 6:sc= 0.0983 USER MOD Single : A 120 SER OG : rot -4:sc= 0.172 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0.0538 X(o=0.054,f=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -0.276 X(o=-0.28,f=-0.29) USER MOD ----------------------------------------------------------------- ATOM 510 N TYR A 53 1.077 -11.464 -1.659 1.00 10.00 N ATOM 511 CA TYR A 53 0.733 -10.364 -2.543 1.00 10.00 C ATOM 512 C TYR A 53 1.970 -9.833 -3.249 1.00 10.00 C ATOM 513 O TYR A 53 3.005 -9.611 -2.623 1.00 10.00 O ATOM 514 CB TYR A 53 0.060 -9.251 -1.735 1.00 10.00 C ATOM 515 CG TYR A 53 -0.339 -8.030 -2.539 1.00 10.00 C ATOM 516 CD1 TYR A 53 -1.101 -8.144 -3.694 1.00 10.00 C ATOM 517 CD2 TYR A 53 0.036 -6.760 -2.124 1.00 10.00 C ATOM 518 CE1 TYR A 53 -1.472 -7.025 -4.415 1.00 10.00 C ATOM 519 CE2 TYR A 53 -0.332 -5.637 -2.836 1.00 10.00 C ATOM 520 CZ TYR A 53 -1.086 -5.773 -3.980 1.00 10.00 C ATOM 521 OH TYR A 53 -1.454 -4.651 -4.692 1.00 10.00 O ATOM 0 HA TYR A 53 0.041 -10.725 -3.304 1.00 10.00 H new ATOM 0 HB2 TYR A 53 -0.830 -9.658 -1.254 1.00 10.00 H new ATOM 0 HB3 TYR A 53 0.737 -8.939 -0.940 1.00 10.00 H new ATOM 0 HD1 TYR A 53 -1.408 -9.122 -4.034 1.00 10.00 H new ATOM 0 HD2 TYR A 53 0.627 -6.649 -1.227 1.00 10.00 H new ATOM 0 HE1 TYR A 53 -2.061 -7.129 -5.314 1.00 10.00 H new ATOM 0 HE2 TYR A 53 -0.030 -4.657 -2.498 1.00 10.00 H new ATOM 0 HH TYR A 53 -2.309 -4.815 -5.141 1.00 10.00 H new ATOM 531 N THR A 54 1.863 -9.649 -4.555 1.00 10.00 N ATOM 532 CA THR A 54 2.965 -9.132 -5.339 1.00 10.00 C ATOM 533 C THR A 54 3.123 -7.638 -5.103 1.00 10.00 C ATOM 534 O THR A 54 2.273 -6.837 -5.494 1.00 10.00 O ATOM 535 CB THR A 54 2.759 -9.381 -6.843 1.00 10.00 C ATOM 536 OG1 THR A 54 2.364 -10.743 -7.066 1.00 10.00 O ATOM 537 CG2 THR A 54 4.036 -9.079 -7.624 1.00 10.00 C ATOM 0 H THR A 54 1.020 -9.852 -5.093 1.00 10.00 H new ATOM 0 HA THR A 54 3.864 -9.659 -5.020 1.00 10.00 H new ATOM 0 HB THR A 54 1.972 -8.714 -7.195 1.00 10.00 H new ATOM 0 HG1 THR A 54 2.233 -10.893 -8.026 1.00 10.00 H new ATOM 0 HG21 THR A 54 3.866 -9.262 -8.685 1.00 10.00 H new ATOM 0 HG22 THR A 54 4.315 -8.036 -7.476 1.00 10.00 H new ATOM 0 HG23 THR A 54 4.841 -9.723 -7.269 1.00 10.00 H new ATOM 545 N TYR A 55 4.203 -7.282 -4.445 1.00 10.00 N ATOM 546 CA TYR A 55 4.504 -5.895 -4.151 1.00 10.00 C ATOM 547 C TYR A 55 5.312 -5.306 -5.295 1.00 10.00 C ATOM 548 O TYR A 55 6.519 -5.523 -5.392 1.00 10.00 O ATOM 549 CB TYR A 55 5.275 -5.781 -2.834 1.00 10.00 C ATOM 550 CG TYR A 55 4.495 -6.270 -1.633 1.00 10.00 C ATOM 551 CD1 TYR A 55 3.452 -5.518 -1.107 1.00 10.00 C ATOM 552 CD2 TYR A 55 4.799 -7.482 -1.027 1.00 10.00 C ATOM 553 CE1 TYR A 55 2.737 -5.959 -0.010 1.00 10.00 C ATOM 554 CE2 TYR A 55 4.087 -7.931 0.069 1.00 10.00 C ATOM 555 CZ TYR A 55 3.056 -7.166 0.572 1.00 10.00 C ATOM 556 OH TYR A 55 2.340 -7.607 1.665 1.00 10.00 O ATOM 0 H TYR A 55 4.898 -7.943 -4.098 1.00 10.00 H new ATOM 0 HA TYR A 55 3.573 -5.339 -4.044 1.00 10.00 H new ATOM 0 HB2 TYR A 55 6.200 -6.352 -2.913 1.00 10.00 H new ATOM 0 HB3 TYR A 55 5.556 -4.740 -2.676 1.00 10.00 H new ATOM 0 HD1 TYR A 55 3.196 -4.573 -1.563 1.00 10.00 H new ATOM 0 HD2 TYR A 55 5.606 -8.084 -1.419 1.00 10.00 H new ATOM 0 HE1 TYR A 55 1.932 -5.360 0.389 1.00 10.00 H new ATOM 0 HE2 TYR A 55 4.337 -8.876 0.529 1.00 10.00 H new ATOM 0 HH TYR A 55 2.689 -8.475 1.956 1.00 10.00 H new ATOM 566 N GLN A 56 4.630 -4.593 -6.174 1.00 10.00 N ATOM 567 CA GLN A 56 5.271 -3.982 -7.328 1.00 10.00 C ATOM 568 C GLN A 56 4.795 -2.545 -7.488 1.00 10.00 C ATOM 569 O GLN A 56 3.652 -2.229 -7.155 1.00 10.00 O ATOM 570 CB GLN A 56 4.937 -4.782 -8.589 1.00 10.00 C ATOM 571 CG GLN A 56 5.679 -4.311 -9.825 1.00 10.00 C ATOM 572 CD GLN A 56 4.898 -4.567 -11.096 1.00 10.00 C ATOM 573 OE1 GLN A 56 4.043 -3.770 -11.487 1.00 10.00 O ATOM 574 NE2 GLN A 56 5.195 -5.668 -11.760 1.00 10.00 N ATOM 0 H GLN A 56 3.626 -4.422 -6.111 1.00 10.00 H new ATOM 0 HA GLN A 56 6.351 -3.983 -7.177 1.00 10.00 H new ATOM 0 HB2 GLN A 56 5.170 -5.832 -8.414 1.00 10.00 H new ATOM 0 HB3 GLN A 56 3.865 -4.720 -8.774 1.00 10.00 H new ATOM 0 HG2 GLN A 56 5.886 -3.245 -9.737 1.00 10.00 H new ATOM 0 HG3 GLN A 56 6.641 -4.819 -9.884 1.00 10.00 H new ATOM 0 HE21 GLN A 56 5.909 -6.302 -11.402 1.00 10.00 H new ATOM 0 HE22 GLN A 56 4.710 -5.885 -12.631 1.00 10.00 H new ATOM 583 N ALA A 57 5.673 -1.679 -7.979 1.00 10.00 N ATOM 584 CA ALA A 57 5.328 -0.280 -8.194 1.00 10.00 C ATOM 585 C ALA A 57 4.438 -0.135 -9.420 1.00 10.00 C ATOM 586 O ALA A 57 4.826 -0.510 -10.528 1.00 10.00 O ATOM 587 CB ALA A 57 6.583 0.562 -8.360 1.00 10.00 C ATOM 0 H ALA A 57 6.630 -1.922 -8.236 1.00 10.00 H new ATOM 0 HA ALA A 57 4.783 0.075 -7.319 1.00 10.00 H new ATOM 0 HB1 ALA A 57 6.304 1.604 -8.520 1.00 10.00 H new ATOM 0 HB2 ALA A 57 7.195 0.484 -7.461 1.00 10.00 H new ATOM 0 HB3 ALA A 57 7.151 0.203 -9.218 1.00 10.00 H new ATOM 593 N THR A 58 3.251 0.411 -9.222 1.00 10.00 N ATOM 594 CA THR A 58 2.308 0.598 -10.310 1.00 10.00 C ATOM 595 C THR A 58 2.216 2.075 -10.685 1.00 10.00 C ATOM 596 O THR A 58 2.551 2.946 -9.880 1.00 10.00 O ATOM 597 CB THR A 58 0.907 0.069 -9.927 1.00 10.00 C ATOM 598 OG1 THR A 58 0.396 0.783 -8.792 1.00 10.00 O ATOM 599 CG2 THR A 58 0.955 -1.420 -9.618 1.00 10.00 C ATOM 0 H THR A 58 2.917 0.734 -8.314 1.00 10.00 H new ATOM 0 HA THR A 58 2.670 0.031 -11.168 1.00 10.00 H new ATOM 0 HB THR A 58 0.244 0.227 -10.778 1.00 10.00 H new ATOM 0 HG1 THR A 58 1.026 0.704 -8.045 1.00 10.00 H new ATOM 0 HG21 THR A 58 -0.043 -1.769 -9.351 1.00 10.00 H new ATOM 0 HG22 THR A 58 1.306 -1.963 -10.496 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.636 -1.597 -8.785 1.00 10.00 H new ATOM 607 N PRO A 59 1.760 2.388 -11.910 1.00 10.00 N ATOM 608 CA PRO A 59 1.624 3.775 -12.364 1.00 10.00 C ATOM 609 C PRO A 59 0.517 4.516 -11.618 1.00 10.00 C ATOM 610 O PRO A 59 0.315 5.714 -11.813 1.00 10.00 O ATOM 611 CB PRO A 59 1.268 3.633 -13.845 1.00 10.00 C ATOM 612 CG PRO A 59 0.640 2.290 -13.952 1.00 10.00 C ATOM 613 CD PRO A 59 1.357 1.427 -12.956 1.00 10.00 C ATOM 0 HA PRO A 59 2.530 4.355 -12.186 1.00 10.00 H new ATOM 0 HB2 PRO A 59 0.583 4.418 -14.165 1.00 10.00 H new ATOM 0 HB3 PRO A 59 2.154 3.708 -14.475 1.00 10.00 H new ATOM 0 HG2 PRO A 59 -0.427 2.338 -13.733 1.00 10.00 H new ATOM 0 HG3 PRO A 59 0.740 1.890 -14.961 1.00 10.00 H new ATOM 0 HD2 PRO A 59 0.709 0.646 -12.558 1.00 10.00 H new ATOM 0 HD3 PRO A 59 2.219 0.929 -13.400 1.00 10.00 H new ATOM 621 N MET A 60 -0.191 3.792 -10.761 1.00 10.00 N ATOM 622 CA MET A 60 -1.274 4.367 -9.983 1.00 10.00 C ATOM 623 C MET A 60 -0.769 4.859 -8.633 1.00 10.00 C ATOM 624 O MET A 60 -1.431 5.660 -7.970 1.00 10.00 O ATOM 625 CB MET A 60 -2.394 3.342 -9.779 1.00 10.00 C ATOM 626 CG MET A 60 -3.115 2.965 -11.060 1.00 10.00 C ATOM 627 SD MET A 60 -4.555 1.920 -10.766 1.00 10.00 S ATOM 628 CE MET A 60 -5.173 1.727 -12.437 1.00 10.00 C ATOM 0 H MET A 60 -0.031 2.800 -10.588 1.00 10.00 H new ATOM 0 HA MET A 60 -1.671 5.217 -10.537 1.00 10.00 H new ATOM 0 HB2 MET A 60 -1.974 2.442 -9.330 1.00 10.00 H new ATOM 0 HB3 MET A 60 -3.118 3.744 -9.070 1.00 10.00 H new ATOM 0 HG2 MET A 60 -3.429 3.872 -11.576 1.00 10.00 H new ATOM 0 HG3 MET A 60 -2.423 2.445 -11.722 1.00 10.00 H new ATOM 0 HE1 MET A 60 -6.066 1.103 -12.425 1.00 10.00 H new ATOM 0 HE2 MET A 60 -5.420 2.706 -12.849 1.00 10.00 H new ATOM 0 HE3 MET A 60 -4.409 1.255 -13.055 1.00 10.00 H new ATOM 638 N ASP A 61 0.399 4.369 -8.221 1.00 10.00 N ATOM 639 CA ASP A 61 0.988 4.769 -6.945 1.00 10.00 C ATOM 640 C ASP A 61 1.522 6.189 -7.050 1.00 10.00 C ATOM 641 O ASP A 61 1.164 7.068 -6.268 1.00 10.00 O ATOM 642 CB ASP A 61 2.126 3.824 -6.534 1.00 10.00 C ATOM 643 CG ASP A 61 1.670 2.395 -6.319 1.00 10.00 C ATOM 644 OD1 ASP A 61 0.821 2.151 -5.435 1.00 10.00 O ATOM 645 OD2 ASP A 61 2.166 1.498 -7.034 1.00 10.00 O ATOM 0 H ASP A 61 0.954 3.697 -8.750 1.00 10.00 H new ATOM 0 HA ASP A 61 0.210 4.719 -6.183 1.00 10.00 H new ATOM 0 HB2 ASP A 61 2.898 3.840 -7.303 1.00 10.00 H new ATOM 0 HB3 ASP A 61 2.583 4.194 -5.616 1.00 10.00 H new ATOM 650 N GLY A 62 2.392 6.402 -8.024 1.00 10.00 N ATOM 651 CA GLY A 62 2.956 7.715 -8.246 1.00 10.00 C ATOM 652 C GLY A 62 4.217 7.969 -7.448 1.00 10.00 C ATOM 653 O GLY A 62 5.297 8.139 -8.021 1.00 10.00 O ATOM 0 H GLY A 62 2.719 5.683 -8.669 1.00 10.00 H new ATOM 0 HA2 GLY A 62 3.176 7.833 -9.307 1.00 10.00 H new ATOM 0 HA3 GLY A 62 2.213 8.470 -7.988 1.00 10.00 H new ATOM 657 N THR A 63 4.099 7.985 -6.129 1.00 10.00 N ATOM 658 CA THR A 63 5.251 8.248 -5.284 1.00 10.00 C ATOM 659 C THR A 63 5.581 7.069 -4.385 1.00 10.00 C ATOM 660 O THR A 63 4.775 6.151 -4.219 1.00 10.00 O ATOM 661 CB THR A 63 5.042 9.502 -4.404 1.00 10.00 C ATOM 662 OG1 THR A 63 4.150 9.208 -3.316 1.00 10.00 O ATOM 663 CG2 THR A 63 4.486 10.661 -5.221 1.00 10.00 C ATOM 0 H THR A 63 3.227 7.821 -5.626 1.00 10.00 H new ATOM 0 HA THR A 63 6.085 8.420 -5.964 1.00 10.00 H new ATOM 0 HB THR A 63 6.014 9.793 -4.006 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.261 8.995 -3.670 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.349 11.529 -4.576 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.183 10.910 -6.021 1.00 10.00 H new ATOM 0 HG23 THR A 63 3.527 10.375 -5.652 1.00 10.00 H new ATOM 671 N LEU A 64 6.777 7.115 -3.812 1.00 10.00 N ATOM 672 CA LEU A 64 7.259 6.082 -2.909 1.00 10.00 C ATOM 673 C LEU A 64 6.313 5.922 -1.725 1.00 10.00 C ATOM 674 O LEU A 64 5.997 4.808 -1.316 1.00 10.00 O ATOM 675 CB LEU A 64 8.662 6.450 -2.414 1.00 10.00 C ATOM 676 CG LEU A 64 9.238 5.533 -1.335 1.00 10.00 C ATOM 677 CD1 LEU A 64 9.454 4.128 -1.878 1.00 10.00 C ATOM 678 CD2 LEU A 64 10.535 6.105 -0.787 1.00 10.00 C ATOM 0 H LEU A 64 7.442 7.874 -3.962 1.00 10.00 H new ATOM 0 HA LEU A 64 7.300 5.134 -3.446 1.00 10.00 H new ATOM 0 HB2 LEU A 64 9.341 6.451 -3.267 1.00 10.00 H new ATOM 0 HB3 LEU A 64 8.636 7.468 -2.026 1.00 10.00 H new ATOM 0 HG LEU A 64 8.519 5.471 -0.518 1.00 10.00 H new ATOM 0 HD11 LEU A 64 9.864 3.493 -1.092 1.00 10.00 H new ATOM 0 HD12 LEU A 64 8.502 3.718 -2.215 1.00 10.00 H new ATOM 0 HD13 LEU A 64 10.150 4.165 -2.716 1.00 10.00 H new ATOM 0 HD21 LEU A 64 10.931 5.439 -0.020 1.00 10.00 H new ATOM 0 HD22 LEU A 64 11.261 6.200 -1.595 1.00 10.00 H new ATOM 0 HD23 LEU A 64 10.345 7.086 -0.353 1.00 10.00 H new ATOM 690 N LYS A 65 5.855 7.049 -1.197 1.00 10.00 N ATOM 691 CA LYS A 65 4.949 7.055 -0.061 1.00 10.00 C ATOM 692 C LYS A 65 3.651 6.333 -0.399 1.00 10.00 C ATOM 693 O LYS A 65 3.293 5.357 0.255 1.00 10.00 O ATOM 694 CB LYS A 65 4.651 8.482 0.367 1.00 10.00 C ATOM 695 CG LYS A 65 4.052 8.556 1.754 1.00 10.00 C ATOM 696 CD LYS A 65 3.888 9.984 2.217 1.00 10.00 C ATOM 697 CE LYS A 65 3.749 10.041 3.721 1.00 10.00 C ATOM 698 NZ LYS A 65 3.260 11.366 4.184 1.00 10.00 N ATOM 0 H LYS A 65 6.100 7.977 -1.542 1.00 10.00 H new ATOM 0 HA LYS A 65 5.433 6.529 0.762 1.00 10.00 H new ATOM 0 HB2 LYS A 65 5.571 9.066 0.340 1.00 10.00 H new ATOM 0 HB3 LYS A 65 3.964 8.936 -0.347 1.00 10.00 H new ATOM 0 HG2 LYS A 65 3.082 8.059 1.758 1.00 10.00 H new ATOM 0 HG3 LYS A 65 4.690 8.017 2.455 1.00 10.00 H new ATOM 0 HD2 LYS A 65 4.748 10.575 1.903 1.00 10.00 H new ATOM 0 HD3 LYS A 65 3.009 10.426 1.748 1.00 10.00 H new ATOM 0 HE2 LYS A 65 3.059 9.264 4.051 1.00 10.00 H new ATOM 0 HE3 LYS A 65 4.713 9.829 4.183 1.00 10.00 H new ATOM 0 HZ1 LYS A 65 3.179 11.363 5.221 1.00 10.00 H new ATOM 0 HZ2 LYS A 65 3.931 12.105 3.891 1.00 10.00 H new ATOM 0 HZ3 LYS A 65 2.328 11.558 3.764 1.00 10.00 H new ATOM 712 N THR A 66 2.967 6.806 -1.438 1.00 10.00 N ATOM 713 CA THR A 66 1.703 6.208 -1.864 1.00 10.00 C ATOM 714 C THR A 66 1.875 4.724 -2.184 1.00 10.00 C ATOM 715 O THR A 66 1.011 3.905 -1.872 1.00 10.00 O ATOM 716 CB THR A 66 1.144 6.927 -3.107 1.00 10.00 C ATOM 717 OG1 THR A 66 1.700 8.247 -3.200 1.00 10.00 O ATOM 718 CG2 THR A 66 -0.376 7.014 -3.046 1.00 10.00 C ATOM 0 H THR A 66 3.267 7.602 -2.001 1.00 10.00 H new ATOM 0 HA THR A 66 1.002 6.317 -1.037 1.00 10.00 H new ATOM 0 HB THR A 66 1.423 6.351 -3.989 1.00 10.00 H new ATOM 0 HG1 THR A 66 1.342 8.698 -3.993 1.00 10.00 H new ATOM 0 HG21 THR A 66 -0.747 7.526 -3.934 1.00 10.00 H new ATOM 0 HG22 THR A 66 -0.797 6.009 -3.004 1.00 10.00 H new ATOM 0 HG23 THR A 66 -0.673 7.570 -2.157 1.00 10.00 H new ATOM 726 N MET A 67 3.006 4.390 -2.793 1.00 10.00 N ATOM 727 CA MET A 67 3.313 3.014 -3.153 1.00 10.00 C ATOM 728 C MET A 67 3.431 2.145 -1.904 1.00 10.00 C ATOM 729 O MET A 67 2.776 1.110 -1.793 1.00 10.00 O ATOM 730 CB MET A 67 4.619 2.962 -3.950 1.00 10.00 C ATOM 731 CG MET A 67 4.936 1.590 -4.513 1.00 10.00 C ATOM 732 SD MET A 67 6.603 1.490 -5.188 1.00 10.00 S ATOM 733 CE MET A 67 7.574 1.578 -3.688 1.00 10.00 C ATOM 0 H MET A 67 3.731 5.061 -3.049 1.00 10.00 H new ATOM 0 HA MET A 67 2.501 2.628 -3.769 1.00 10.00 H new ATOM 0 HB2 MET A 67 4.562 3.677 -4.771 1.00 10.00 H new ATOM 0 HB3 MET A 67 5.440 3.279 -3.307 1.00 10.00 H new ATOM 0 HG2 MET A 67 4.820 0.843 -3.728 1.00 10.00 H new ATOM 0 HG3 MET A 67 4.216 1.346 -5.294 1.00 10.00 H new ATOM 0 HE1 MET A 67 8.547 2.017 -3.910 1.00 10.00 H new ATOM 0 HE2 MET A 67 7.056 2.196 -2.955 1.00 10.00 H new ATOM 0 HE3 MET A 67 7.712 0.575 -3.285 1.00 10.00 H new ATOM 743 N LEU A 68 4.246 2.591 -0.952 1.00 10.00 N ATOM 744 CA LEU A 68 4.452 1.850 0.284 1.00 10.00 C ATOM 745 C LEU A 68 3.161 1.763 1.094 1.00 10.00 C ATOM 746 O LEU A 68 2.885 0.735 1.714 1.00 10.00 O ATOM 747 CB LEU A 68 5.558 2.492 1.118 1.00 10.00 C ATOM 748 CG LEU A 68 6.958 2.419 0.506 1.00 10.00 C ATOM 749 CD1 LEU A 68 7.937 3.239 1.329 1.00 10.00 C ATOM 750 CD2 LEU A 68 7.432 0.974 0.408 1.00 10.00 C ATOM 0 H LEU A 68 4.773 3.462 -1.015 1.00 10.00 H new ATOM 0 HA LEU A 68 4.757 0.837 0.020 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.305 3.539 1.284 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.580 2.011 2.096 1.00 10.00 H new ATOM 0 HG LEU A 68 6.912 2.833 -0.501 1.00 10.00 H new ATOM 0 HD11 LEU A 68 8.929 3.178 0.882 1.00 10.00 H new ATOM 0 HD12 LEU A 68 7.612 4.279 1.350 1.00 10.00 H new ATOM 0 HD13 LEU A 68 7.973 2.849 2.346 1.00 10.00 H new ATOM 0 HD21 LEU A 68 8.430 0.947 -0.030 1.00 10.00 H new ATOM 0 HD22 LEU A 68 7.461 0.532 1.404 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.745 0.407 -0.220 1.00 10.00 H new ATOM 762 N GLU A 69 2.370 2.836 1.077 1.00 10.00 N ATOM 763 CA GLU A 69 1.101 2.859 1.798 1.00 10.00 C ATOM 764 C GLU A 69 0.154 1.815 1.223 1.00 10.00 C ATOM 765 O GLU A 69 -0.574 1.144 1.953 1.00 10.00 O ATOM 766 CB GLU A 69 0.452 4.244 1.722 1.00 10.00 C ATOM 767 CG GLU A 69 1.182 5.307 2.523 1.00 10.00 C ATOM 768 CD GLU A 69 0.434 6.624 2.568 1.00 10.00 C ATOM 769 OE1 GLU A 69 0.180 7.210 1.495 1.00 10.00 O ATOM 770 OE2 GLU A 69 0.086 7.072 3.682 1.00 10.00 O ATOM 0 H GLU A 69 2.586 3.696 0.574 1.00 10.00 H new ATOM 0 HA GLU A 69 1.301 2.629 2.844 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.405 4.556 0.679 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.575 4.174 2.080 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.337 4.947 3.540 1.00 10.00 H new ATOM 0 HG3 GLU A 69 2.169 5.469 2.089 1.00 10.00 H new ATOM 777 N ARG A 70 0.179 1.678 -0.095 1.00 10.00 N ATOM 778 CA ARG A 70 -0.665 0.713 -0.782 1.00 10.00 C ATOM 779 C ARG A 70 -0.165 -0.708 -0.519 1.00 10.00 C ATOM 780 O ARG A 70 -0.952 -1.659 -0.466 1.00 10.00 O ATOM 781 CB ARG A 70 -0.676 1.014 -2.281 1.00 10.00 C ATOM 782 CG ARG A 70 -1.788 0.319 -3.053 1.00 10.00 C ATOM 783 CD ARG A 70 -1.263 -0.859 -3.860 1.00 10.00 C ATOM 784 NE ARG A 70 -0.168 -0.476 -4.753 1.00 10.00 N ATOM 785 CZ ARG A 70 0.566 -1.345 -5.449 1.00 10.00 C ATOM 786 NH1 ARG A 70 0.297 -2.643 -5.405 1.00 10.00 N ATOM 787 NH2 ARG A 70 1.556 -0.908 -6.214 1.00 10.00 N ATOM 0 H ARG A 70 0.778 2.226 -0.712 1.00 10.00 H new ATOM 0 HA ARG A 70 -1.684 0.791 -0.402 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -0.770 2.091 -2.422 1.00 10.00 H new ATOM 0 HB3 ARG A 70 0.284 0.719 -2.706 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -2.552 -0.028 -2.357 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -2.268 1.033 -3.722 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -0.919 -1.638 -3.180 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -2.076 -1.285 -4.448 1.00 10.00 H new ATOM 0 HE ARG A 70 0.047 0.517 -4.849 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -0.477 -2.984 -4.835 1.00 10.00 H new ATOM 0 HH12 ARG A 70 0.864 -3.300 -5.941 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.755 0.091 -6.269 1.00 10.00 H new ATOM 0 HH22 ARG A 70 2.119 -1.571 -6.747 1.00 10.00 H new ATOM 801 N TRP A 71 1.145 -0.841 -0.358 1.00 10.00 N ATOM 802 CA TRP A 71 1.764 -2.135 -0.091 1.00 10.00 C ATOM 803 C TRP A 71 1.433 -2.612 1.321 1.00 10.00 C ATOM 804 O TRP A 71 0.896 -3.705 1.514 1.00 10.00 O ATOM 805 CB TRP A 71 3.285 -2.041 -0.246 1.00 10.00 C ATOM 806 CG TRP A 71 3.766 -2.000 -1.667 1.00 10.00 C ATOM 807 CD1 TRP A 71 3.009 -1.881 -2.800 1.00 10.00 C ATOM 808 CD2 TRP A 71 5.126 -2.081 -2.103 1.00 10.00 C ATOM 809 NE1 TRP A 71 3.818 -1.882 -3.910 1.00 10.00 N ATOM 810 CE2 TRP A 71 5.123 -2.005 -3.507 1.00 10.00 C ATOM 811 CE3 TRP A 71 6.349 -2.213 -1.437 1.00 10.00 C ATOM 812 CZ2 TRP A 71 6.295 -2.055 -4.257 1.00 10.00 C ATOM 813 CZ3 TRP A 71 7.511 -2.260 -2.183 1.00 10.00 C ATOM 814 CH2 TRP A 71 7.477 -2.183 -3.580 1.00 10.00 C ATOM 0 H TRP A 71 1.804 -0.064 -0.408 1.00 10.00 H new ATOM 0 HA TRP A 71 1.368 -2.850 -0.812 1.00 10.00 H new ATOM 0 HB2 TRP A 71 3.635 -1.146 0.268 1.00 10.00 H new ATOM 0 HB3 TRP A 71 3.742 -2.895 0.254 1.00 10.00 H new ATOM 0 HD1 TRP A 71 1.932 -1.798 -2.819 1.00 10.00 H new ATOM 0 HE1 TRP A 71 3.500 -1.804 -4.876 1.00 10.00 H new ATOM 0 HE3 TRP A 71 6.384 -2.277 -0.359 1.00 10.00 H new ATOM 0 HZ2 TRP A 71 6.272 -1.995 -5.335 1.00 10.00 H new ATOM 0 HZ3 TRP A 71 8.462 -2.358 -1.680 1.00 10.00 H new ATOM 0 HH2 TRP A 71 8.403 -2.225 -4.135 1.00 10.00 H new ATOM 825 N ALA A 72 1.745 -1.765 2.299 1.00 10.00 N ATOM 826 CA ALA A 72 1.511 -2.070 3.706 1.00 10.00 C ATOM 827 C ALA A 72 0.030 -2.267 4.001 1.00 10.00 C ATOM 828 O ALA A 72 -0.330 -3.007 4.912 1.00 10.00 O ATOM 829 CB ALA A 72 2.078 -0.963 4.589 1.00 10.00 C ATOM 0 H ALA A 72 2.166 -0.850 2.138 1.00 10.00 H new ATOM 0 HA ALA A 72 2.023 -3.006 3.929 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.896 -1.204 5.636 1.00 10.00 H new ATOM 0 HB2 ALA A 72 3.151 -0.875 4.418 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.593 -0.018 4.345 1.00 10.00 H new ATOM 835 N ALA A 73 -0.821 -1.611 3.226 1.00 10.00 N ATOM 836 CA ALA A 73 -2.262 -1.709 3.415 1.00 10.00 C ATOM 837 C ALA A 73 -2.776 -3.121 3.166 1.00 10.00 C ATOM 838 O ALA A 73 -3.686 -3.590 3.851 1.00 10.00 O ATOM 839 CB ALA A 73 -2.978 -0.728 2.504 1.00 10.00 C ATOM 0 H ALA A 73 -0.538 -1.003 2.458 1.00 10.00 H new ATOM 0 HA ALA A 73 -2.472 -1.460 4.455 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -4.054 -0.811 2.654 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -2.656 0.287 2.737 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -2.738 -0.955 1.465 1.00 10.00 H new ATOM 845 N ASP A 74 -2.174 -3.807 2.204 1.00 10.00 N ATOM 846 CA ASP A 74 -2.595 -5.162 1.865 1.00 10.00 C ATOM 847 C ASP A 74 -2.260 -6.138 2.983 1.00 10.00 C ATOM 848 O ASP A 74 -3.033 -7.050 3.278 1.00 10.00 O ATOM 849 CB ASP A 74 -1.940 -5.638 0.572 1.00 10.00 C ATOM 850 CG ASP A 74 -2.510 -6.965 0.099 1.00 10.00 C ATOM 851 OD1 ASP A 74 -2.002 -8.026 0.522 1.00 10.00 O ATOM 852 OD2 ASP A 74 -3.473 -6.952 -0.697 1.00 10.00 O ATOM 0 H ASP A 74 -1.397 -3.451 1.647 1.00 10.00 H new ATOM 0 HA ASP A 74 -3.676 -5.134 1.727 1.00 10.00 H new ATOM 0 HB2 ASP A 74 -2.081 -4.886 -0.204 1.00 10.00 H new ATOM 0 HB3 ASP A 74 -0.866 -5.739 0.726 1.00 10.00 H new ATOM 857 N SER A 75 -1.114 -5.941 3.611 1.00 10.00 N ATOM 858 CA SER A 75 -0.677 -6.815 4.685 1.00 10.00 C ATOM 859 C SER A 75 -1.058 -6.252 6.055 1.00 10.00 C ATOM 860 O SER A 75 -0.656 -6.791 7.088 1.00 10.00 O ATOM 861 CB SER A 75 0.831 -7.022 4.589 1.00 10.00 C ATOM 862 OG SER A 75 1.441 -5.969 3.858 1.00 10.00 O ATOM 0 H SER A 75 -0.468 -5.182 3.395 1.00 10.00 H new ATOM 0 HA SER A 75 -1.182 -7.775 4.578 1.00 10.00 H new ATOM 0 HB2 SER A 75 1.260 -7.071 5.590 1.00 10.00 H new ATOM 0 HB3 SER A 75 1.041 -7.976 4.105 1.00 10.00 H new ATOM 0 HG SER A 75 1.831 -6.327 3.033 1.00 10.00 H new ATOM 868 N ASN A 76 -1.828 -5.164 6.048 1.00 10.00 N ATOM 869 CA ASN A 76 -2.279 -4.510 7.279 1.00 10.00 C ATOM 870 C ASN A 76 -1.085 -4.141 8.160 1.00 10.00 C ATOM 871 O ASN A 76 -1.072 -4.390 9.369 1.00 10.00 O ATOM 872 CB ASN A 76 -3.253 -5.416 8.045 1.00 10.00 C ATOM 873 CG ASN A 76 -4.051 -4.666 9.098 1.00 10.00 C ATOM 874 OD1 ASN A 76 -4.331 -3.476 8.955 1.00 10.00 O ATOM 875 ND2 ASN A 76 -4.423 -5.360 10.162 1.00 10.00 N ATOM 0 H ASN A 76 -2.156 -4.712 5.194 1.00 10.00 H new ATOM 0 HA ASN A 76 -2.803 -3.593 7.008 1.00 10.00 H new ATOM 0 HB2 ASN A 76 -3.940 -5.882 7.339 1.00 10.00 H new ATOM 0 HB3 ASN A 76 -2.694 -6.220 8.524 1.00 10.00 H new ATOM 0 HD21 ASN A 76 -4.962 -4.910 10.902 1.00 10.00 H new ATOM 0 HD22 ASN A 76 -4.170 -6.345 10.242 1.00 10.00 H new ATOM 882 N MET A 77 -0.078 -3.545 7.537 1.00 10.00 N ATOM 883 CA MET A 77 1.134 -3.139 8.232 1.00 10.00 C ATOM 884 C MET A 77 1.221 -1.622 8.300 1.00 10.00 C ATOM 885 O MET A 77 0.497 -0.918 7.595 1.00 10.00 O ATOM 886 CB MET A 77 2.369 -3.693 7.517 1.00 10.00 C ATOM 887 CG MET A 77 2.388 -5.207 7.405 1.00 10.00 C ATOM 888 SD MET A 77 4.053 -5.876 7.238 1.00 10.00 S ATOM 889 CE MET A 77 4.726 -4.811 5.965 1.00 10.00 C ATOM 0 H MET A 77 -0.078 -3.330 6.540 1.00 10.00 H new ATOM 0 HA MET A 77 1.099 -3.540 9.245 1.00 10.00 H new ATOM 0 HB2 MET A 77 2.420 -3.264 6.516 1.00 10.00 H new ATOM 0 HB3 MET A 77 3.262 -3.367 8.050 1.00 10.00 H new ATOM 0 HG2 MET A 77 1.916 -5.638 8.288 1.00 10.00 H new ATOM 0 HG3 MET A 77 1.792 -5.510 6.544 1.00 10.00 H new ATOM 0 HE1 MET A 77 5.715 -5.168 5.677 1.00 10.00 H new ATOM 0 HE2 MET A 77 4.068 -4.822 5.096 1.00 10.00 H new ATOM 0 HE3 MET A 77 4.805 -3.793 6.347 1.00 10.00 H new ATOM 899 N GLN A 78 2.105 -1.126 9.147 1.00 10.00 N ATOM 900 CA GLN A 78 2.290 0.306 9.296 1.00 10.00 C ATOM 901 C GLN A 78 3.493 0.770 8.489 1.00 10.00 C ATOM 902 O GLN A 78 4.413 -0.007 8.223 1.00 10.00 O ATOM 903 CB GLN A 78 2.475 0.668 10.770 1.00 10.00 C ATOM 904 CG GLN A 78 1.192 0.584 11.580 1.00 10.00 C ATOM 905 CD GLN A 78 0.286 1.785 11.379 1.00 10.00 C ATOM 906 OE1 GLN A 78 0.318 2.440 10.336 1.00 10.00 O ATOM 907 NE2 GLN A 78 -0.535 2.080 12.372 1.00 10.00 N ATOM 0 H GLN A 78 2.707 -1.695 9.743 1.00 10.00 H new ATOM 0 HA GLN A 78 1.400 0.811 8.921 1.00 10.00 H new ATOM 0 HB2 GLN A 78 3.217 0.001 11.209 1.00 10.00 H new ATOM 0 HB3 GLN A 78 2.874 1.680 10.840 1.00 10.00 H new ATOM 0 HG2 GLN A 78 0.653 -0.322 11.303 1.00 10.00 H new ATOM 0 HG3 GLN A 78 1.441 0.496 12.638 1.00 10.00 H new ATOM 0 HE21 GLN A 78 -0.533 1.514 13.221 1.00 10.00 H new ATOM 0 HE22 GLN A 78 -1.171 2.873 12.290 1.00 10.00 H new ATOM 916 N LEU A 79 3.482 2.034 8.104 1.00 10.00 N ATOM 917 CA LEU A 79 4.570 2.610 7.330 1.00 10.00 C ATOM 918 C LEU A 79 5.124 3.837 8.025 1.00 10.00 C ATOM 919 O LEU A 79 4.381 4.716 8.459 1.00 10.00 O ATOM 920 CB LEU A 79 4.093 2.973 5.919 1.00 10.00 C ATOM 921 CG LEU A 79 5.037 3.882 5.126 1.00 10.00 C ATOM 922 CD1 LEU A 79 6.267 3.114 4.683 1.00 10.00 C ATOM 923 CD2 LEU A 79 4.320 4.489 3.931 1.00 10.00 C ATOM 0 H LEU A 79 2.727 2.686 8.316 1.00 10.00 H new ATOM 0 HA LEU A 79 5.363 1.866 7.249 1.00 10.00 H new ATOM 0 HB2 LEU A 79 3.942 2.052 5.355 1.00 10.00 H new ATOM 0 HB3 LEU A 79 3.122 3.462 5.996 1.00 10.00 H new ATOM 0 HG LEU A 79 5.358 4.695 5.777 1.00 10.00 H new ATOM 0 HD11 LEU A 79 6.926 3.776 4.121 1.00 10.00 H new ATOM 0 HD12 LEU A 79 6.794 2.735 5.558 1.00 10.00 H new ATOM 0 HD13 LEU A 79 5.966 2.279 4.050 1.00 10.00 H new ATOM 0 HD21 LEU A 79 5.008 5.131 3.381 1.00 10.00 H new ATOM 0 HD22 LEU A 79 3.966 3.693 3.276 1.00 10.00 H new ATOM 0 HD23 LEU A 79 3.471 5.079 4.277 1.00 10.00 H new ATOM 935 N SER A 80 6.432 3.875 8.140 1.00 10.00 N ATOM 936 CA SER A 80 7.111 4.983 8.767 1.00 10.00 C ATOM 937 C SER A 80 7.936 5.745 7.734 1.00 10.00 C ATOM 938 O SER A 80 9.064 5.363 7.411 1.00 10.00 O ATOM 939 CB SER A 80 7.999 4.455 9.889 1.00 10.00 C ATOM 940 OG SER A 80 7.222 3.935 10.957 1.00 10.00 O ATOM 0 H SER A 80 7.053 3.140 7.802 1.00 10.00 H new ATOM 0 HA SER A 80 6.379 5.672 9.189 1.00 10.00 H new ATOM 0 HB2 SER A 80 8.656 3.676 9.501 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.639 5.257 10.258 1.00 10.00 H new ATOM 0 HG SER A 80 7.816 3.602 11.662 1.00 10.00 H new ATOM 946 N TYR A 81 7.354 6.814 7.209 1.00 10.00 N ATOM 947 CA TYR A 81 8.015 7.641 6.213 1.00 10.00 C ATOM 948 C TYR A 81 8.777 8.768 6.904 1.00 10.00 C ATOM 949 O TYR A 81 8.193 9.788 7.272 1.00 10.00 O ATOM 950 CB TYR A 81 6.973 8.214 5.245 1.00 10.00 C ATOM 951 CG TYR A 81 7.522 8.653 3.905 1.00 10.00 C ATOM 952 CD1 TYR A 81 7.857 7.723 2.928 1.00 10.00 C ATOM 953 CD2 TYR A 81 7.685 9.998 3.609 1.00 10.00 C ATOM 954 CE1 TYR A 81 8.344 8.124 1.696 1.00 10.00 C ATOM 955 CE2 TYR A 81 8.165 10.408 2.380 1.00 10.00 C ATOM 956 CZ TYR A 81 8.493 9.468 1.427 1.00 10.00 C ATOM 957 OH TYR A 81 8.973 9.875 0.202 1.00 10.00 O ATOM 0 H TYR A 81 6.417 7.130 7.460 1.00 10.00 H new ATOM 0 HA TYR A 81 8.723 7.035 5.648 1.00 10.00 H new ATOM 0 HB2 TYR A 81 6.202 7.462 5.077 1.00 10.00 H new ATOM 0 HB3 TYR A 81 6.488 9.067 5.720 1.00 10.00 H new ATOM 0 HD1 TYR A 81 7.735 6.670 3.134 1.00 10.00 H new ATOM 0 HD2 TYR A 81 7.432 10.739 4.353 1.00 10.00 H new ATOM 0 HE1 TYR A 81 8.606 7.388 0.950 1.00 10.00 H new ATOM 0 HE2 TYR A 81 8.283 11.460 2.167 1.00 10.00 H new ATOM 0 HH TYR A 81 9.472 10.712 0.308 1.00 10.00 H new ATOM 967 N ASN A 82 10.079 8.581 7.081 1.00 10.00 N ATOM 968 CA ASN A 82 10.910 9.577 7.747 1.00 10.00 C ATOM 969 C ASN A 82 11.702 10.397 6.737 1.00 10.00 C ATOM 970 O ASN A 82 12.811 10.852 7.020 1.00 10.00 O ATOM 971 CB ASN A 82 11.869 8.907 8.734 1.00 10.00 C ATOM 972 CG ASN A 82 11.149 8.227 9.885 1.00 10.00 C ATOM 973 OD1 ASN A 82 10.021 8.582 10.230 1.00 10.00 O ATOM 974 ND2 ASN A 82 11.799 7.248 10.491 1.00 10.00 N ATOM 0 H ASN A 82 10.583 7.749 6.773 1.00 10.00 H new ATOM 0 HA ASN A 82 10.246 10.247 8.294 1.00 10.00 H new ATOM 0 HB2 ASN A 82 12.473 8.171 8.204 1.00 10.00 H new ATOM 0 HB3 ASN A 82 12.555 9.655 9.132 1.00 10.00 H new ATOM 0 HD21 ASN A 82 11.367 6.757 11.274 1.00 10.00 H new ATOM 0 HD22 ASN A 82 12.732 6.983 10.175 1.00 10.00 H new ATOM 981 N LEU A 83 11.131 10.577 5.556 1.00 10.00 N ATOM 982 CA LEU A 83 11.783 11.349 4.515 1.00 10.00 C ATOM 983 C LEU A 83 11.249 12.773 4.510 1.00 10.00 C ATOM 984 O LEU A 83 10.077 12.997 4.816 1.00 10.00 O ATOM 985 CB LEU A 83 11.564 10.702 3.145 1.00 10.00 C ATOM 986 CG LEU A 83 12.077 9.268 3.007 1.00 10.00 C ATOM 987 CD1 LEU A 83 11.980 8.811 1.562 1.00 10.00 C ATOM 988 CD2 LEU A 83 13.510 9.156 3.499 1.00 10.00 C ATOM 0 H LEU A 83 10.220 10.199 5.297 1.00 10.00 H new ATOM 0 HA LEU A 83 12.853 11.370 4.720 1.00 10.00 H new ATOM 0 HB2 LEU A 83 10.497 10.711 2.924 1.00 10.00 H new ATOM 0 HB3 LEU A 83 12.051 11.318 2.389 1.00 10.00 H new ATOM 0 HG LEU A 83 11.453 8.622 3.624 1.00 10.00 H new ATOM 0 HD11 LEU A 83 12.348 7.789 1.478 1.00 10.00 H new ATOM 0 HD12 LEU A 83 10.940 8.850 1.237 1.00 10.00 H new ATOM 0 HD13 LEU A 83 12.582 9.466 0.932 1.00 10.00 H new ATOM 0 HD21 LEU A 83 13.852 8.127 3.391 1.00 10.00 H new ATOM 0 HD22 LEU A 83 14.149 9.815 2.911 1.00 10.00 H new ATOM 0 HD23 LEU A 83 13.558 9.446 4.549 1.00 10.00 H new ATOM 1000 N PRO A 84 12.103 13.751 4.166 1.00 10.00 N ATOM 1001 CA PRO A 84 11.720 15.167 4.125 1.00 10.00 C ATOM 1002 C PRO A 84 10.526 15.427 3.207 1.00 10.00 C ATOM 1003 O PRO A 84 9.620 16.193 3.549 1.00 10.00 O ATOM 1004 CB PRO A 84 12.974 15.874 3.585 1.00 10.00 C ATOM 1005 CG PRO A 84 13.829 14.797 3.010 1.00 10.00 C ATOM 1006 CD PRO A 84 13.517 13.557 3.795 1.00 10.00 C ATOM 0 HA PRO A 84 11.406 15.523 5.106 1.00 10.00 H new ATOM 0 HB2 PRO A 84 12.711 16.612 2.827 1.00 10.00 H new ATOM 0 HB3 PRO A 84 13.496 16.406 4.380 1.00 10.00 H new ATOM 0 HG2 PRO A 84 13.615 14.652 1.951 1.00 10.00 H new ATOM 0 HG3 PRO A 84 14.885 15.053 3.089 1.00 10.00 H new ATOM 0 HD2 PRO A 84 13.659 12.655 3.199 1.00 10.00 H new ATOM 0 HD3 PRO A 84 14.156 13.463 4.673 1.00 10.00 H new ATOM 1014 N SER A 85 10.519 14.778 2.052 1.00 10.00 N ATOM 1015 CA SER A 85 9.446 14.948 1.088 1.00 10.00 C ATOM 1016 C SER A 85 9.137 13.630 0.388 1.00 10.00 C ATOM 1017 O SER A 85 9.894 12.662 0.506 1.00 10.00 O ATOM 1018 CB SER A 85 9.836 16.008 0.057 1.00 10.00 C ATOM 1019 OG SER A 85 10.174 17.238 0.687 1.00 10.00 O ATOM 0 H SER A 85 11.248 14.127 1.760 1.00 10.00 H new ATOM 0 HA SER A 85 8.552 15.274 1.619 1.00 10.00 H new ATOM 0 HB2 SER A 85 10.682 15.653 -0.531 1.00 10.00 H new ATOM 0 HB3 SER A 85 9.010 16.166 -0.636 1.00 10.00 H new ATOM 0 HG SER A 85 10.421 17.898 0.006 1.00 10.00 H new ATOM 1025 N ASP A 86 8.017 13.597 -0.322 1.00 10.00 N ATOM 1026 CA ASP A 86 7.606 12.412 -1.058 1.00 10.00 C ATOM 1027 C ASP A 86 8.299 12.386 -2.415 1.00 10.00 C ATOM 1028 O ASP A 86 8.291 13.372 -3.152 1.00 10.00 O ATOM 1029 CB ASP A 86 6.078 12.378 -1.231 1.00 10.00 C ATOM 1030 CG ASP A 86 5.540 13.562 -2.013 1.00 10.00 C ATOM 1031 OD1 ASP A 86 5.745 14.717 -1.576 1.00 10.00 O ATOM 1032 OD2 ASP A 86 4.910 13.346 -3.070 1.00 10.00 O ATOM 0 H ASP A 86 7.374 14.384 -0.403 1.00 10.00 H new ATOM 0 HA ASP A 86 7.898 11.528 -0.492 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.797 11.456 -1.740 1.00 10.00 H new ATOM 0 HB3 ASP A 86 5.608 12.356 -0.248 1.00 10.00 H new ATOM 1037 N TYR A 87 8.921 11.264 -2.734 1.00 10.00 N ATOM 1038 CA TYR A 87 9.634 11.129 -3.996 1.00 10.00 C ATOM 1039 C TYR A 87 8.849 10.264 -4.969 1.00 10.00 C ATOM 1040 O TYR A 87 8.300 9.231 -4.581 1.00 10.00 O ATOM 1041 CB TYR A 87 11.024 10.537 -3.753 1.00 10.00 C ATOM 1042 CG TYR A 87 11.864 11.354 -2.794 1.00 10.00 C ATOM 1043 CD1 TYR A 87 12.464 12.539 -3.203 1.00 10.00 C ATOM 1044 CD2 TYR A 87 12.045 10.948 -1.480 1.00 10.00 C ATOM 1045 CE1 TYR A 87 13.220 13.295 -2.327 1.00 10.00 C ATOM 1046 CE2 TYR A 87 12.802 11.695 -0.599 1.00 10.00 C ATOM 1047 CZ TYR A 87 13.385 12.868 -1.026 1.00 10.00 C ATOM 1048 OH TYR A 87 14.127 13.621 -0.148 1.00 10.00 O ATOM 0 H TYR A 87 8.948 10.435 -2.140 1.00 10.00 H new ATOM 0 HA TYR A 87 9.746 12.119 -4.438 1.00 10.00 H new ATOM 0 HB2 TYR A 87 10.917 9.526 -3.360 1.00 10.00 H new ATOM 0 HB3 TYR A 87 11.548 10.455 -4.705 1.00 10.00 H new ATOM 0 HD1 TYR A 87 12.338 12.875 -4.222 1.00 10.00 H new ATOM 0 HD2 TYR A 87 11.586 10.032 -1.140 1.00 10.00 H new ATOM 0 HE1 TYR A 87 13.679 14.215 -2.659 1.00 10.00 H new ATOM 0 HE2 TYR A 87 12.936 11.361 0.419 1.00 10.00 H new ATOM 0 HH TYR A 87 14.061 14.568 -0.393 1.00 10.00 H new ATOM 1058 N THR A 88 8.793 10.688 -6.222 1.00 10.00 N ATOM 1059 CA THR A 88 8.072 9.949 -7.246 1.00 10.00 C ATOM 1060 C THR A 88 8.861 8.721 -7.692 1.00 10.00 C ATOM 1061 O THR A 88 10.085 8.674 -7.541 1.00 10.00 O ATOM 1062 CB THR A 88 7.772 10.838 -8.470 1.00 10.00 C ATOM 1063 OG1 THR A 88 8.859 11.748 -8.707 1.00 10.00 O ATOM 1064 CG2 THR A 88 6.486 11.625 -8.264 1.00 10.00 C ATOM 0 H THR A 88 9.240 11.543 -6.555 1.00 10.00 H new ATOM 0 HA THR A 88 7.129 9.626 -6.806 1.00 10.00 H new ATOM 0 HB THR A 88 7.652 10.187 -9.336 1.00 10.00 H new ATOM 0 HG1 THR A 88 8.655 12.304 -9.488 1.00 10.00 H new ATOM 0 HG21 THR A 88 6.295 12.245 -9.140 1.00 10.00 H new ATOM 0 HG22 THR A 88 5.656 10.934 -8.120 1.00 10.00 H new ATOM 0 HG23 THR A 88 6.585 12.261 -7.384 1.00 10.00 H new ATOM 1072 N LEU A 89 8.157 7.719 -8.209 1.00 10.00 N ATOM 1073 CA LEU A 89 8.794 6.505 -8.693 1.00 10.00 C ATOM 1074 C LEU A 89 9.828 6.843 -9.756 1.00 10.00 C ATOM 1075 O LEU A 89 9.488 7.368 -10.815 1.00 10.00 O ATOM 1076 CB LEU A 89 7.743 5.556 -9.274 1.00 10.00 C ATOM 1077 CG LEU A 89 7.025 4.647 -8.269 1.00 10.00 C ATOM 1078 CD1 LEU A 89 7.450 4.927 -6.835 1.00 10.00 C ATOM 1079 CD2 LEU A 89 5.518 4.773 -8.421 1.00 10.00 C ATOM 0 H LEU A 89 7.141 7.727 -8.303 1.00 10.00 H new ATOM 0 HA LEU A 89 9.293 6.015 -7.857 1.00 10.00 H new ATOM 0 HB2 LEU A 89 6.993 6.152 -9.794 1.00 10.00 H new ATOM 0 HB3 LEU A 89 8.225 4.927 -10.022 1.00 10.00 H new ATOM 0 HG LEU A 89 7.316 3.621 -8.492 1.00 10.00 H new ATOM 0 HD11 LEU A 89 6.915 4.259 -6.160 1.00 10.00 H new ATOM 0 HD12 LEU A 89 8.523 4.762 -6.735 1.00 10.00 H new ATOM 0 HD13 LEU A 89 7.217 5.961 -6.582 1.00 10.00 H new ATOM 0 HD21 LEU A 89 5.024 4.121 -7.700 1.00 10.00 H new ATOM 0 HD22 LEU A 89 5.219 5.806 -8.241 1.00 10.00 H new ATOM 0 HD23 LEU A 89 5.229 4.482 -9.431 1.00 10.00 H new ATOM 1091 N ILE A 90 11.087 6.549 -9.461 1.00 10.00 N ATOM 1092 CA ILE A 90 12.180 6.831 -10.385 1.00 10.00 C ATOM 1093 C ILE A 90 12.039 6.042 -11.684 1.00 10.00 C ATOM 1094 O ILE A 90 12.409 6.524 -12.753 1.00 10.00 O ATOM 1095 CB ILE A 90 13.552 6.528 -9.751 1.00 10.00 C ATOM 1096 CG1 ILE A 90 13.498 5.224 -8.952 1.00 10.00 C ATOM 1097 CG2 ILE A 90 13.992 7.686 -8.869 1.00 10.00 C ATOM 1098 CD1 ILE A 90 14.850 4.747 -8.465 1.00 10.00 C ATOM 0 H ILE A 90 11.379 6.114 -8.586 1.00 10.00 H new ATOM 0 HA ILE A 90 12.123 7.896 -10.612 1.00 10.00 H new ATOM 0 HB ILE A 90 14.286 6.406 -10.548 1.00 10.00 H new ATOM 0 HG12 ILE A 90 12.841 5.362 -8.093 1.00 10.00 H new ATOM 0 HG13 ILE A 90 13.051 4.447 -9.573 1.00 10.00 H new ATOM 0 HG21 ILE A 90 14.962 7.459 -8.428 1.00 10.00 H new ATOM 0 HG22 ILE A 90 14.070 8.592 -9.470 1.00 10.00 H new ATOM 0 HG23 ILE A 90 13.260 7.838 -8.076 1.00 10.00 H new ATOM 0 HD11 ILE A 90 14.729 3.818 -7.908 1.00 10.00 H new ATOM 0 HD12 ILE A 90 15.504 4.575 -9.319 1.00 10.00 H new ATOM 0 HD13 ILE A 90 15.291 5.504 -7.817 1.00 10.00 H new ATOM 1110 N GLY A 91 11.504 4.833 -11.587 1.00 10.00 N ATOM 1111 CA GLY A 91 11.326 4.010 -12.769 1.00 10.00 C ATOM 1112 C GLY A 91 11.582 2.536 -12.514 1.00 10.00 C ATOM 1113 O GLY A 91 10.648 1.736 -12.548 1.00 10.00 O ATOM 0 H GLY A 91 11.191 4.407 -10.715 1.00 10.00 H new ATOM 0 HA2 GLY A 91 10.310 4.137 -13.143 1.00 10.00 H new ATOM 0 HA3 GLY A 91 11.999 4.359 -13.552 1.00 10.00 H new ATOM 1117 N PRO A 92 12.845 2.149 -12.227 1.00 10.00 N ATOM 1118 CA PRO A 92 13.239 0.746 -11.973 1.00 10.00 C ATOM 1119 C PRO A 92 12.500 0.090 -10.803 1.00 10.00 C ATOM 1120 O PRO A 92 12.702 -1.091 -10.520 1.00 10.00 O ATOM 1121 CB PRO A 92 14.737 0.835 -11.659 1.00 10.00 C ATOM 1122 CG PRO A 92 14.982 2.264 -11.325 1.00 10.00 C ATOM 1123 CD PRO A 92 14.010 3.047 -12.154 1.00 10.00 C ATOM 0 HA PRO A 92 12.993 0.123 -12.833 1.00 10.00 H new ATOM 0 HB2 PRO A 92 15.004 0.185 -10.826 1.00 10.00 H new ATOM 0 HB3 PRO A 92 15.338 0.522 -12.513 1.00 10.00 H new ATOM 0 HG2 PRO A 92 14.828 2.449 -10.262 1.00 10.00 H new ATOM 0 HG3 PRO A 92 16.009 2.549 -11.553 1.00 10.00 H new ATOM 0 HD2 PRO A 92 13.758 4.000 -11.689 1.00 10.00 H new ATOM 0 HD3 PRO A 92 14.410 3.271 -13.143 1.00 10.00 H new ATOM 1131 N VAL A 93 11.653 0.857 -10.126 1.00 10.00 N ATOM 1132 CA VAL A 93 10.883 0.348 -8.998 1.00 10.00 C ATOM 1133 C VAL A 93 9.840 -0.657 -9.480 1.00 10.00 C ATOM 1134 O VAL A 93 9.567 -1.660 -8.822 1.00 10.00 O ATOM 1135 CB VAL A 93 10.166 1.483 -8.232 1.00 10.00 C ATOM 1136 CG1 VAL A 93 10.117 1.177 -6.743 1.00 10.00 C ATOM 1137 CG2 VAL A 93 10.836 2.825 -8.487 1.00 10.00 C ATOM 0 H VAL A 93 11.482 1.839 -10.341 1.00 10.00 H new ATOM 0 HA VAL A 93 11.588 -0.136 -8.322 1.00 10.00 H new ATOM 0 HB VAL A 93 9.143 1.546 -8.603 1.00 10.00 H new ATOM 0 HG11 VAL A 93 9.608 1.988 -6.221 1.00 10.00 H new ATOM 0 HG12 VAL A 93 9.575 0.245 -6.581 1.00 10.00 H new ATOM 0 HG13 VAL A 93 11.132 1.078 -6.358 1.00 10.00 H new ATOM 0 HG21 VAL A 93 10.310 3.605 -7.936 1.00 10.00 H new ATOM 0 HG22 VAL A 93 11.873 2.783 -8.155 1.00 10.00 H new ATOM 0 HG23 VAL A 93 10.805 3.051 -9.553 1.00 10.00 H new ATOM 1147 N SER A 94 9.270 -0.384 -10.648 1.00 10.00 N ATOM 1148 CA SER A 94 8.260 -1.255 -11.234 1.00 10.00 C ATOM 1149 C SER A 94 8.875 -2.551 -11.765 1.00 10.00 C ATOM 1150 O SER A 94 8.161 -3.483 -12.136 1.00 10.00 O ATOM 1151 CB SER A 94 7.528 -0.517 -12.351 1.00 10.00 C ATOM 1152 OG SER A 94 6.987 0.706 -11.874 1.00 10.00 O ATOM 0 H SER A 94 9.492 0.438 -11.210 1.00 10.00 H new ATOM 0 HA SER A 94 7.550 -1.525 -10.453 1.00 10.00 H new ATOM 0 HB2 SER A 94 8.215 -0.320 -13.174 1.00 10.00 H new ATOM 0 HB3 SER A 94 6.729 -1.145 -12.746 1.00 10.00 H new ATOM 0 HG SER A 94 6.189 0.523 -11.335 1.00 10.00 H new ATOM 1158 N ALA A 95 10.202 -2.610 -11.790 1.00 10.00 N ATOM 1159 CA ALA A 95 10.909 -3.795 -12.259 1.00 10.00 C ATOM 1160 C ALA A 95 11.058 -4.795 -11.120 1.00 10.00 C ATOM 1161 O ALA A 95 11.609 -5.886 -11.288 1.00 10.00 O ATOM 1162 CB ALA A 95 12.272 -3.412 -12.815 1.00 10.00 C ATOM 0 H ALA A 95 10.811 -1.849 -11.490 1.00 10.00 H new ATOM 0 HA ALA A 95 10.331 -4.259 -13.059 1.00 10.00 H new ATOM 0 HB1 ALA A 95 12.788 -4.307 -13.161 1.00 10.00 H new ATOM 0 HB2 ALA A 95 12.144 -2.722 -13.649 1.00 10.00 H new ATOM 0 HB3 ALA A 95 12.862 -2.932 -12.034 1.00 10.00 H new ATOM 1168 N ILE A 96 10.563 -4.404 -9.957 1.00 10.00 N ATOM 1169 CA ILE A 96 10.615 -5.236 -8.768 1.00 10.00 C ATOM 1170 C ILE A 96 9.233 -5.801 -8.469 1.00 10.00 C ATOM 1171 O ILE A 96 8.338 -5.082 -8.031 1.00 10.00 O ATOM 1172 CB ILE A 96 11.128 -4.428 -7.555 1.00 10.00 C ATOM 1173 CG1 ILE A 96 12.518 -3.867 -7.858 1.00 10.00 C ATOM 1174 CG2 ILE A 96 11.157 -5.291 -6.304 1.00 10.00 C ATOM 1175 CD1 ILE A 96 12.826 -2.576 -7.134 1.00 10.00 C ATOM 0 H ILE A 96 10.114 -3.500 -9.812 1.00 10.00 H new ATOM 0 HA ILE A 96 11.308 -6.057 -8.952 1.00 10.00 H new ATOM 0 HB ILE A 96 10.445 -3.599 -7.371 1.00 10.00 H new ATOM 0 HG12 ILE A 96 13.267 -4.612 -7.588 1.00 10.00 H new ATOM 0 HG13 ILE A 96 12.606 -3.701 -8.932 1.00 10.00 H new ATOM 0 HG21 ILE A 96 11.521 -4.701 -5.463 1.00 10.00 H new ATOM 0 HG22 ILE A 96 10.151 -5.650 -6.086 1.00 10.00 H new ATOM 0 HG23 ILE A 96 11.819 -6.142 -6.464 1.00 10.00 H new ATOM 0 HD11 ILE A 96 13.829 -2.240 -7.399 1.00 10.00 H new ATOM 0 HD12 ILE A 96 12.101 -1.815 -7.422 1.00 10.00 H new ATOM 0 HD13 ILE A 96 12.771 -2.740 -6.058 1.00 10.00 H new ATOM 1187 N SER A 97 9.053 -7.083 -8.749 1.00 10.00 N ATOM 1188 CA SER A 97 7.784 -7.745 -8.509 1.00 10.00 C ATOM 1189 C SER A 97 7.990 -8.971 -7.629 1.00 10.00 C ATOM 1190 O SER A 97 8.222 -10.076 -8.122 1.00 10.00 O ATOM 1191 CB SER A 97 7.142 -8.150 -9.835 1.00 10.00 C ATOM 1192 OG SER A 97 7.375 -7.170 -10.838 1.00 10.00 O ATOM 0 H SER A 97 9.774 -7.686 -9.144 1.00 10.00 H new ATOM 0 HA SER A 97 7.118 -7.052 -7.995 1.00 10.00 H new ATOM 0 HB2 SER A 97 7.545 -9.109 -10.159 1.00 10.00 H new ATOM 0 HB3 SER A 97 6.069 -8.285 -9.697 1.00 10.00 H new ATOM 0 HG SER A 97 7.250 -7.572 -11.723 1.00 10.00 H new ATOM 1198 N THR A 98 7.913 -8.775 -6.326 1.00 10.00 N ATOM 1199 CA THR A 98 8.107 -9.866 -5.392 1.00 10.00 C ATOM 1200 C THR A 98 6.888 -10.045 -4.498 1.00 10.00 C ATOM 1201 O THR A 98 6.129 -9.106 -4.268 1.00 10.00 O ATOM 1202 CB THR A 98 9.357 -9.628 -4.519 1.00 10.00 C ATOM 1203 OG1 THR A 98 9.652 -10.797 -3.744 1.00 10.00 O ATOM 1204 CG2 THR A 98 9.154 -8.438 -3.598 1.00 10.00 C ATOM 0 H THR A 98 7.718 -7.873 -5.892 1.00 10.00 H new ATOM 0 HA THR A 98 8.250 -10.774 -5.977 1.00 10.00 H new ATOM 0 HB THR A 98 10.197 -9.416 -5.181 1.00 10.00 H new ATOM 0 HG1 THR A 98 10.471 -11.215 -4.082 1.00 10.00 H new ATOM 0 HG21 THR A 98 10.048 -8.290 -2.993 1.00 10.00 H new ATOM 0 HG22 THR A 98 8.967 -7.545 -4.194 1.00 10.00 H new ATOM 0 HG23 THR A 98 8.301 -8.624 -2.946 1.00 10.00 H new ATOM 1212 N THR A 99 6.699 -11.260 -4.010 1.00 10.00 N ATOM 1213 CA THR A 99 5.585 -11.562 -3.134 1.00 10.00 C ATOM 1214 C THR A 99 5.993 -11.414 -1.671 1.00 10.00 C ATOM 1215 O THR A 99 5.162 -11.498 -0.765 1.00 10.00 O ATOM 1216 CB THR A 99 5.069 -12.985 -3.381 1.00 10.00 C ATOM 1217 OG1 THR A 99 6.120 -13.798 -3.923 1.00 10.00 O ATOM 1218 CG2 THR A 99 3.889 -12.972 -4.339 1.00 10.00 C ATOM 0 H THR A 99 7.307 -12.055 -4.208 1.00 10.00 H new ATOM 0 HA THR A 99 4.787 -10.852 -3.354 1.00 10.00 H new ATOM 0 HB THR A 99 4.740 -13.401 -2.429 1.00 10.00 H new ATOM 0 HG1 THR A 99 5.785 -14.706 -4.077 1.00 10.00 H new ATOM 0 HG21 THR A 99 3.539 -13.992 -4.500 1.00 10.00 H new ATOM 0 HG22 THR A 99 3.082 -12.375 -3.914 1.00 10.00 H new ATOM 0 HG23 THR A 99 4.198 -12.540 -5.291 1.00 10.00 H new ATOM 1226 N SER A 100 7.281 -11.195 -1.451 1.00 10.00 N ATOM 1227 CA SER A 100 7.811 -11.030 -0.109 1.00 10.00 C ATOM 1228 C SER A 100 8.096 -9.554 0.163 1.00 10.00 C ATOM 1229 O SER A 100 8.941 -8.947 -0.495 1.00 10.00 O ATOM 1230 CB SER A 100 9.082 -11.866 0.047 1.00 10.00 C ATOM 1231 OG SER A 100 8.937 -13.127 -0.591 1.00 10.00 O ATOM 0 H SER A 100 7.980 -11.127 -2.190 1.00 10.00 H new ATOM 0 HA SER A 100 7.075 -11.375 0.617 1.00 10.00 H new ATOM 0 HB2 SER A 100 9.929 -11.331 -0.382 1.00 10.00 H new ATOM 0 HB3 SER A 100 9.300 -12.011 1.105 1.00 10.00 H new ATOM 0 HG SER A 100 9.761 -13.646 -0.481 1.00 10.00 H new ATOM 1237 N VAL A 101 7.392 -8.978 1.134 1.00 10.00 N ATOM 1238 CA VAL A 101 7.565 -7.568 1.469 1.00 10.00 C ATOM 1239 C VAL A 101 9.000 -7.273 1.916 1.00 10.00 C ATOM 1240 O VAL A 101 9.527 -6.190 1.655 1.00 10.00 O ATOM 1241 CB VAL A 101 6.552 -7.107 2.545 1.00 10.00 C ATOM 1242 CG1 VAL A 101 6.854 -7.728 3.902 1.00 10.00 C ATOM 1243 CG2 VAL A 101 6.517 -5.590 2.636 1.00 10.00 C ATOM 0 H VAL A 101 6.698 -9.465 1.701 1.00 10.00 H new ATOM 0 HA VAL A 101 7.368 -6.998 0.561 1.00 10.00 H new ATOM 0 HB VAL A 101 5.565 -7.455 2.240 1.00 10.00 H new ATOM 0 HG11 VAL A 101 6.122 -7.381 4.632 1.00 10.00 H new ATOM 0 HG12 VAL A 101 6.803 -8.814 3.825 1.00 10.00 H new ATOM 0 HG13 VAL A 101 7.853 -7.434 4.222 1.00 10.00 H new ATOM 0 HG21 VAL A 101 5.799 -5.288 3.398 1.00 10.00 H new ATOM 0 HG22 VAL A 101 7.507 -5.219 2.902 1.00 10.00 H new ATOM 0 HG23 VAL A 101 6.221 -5.174 1.673 1.00 10.00 H new ATOM 1253 N GLN A 102 9.639 -8.244 2.563 1.00 10.00 N ATOM 1254 CA GLN A 102 11.011 -8.075 3.019 1.00 10.00 C ATOM 1255 C GLN A 102 11.954 -7.974 1.824 1.00 10.00 C ATOM 1256 O GLN A 102 12.873 -7.154 1.812 1.00 10.00 O ATOM 1257 CB GLN A 102 11.423 -9.232 3.924 1.00 10.00 C ATOM 1258 CG GLN A 102 10.764 -9.192 5.294 1.00 10.00 C ATOM 1259 CD GLN A 102 11.216 -10.324 6.193 1.00 10.00 C ATOM 1260 OE1 GLN A 102 12.208 -10.202 6.909 1.00 10.00 O ATOM 1261 NE2 GLN A 102 10.489 -11.430 6.170 1.00 10.00 N ATOM 0 H GLN A 102 9.229 -9.152 2.782 1.00 10.00 H new ATOM 0 HA GLN A 102 11.073 -7.151 3.594 1.00 10.00 H new ATOM 0 HB2 GLN A 102 11.171 -10.173 3.435 1.00 10.00 H new ATOM 0 HB3 GLN A 102 12.506 -9.218 4.049 1.00 10.00 H new ATOM 0 HG2 GLN A 102 10.990 -8.240 5.774 1.00 10.00 H new ATOM 0 HG3 GLN A 102 9.682 -9.239 5.174 1.00 10.00 H new ATOM 0 HE21 GLN A 102 9.673 -11.491 5.561 1.00 10.00 H new ATOM 0 HE22 GLN A 102 10.745 -12.221 6.761 1.00 10.00 H new ATOM 1270 N GLN A 103 11.706 -8.800 0.811 1.00 10.00 N ATOM 1271 CA GLN A 103 12.518 -8.791 -0.398 1.00 10.00 C ATOM 1272 C GLN A 103 12.354 -7.462 -1.124 1.00 10.00 C ATOM 1273 O GLN A 103 13.324 -6.893 -1.623 1.00 10.00 O ATOM 1274 CB GLN A 103 12.119 -9.940 -1.327 1.00 10.00 C ATOM 1275 CG GLN A 103 12.973 -10.031 -2.579 1.00 10.00 C ATOM 1276 CD GLN A 103 14.357 -10.579 -2.305 1.00 10.00 C ATOM 1277 OE1 GLN A 103 15.281 -9.838 -1.971 1.00 10.00 O ATOM 1278 NE2 GLN A 103 14.512 -11.885 -2.445 1.00 10.00 N ATOM 0 H GLN A 103 10.949 -9.483 0.805 1.00 10.00 H new ATOM 0 HA GLN A 103 13.562 -8.921 -0.112 1.00 10.00 H new ATOM 0 HB2 GLN A 103 12.189 -10.880 -0.780 1.00 10.00 H new ATOM 0 HB3 GLN A 103 11.075 -9.817 -1.617 1.00 10.00 H new ATOM 0 HG2 GLN A 103 12.473 -10.667 -3.309 1.00 10.00 H new ATOM 0 HG3 GLN A 103 13.061 -9.041 -3.026 1.00 10.00 H new ATOM 0 HE21 GLN A 103 13.721 -12.466 -2.724 1.00 10.00 H new ATOM 0 HE22 GLN A 103 15.423 -12.312 -2.274 1.00 10.00 H new ATOM 1287 N ALA A 104 11.115 -6.978 -1.167 1.00 10.00 N ATOM 1288 CA ALA A 104 10.800 -5.708 -1.815 1.00 10.00 C ATOM 1289 C ALA A 104 11.650 -4.584 -1.233 1.00 10.00 C ATOM 1290 O ALA A 104 12.314 -3.850 -1.966 1.00 10.00 O ATOM 1291 CB ALA A 104 9.321 -5.390 -1.657 1.00 10.00 C ATOM 0 H ALA A 104 10.308 -7.450 -0.758 1.00 10.00 H new ATOM 0 HA ALA A 104 11.028 -5.795 -2.877 1.00 10.00 H new ATOM 0 HB1 ALA A 104 9.099 -4.441 -2.144 1.00 10.00 H new ATOM 0 HB2 ALA A 104 8.728 -6.181 -2.116 1.00 10.00 H new ATOM 0 HB3 ALA A 104 9.075 -5.320 -0.597 1.00 10.00 H new ATOM 1297 N ALA A 105 11.647 -4.472 0.091 1.00 10.00 N ATOM 1298 CA ALA A 105 12.422 -3.442 0.776 1.00 10.00 C ATOM 1299 C ALA A 105 13.915 -3.626 0.519 1.00 10.00 C ATOM 1300 O ALA A 105 14.674 -2.657 0.441 1.00 10.00 O ATOM 1301 CB ALA A 105 12.133 -3.470 2.269 1.00 10.00 C ATOM 0 H ALA A 105 11.116 -5.082 0.712 1.00 10.00 H new ATOM 0 HA ALA A 105 12.126 -2.470 0.380 1.00 10.00 H new ATOM 0 HB1 ALA A 105 12.718 -2.697 2.767 1.00 10.00 H new ATOM 0 HB2 ALA A 105 11.072 -3.288 2.438 1.00 10.00 H new ATOM 0 HB3 ALA A 105 12.402 -4.446 2.673 1.00 10.00 H new ATOM 1307 N THR A 106 14.324 -4.877 0.369 1.00 10.00 N ATOM 1308 CA THR A 106 15.715 -5.205 0.112 1.00 10.00 C ATOM 1309 C THR A 106 16.142 -4.695 -1.266 1.00 10.00 C ATOM 1310 O THR A 106 17.166 -4.021 -1.404 1.00 10.00 O ATOM 1311 CB THR A 106 15.933 -6.731 0.191 1.00 10.00 C ATOM 1312 OG1 THR A 106 15.537 -7.217 1.482 1.00 10.00 O ATOM 1313 CG2 THR A 106 17.386 -7.098 -0.067 1.00 10.00 C ATOM 0 H THR A 106 13.705 -5.686 0.422 1.00 10.00 H new ATOM 0 HA THR A 106 16.324 -4.718 0.874 1.00 10.00 H new ATOM 0 HB THR A 106 15.320 -7.196 -0.581 1.00 10.00 H new ATOM 0 HG1 THR A 106 14.561 -7.296 1.516 1.00 10.00 H new ATOM 0 HG21 THR A 106 17.505 -8.180 -0.004 1.00 10.00 H new ATOM 0 HG22 THR A 106 17.676 -6.758 -1.061 1.00 10.00 H new ATOM 0 HG23 THR A 106 18.020 -6.619 0.679 1.00 10.00 H new ATOM 1321 N GLU A 107 15.334 -5.001 -2.275 1.00 10.00 N ATOM 1322 CA GLU A 107 15.617 -4.589 -3.644 1.00 10.00 C ATOM 1323 C GLU A 107 15.460 -3.081 -3.814 1.00 10.00 C ATOM 1324 O GLU A 107 16.222 -2.450 -4.548 1.00 10.00 O ATOM 1325 CB GLU A 107 14.695 -5.328 -4.616 1.00 10.00 C ATOM 1326 CG GLU A 107 14.928 -6.829 -4.646 1.00 10.00 C ATOM 1327 CD GLU A 107 14.285 -7.500 -5.841 1.00 10.00 C ATOM 1328 OE1 GLU A 107 14.786 -7.316 -6.970 1.00 10.00 O ATOM 1329 OE2 GLU A 107 13.287 -8.227 -5.658 1.00 10.00 O ATOM 0 H GLU A 107 14.472 -5.537 -2.169 1.00 10.00 H new ATOM 0 HA GLU A 107 16.653 -4.845 -3.866 1.00 10.00 H new ATOM 0 HB2 GLU A 107 13.658 -5.134 -4.340 1.00 10.00 H new ATOM 0 HB3 GLU A 107 14.839 -4.925 -5.619 1.00 10.00 H new ATOM 0 HG2 GLU A 107 16.000 -7.025 -4.659 1.00 10.00 H new ATOM 0 HG3 GLU A 107 14.534 -7.271 -3.731 1.00 10.00 H new ATOM 1336 N LEU A 108 14.471 -2.510 -3.137 1.00 10.00 N ATOM 1337 CA LEU A 108 14.222 -1.077 -3.215 1.00 10.00 C ATOM 1338 C LEU A 108 15.421 -0.287 -2.706 1.00 10.00 C ATOM 1339 O LEU A 108 15.894 0.626 -3.372 1.00 10.00 O ATOM 1340 CB LEU A 108 12.979 -0.695 -2.411 1.00 10.00 C ATOM 1341 CG LEU A 108 11.730 -0.378 -3.238 1.00 10.00 C ATOM 1342 CD1 LEU A 108 11.201 -1.622 -3.928 1.00 10.00 C ATOM 1343 CD2 LEU A 108 10.657 0.234 -2.354 1.00 10.00 C ATOM 0 H LEU A 108 13.829 -3.018 -2.528 1.00 10.00 H new ATOM 0 HA LEU A 108 14.056 -0.830 -4.263 1.00 10.00 H new ATOM 0 HB2 LEU A 108 12.744 -1.512 -1.729 1.00 10.00 H new ATOM 0 HB3 LEU A 108 13.217 0.174 -1.798 1.00 10.00 H new ATOM 0 HG LEU A 108 12.006 0.342 -4.008 1.00 10.00 H new ATOM 0 HD11 LEU A 108 10.314 -1.367 -4.508 1.00 10.00 H new ATOM 0 HD12 LEU A 108 11.966 -2.023 -4.593 1.00 10.00 H new ATOM 0 HD13 LEU A 108 10.942 -2.371 -3.180 1.00 10.00 H new ATOM 0 HD21 LEU A 108 9.774 0.455 -2.954 1.00 10.00 H new ATOM 0 HD22 LEU A 108 10.392 -0.468 -1.564 1.00 10.00 H new ATOM 0 HD23 LEU A 108 11.034 1.155 -1.910 1.00 10.00 H new ATOM 1355 N SER A 109 15.918 -0.654 -1.532 1.00 10.00 N ATOM 1356 CA SER A 109 17.064 0.021 -0.937 1.00 10.00 C ATOM 1357 C SER A 109 18.292 -0.051 -1.839 1.00 10.00 C ATOM 1358 O SER A 109 19.119 0.853 -1.833 1.00 10.00 O ATOM 1359 CB SER A 109 17.383 -0.598 0.417 1.00 10.00 C ATOM 1360 OG SER A 109 16.236 -0.593 1.243 1.00 10.00 O ATOM 0 H SER A 109 15.543 -1.419 -0.971 1.00 10.00 H new ATOM 0 HA SER A 109 16.803 1.072 -0.811 1.00 10.00 H new ATOM 0 HB2 SER A 109 17.738 -1.620 0.282 1.00 10.00 H new ATOM 0 HB3 SER A 109 18.188 -0.042 0.898 1.00 10.00 H new ATOM 0 HG SER A 109 15.657 -1.347 1.003 1.00 10.00 H new ATOM 1366 N ALA A 110 18.396 -1.120 -2.618 1.00 10.00 N ATOM 1367 CA ALA A 110 19.529 -1.296 -3.514 1.00 10.00 C ATOM 1368 C ALA A 110 19.550 -0.218 -4.595 1.00 10.00 C ATOM 1369 O ALA A 110 20.581 0.404 -4.847 1.00 10.00 O ATOM 1370 CB ALA A 110 19.492 -2.682 -4.141 1.00 10.00 C ATOM 0 H ALA A 110 17.711 -1.875 -2.647 1.00 10.00 H new ATOM 0 HA ALA A 110 20.444 -1.199 -2.929 1.00 10.00 H new ATOM 0 HB1 ALA A 110 20.345 -2.802 -4.809 1.00 10.00 H new ATOM 0 HB2 ALA A 110 19.537 -3.438 -3.357 1.00 10.00 H new ATOM 0 HB3 ALA A 110 18.568 -2.801 -4.707 1.00 10.00 H new ATOM 1376 N VAL A 111 18.400 0.017 -5.213 1.00 10.00 N ATOM 1377 CA VAL A 111 18.296 1.017 -6.271 1.00 10.00 C ATOM 1378 C VAL A 111 18.127 2.426 -5.692 1.00 10.00 C ATOM 1379 O VAL A 111 18.669 3.402 -6.219 1.00 10.00 O ATOM 1380 CB VAL A 111 17.122 0.691 -7.234 1.00 10.00 C ATOM 1381 CG1 VAL A 111 15.818 0.484 -6.480 1.00 10.00 C ATOM 1382 CG2 VAL A 111 16.965 1.773 -8.289 1.00 10.00 C ATOM 0 H VAL A 111 17.528 -0.469 -5.002 1.00 10.00 H new ATOM 0 HA VAL A 111 19.227 0.989 -6.836 1.00 10.00 H new ATOM 0 HB VAL A 111 17.366 -0.245 -7.736 1.00 10.00 H new ATOM 0 HG11 VAL A 111 15.020 0.258 -7.188 1.00 10.00 H new ATOM 0 HG12 VAL A 111 15.929 -0.345 -5.782 1.00 10.00 H new ATOM 0 HG13 VAL A 111 15.568 1.391 -5.929 1.00 10.00 H new ATOM 0 HG21 VAL A 111 16.136 1.519 -8.950 1.00 10.00 H new ATOM 0 HG22 VAL A 111 16.763 2.728 -7.804 1.00 10.00 H new ATOM 0 HG23 VAL A 111 17.883 1.849 -8.872 1.00 10.00 H new ATOM 1392 N TYR A 112 17.403 2.515 -4.589 1.00 10.00 N ATOM 1393 CA TYR A 112 17.132 3.790 -3.934 1.00 10.00 C ATOM 1394 C TYR A 112 18.361 4.360 -3.239 1.00 10.00 C ATOM 1395 O TYR A 112 18.430 5.563 -2.989 1.00 10.00 O ATOM 1396 CB TYR A 112 15.975 3.645 -2.956 1.00 10.00 C ATOM 1397 CG TYR A 112 14.630 3.813 -3.621 1.00 10.00 C ATOM 1398 CD1 TYR A 112 14.426 3.381 -4.924 1.00 10.00 C ATOM 1399 CD2 TYR A 112 13.572 4.414 -2.958 1.00 10.00 C ATOM 1400 CE1 TYR A 112 13.209 3.534 -5.547 1.00 10.00 C ATOM 1401 CE2 TYR A 112 12.350 4.576 -3.574 1.00 10.00 C ATOM 1402 CZ TYR A 112 12.170 4.135 -4.868 1.00 10.00 C ATOM 1403 OH TYR A 112 10.951 4.302 -5.488 1.00 10.00 O ATOM 0 H TYR A 112 16.986 1.710 -4.121 1.00 10.00 H new ATOM 0 HA TYR A 112 16.854 4.501 -4.711 1.00 10.00 H new ATOM 0 HB2 TYR A 112 16.023 2.663 -2.484 1.00 10.00 H new ATOM 0 HB3 TYR A 112 16.079 4.385 -2.163 1.00 10.00 H new ATOM 0 HD1 TYR A 112 15.240 2.915 -5.460 1.00 10.00 H new ATOM 0 HD2 TYR A 112 13.707 4.760 -1.944 1.00 10.00 H new ATOM 0 HE1 TYR A 112 13.068 3.186 -6.560 1.00 10.00 H new ATOM 0 HE2 TYR A 112 11.535 5.047 -3.044 1.00 10.00 H new ATOM 0 HH TYR A 112 10.328 4.741 -4.872 1.00 10.00 H new ATOM 1413 N ALA A 113 19.300 3.494 -2.887 1.00 10.00 N ATOM 1414 CA ALA A 113 20.536 3.911 -2.226 1.00 10.00 C ATOM 1415 C ALA A 113 21.233 5.045 -2.982 1.00 10.00 C ATOM 1416 O ALA A 113 21.885 5.890 -2.373 1.00 10.00 O ATOM 1417 CB ALA A 113 21.478 2.729 -2.084 1.00 10.00 C ATOM 0 H ALA A 113 19.232 2.489 -3.048 1.00 10.00 H new ATOM 0 HA ALA A 113 20.269 4.285 -1.238 1.00 10.00 H new ATOM 0 HB1 ALA A 113 22.395 3.052 -1.591 1.00 10.00 H new ATOM 0 HB2 ALA A 113 20.999 1.952 -1.488 1.00 10.00 H new ATOM 0 HB3 ALA A 113 21.717 2.334 -3.071 1.00 10.00 H new ATOM 1423 N ALA A 114 21.085 5.066 -4.305 1.00 10.00 N ATOM 1424 CA ALA A 114 21.699 6.100 -5.132 1.00 10.00 C ATOM 1425 C ALA A 114 20.941 7.419 -5.022 1.00 10.00 C ATOM 1426 O ALA A 114 21.478 8.487 -5.310 1.00 10.00 O ATOM 1427 CB ALA A 114 21.747 5.657 -6.585 1.00 10.00 C ATOM 0 H ALA A 114 20.544 4.377 -4.827 1.00 10.00 H new ATOM 0 HA ALA A 114 22.715 6.255 -4.768 1.00 10.00 H new ATOM 0 HB1 ALA A 114 22.208 6.439 -7.189 1.00 10.00 H new ATOM 0 HB2 ALA A 114 22.334 4.742 -6.667 1.00 10.00 H new ATOM 0 HB3 ALA A 114 20.734 5.472 -6.943 1.00 10.00 H new ATOM 1433 N GLN A 115 19.689 7.336 -4.599 1.00 10.00 N ATOM 1434 CA GLN A 115 18.846 8.516 -4.458 1.00 10.00 C ATOM 1435 C GLN A 115 18.894 9.036 -3.025 1.00 10.00 C ATOM 1436 O GLN A 115 18.362 10.105 -2.718 1.00 10.00 O ATOM 1437 CB GLN A 115 17.398 8.186 -4.841 1.00 10.00 C ATOM 1438 CG GLN A 115 17.270 7.174 -5.976 1.00 10.00 C ATOM 1439 CD GLN A 115 17.902 7.639 -7.277 1.00 10.00 C ATOM 1440 OE1 GLN A 115 17.847 8.933 -7.539 1.00 10.00 O flip ATOM 1441 NE2 GLN A 115 18.427 6.835 -8.046 1.00 10.00 N flip ATOM 0 H GLN A 115 19.232 6.460 -4.346 1.00 10.00 H new ATOM 0 HA GLN A 115 19.223 9.289 -5.128 1.00 10.00 H new ATOM 0 HB2 GLN A 115 16.880 7.799 -3.963 1.00 10.00 H new ATOM 0 HB3 GLN A 115 16.891 9.107 -5.130 1.00 10.00 H new ATOM 0 HG2 GLN A 115 17.735 6.237 -5.670 1.00 10.00 H new ATOM 0 HG3 GLN A 115 16.214 6.965 -6.149 1.00 10.00 H new ATOM 0 HE21 GLN A 115 18.450 5.843 -7.809 1.00 10.00 H new ATOM 0 HE22 GLN A 115 18.839 7.160 -8.920 1.00 10.00 H new ATOM 1450 N GLY A 116 19.529 8.261 -2.152 1.00 10.00 N ATOM 1451 CA GLY A 116 19.643 8.643 -0.759 1.00 10.00 C ATOM 1452 C GLY A 116 18.494 8.116 0.080 1.00 10.00 C ATOM 1453 O GLY A 116 18.184 8.669 1.136 1.00 10.00 O ATOM 0 H GLY A 116 19.968 7.371 -2.387 1.00 10.00 H new ATOM 0 HA2 GLY A 116 20.584 8.268 -0.358 1.00 10.00 H new ATOM 0 HA3 GLY A 116 19.675 9.730 -0.684 1.00 10.00 H new ATOM 1457 N VAL A 117 17.875 7.033 -0.373 1.00 10.00 N ATOM 1458 CA VAL A 117 16.746 6.442 0.337 1.00 10.00 C ATOM 1459 C VAL A 117 16.985 4.957 0.606 1.00 10.00 C ATOM 1460 O VAL A 117 17.573 4.257 -0.214 1.00 10.00 O ATOM 1461 CB VAL A 117 15.428 6.599 -0.464 1.00 10.00 C ATOM 1462 CG1 VAL A 117 14.250 6.022 0.308 1.00 10.00 C ATOM 1463 CG2 VAL A 117 15.168 8.059 -0.808 1.00 10.00 C ATOM 0 H VAL A 117 18.136 6.545 -1.230 1.00 10.00 H new ATOM 0 HA VAL A 117 16.654 6.975 1.284 1.00 10.00 H new ATOM 0 HB VAL A 117 15.538 6.041 -1.394 1.00 10.00 H new ATOM 0 HG11 VAL A 117 13.337 6.145 -0.275 1.00 10.00 H new ATOM 0 HG12 VAL A 117 14.422 4.962 0.495 1.00 10.00 H new ATOM 0 HG13 VAL A 117 14.146 6.546 1.258 1.00 10.00 H new ATOM 0 HG21 VAL A 117 14.237 8.140 -1.370 1.00 10.00 H new ATOM 0 HG22 VAL A 117 15.090 8.641 0.110 1.00 10.00 H new ATOM 0 HG23 VAL A 117 15.991 8.443 -1.411 1.00 10.00 H new ATOM 1473 N SER A 118 16.563 4.497 1.770 1.00 10.00 N ATOM 1474 CA SER A 118 16.695 3.101 2.138 1.00 10.00 C ATOM 1475 C SER A 118 15.451 2.653 2.904 1.00 10.00 C ATOM 1476 O SER A 118 14.924 3.398 3.730 1.00 10.00 O ATOM 1477 CB SER A 118 17.974 2.895 2.948 1.00 10.00 C ATOM 1478 OG SER A 118 19.103 2.972 2.096 1.00 10.00 O ATOM 0 H SER A 118 16.122 5.078 2.483 1.00 10.00 H new ATOM 0 HA SER A 118 16.773 2.485 1.242 1.00 10.00 H new ATOM 0 HB2 SER A 118 18.045 3.651 3.730 1.00 10.00 H new ATOM 0 HB3 SER A 118 17.948 1.925 3.445 1.00 10.00 H new ATOM 0 HG SER A 118 18.817 3.238 1.197 1.00 10.00 H new ATOM 1484 N VAL A 119 14.969 1.449 2.616 1.00 10.00 N ATOM 1485 CA VAL A 119 13.761 0.936 3.259 1.00 10.00 C ATOM 1486 C VAL A 119 13.984 -0.446 3.868 1.00 10.00 C ATOM 1487 O VAL A 119 14.843 -1.206 3.425 1.00 10.00 O ATOM 1488 CB VAL A 119 12.583 0.854 2.260 1.00 10.00 C ATOM 1489 CG1 VAL A 119 12.053 2.239 1.934 1.00 10.00 C ATOM 1490 CG2 VAL A 119 12.999 0.142 0.984 1.00 10.00 C ATOM 0 H VAL A 119 15.394 0.810 1.944 1.00 10.00 H new ATOM 0 HA VAL A 119 13.516 1.640 4.055 1.00 10.00 H new ATOM 0 HB VAL A 119 11.788 0.279 2.734 1.00 10.00 H new ATOM 0 HG11 VAL A 119 11.225 2.155 1.230 1.00 10.00 H new ATOM 0 HG12 VAL A 119 11.705 2.720 2.848 1.00 10.00 H new ATOM 0 HG13 VAL A 119 12.848 2.838 1.490 1.00 10.00 H new ATOM 0 HG21 VAL A 119 12.152 0.098 0.299 1.00 10.00 H new ATOM 0 HG22 VAL A 119 13.818 0.686 0.514 1.00 10.00 H new ATOM 0 HG23 VAL A 119 13.326 -0.870 1.222 1.00 10.00 H new ATOM 1500 N SER A 120 13.217 -0.762 4.898 1.00 10.00 N ATOM 1501 CA SER A 120 13.311 -2.056 5.558 1.00 10.00 C ATOM 1502 C SER A 120 11.988 -2.406 6.220 1.00 10.00 C ATOM 1503 O SER A 120 11.168 -1.527 6.482 1.00 10.00 O ATOM 1504 CB SER A 120 14.422 -2.045 6.611 1.00 10.00 C ATOM 1505 OG SER A 120 15.682 -1.746 6.031 1.00 10.00 O ATOM 0 H SER A 120 12.518 -0.137 5.298 1.00 10.00 H new ATOM 0 HA SER A 120 13.547 -2.806 4.803 1.00 10.00 H new ATOM 0 HB2 SER A 120 14.190 -1.308 7.380 1.00 10.00 H new ATOM 0 HB3 SER A 120 14.468 -3.016 7.104 1.00 10.00 H new ATOM 0 HG SER A 120 15.585 -1.669 5.059 1.00 10.00 H new ATOM 1511 N VAL A 121 11.777 -3.686 6.473 1.00 10.00 N ATOM 1512 CA VAL A 121 10.564 -4.140 7.126 1.00 10.00 C ATOM 1513 C VAL A 121 10.929 -4.694 8.490 1.00 10.00 C ATOM 1514 O VAL A 121 11.633 -5.697 8.590 1.00 10.00 O ATOM 1515 CB VAL A 121 9.836 -5.234 6.319 1.00 10.00 C ATOM 1516 CG1 VAL A 121 8.418 -5.431 6.838 1.00 10.00 C ATOM 1517 CG2 VAL A 121 9.838 -4.913 4.833 1.00 10.00 C ATOM 0 H VAL A 121 12.433 -4.430 6.235 1.00 10.00 H new ATOM 0 HA VAL A 121 9.888 -3.289 7.209 1.00 10.00 H new ATOM 0 HB VAL A 121 10.378 -6.170 6.453 1.00 10.00 H new ATOM 0 HG11 VAL A 121 7.922 -6.207 6.255 1.00 10.00 H new ATOM 0 HG12 VAL A 121 8.452 -5.730 7.886 1.00 10.00 H new ATOM 0 HG13 VAL A 121 7.864 -4.497 6.745 1.00 10.00 H new ATOM 0 HG21 VAL A 121 9.318 -5.702 4.290 1.00 10.00 H new ATOM 0 HG22 VAL A 121 9.332 -3.962 4.665 1.00 10.00 H new ATOM 0 HG23 VAL A 121 10.866 -4.844 4.477 1.00 10.00 H new ATOM 1527 N SER A 122 10.462 -4.042 9.536 1.00 10.00 N ATOM 1528 CA SER A 122 10.775 -4.471 10.884 1.00 10.00 C ATOM 1529 C SER A 122 9.520 -4.525 11.749 1.00 10.00 C ATOM 1530 O SER A 122 8.872 -3.503 11.975 1.00 10.00 O ATOM 1531 CB SER A 122 11.816 -3.522 11.483 1.00 10.00 C ATOM 1532 OG SER A 122 12.909 -3.352 10.593 1.00 10.00 O ATOM 0 H SER A 122 9.866 -3.216 9.479 1.00 10.00 H new ATOM 0 HA SER A 122 11.186 -5.480 10.852 1.00 10.00 H new ATOM 0 HB2 SER A 122 11.357 -2.556 11.692 1.00 10.00 H new ATOM 0 HB3 SER A 122 12.173 -3.918 12.434 1.00 10.00 H new ATOM 0 HG SER A 122 13.564 -2.741 10.992 1.00 10.00 H new ATOM 1538 N ALA A 123 9.175 -5.732 12.198 1.00 10.00 N ATOM 1539 CA ALA A 123 8.008 -5.956 13.050 1.00 10.00 C ATOM 1540 C ALA A 123 6.722 -5.527 12.346 1.00 10.00 C ATOM 1541 O ALA A 123 5.923 -4.764 12.896 1.00 10.00 O ATOM 1542 CB ALA A 123 8.163 -5.237 14.389 1.00 10.00 C ATOM 0 H ALA A 123 9.697 -6.581 11.981 1.00 10.00 H new ATOM 0 HA ALA A 123 7.940 -7.026 13.248 1.00 10.00 H new ATOM 0 HB1 ALA A 123 7.282 -5.419 15.004 1.00 10.00 H new ATOM 0 HB2 ALA A 123 9.048 -5.612 14.903 1.00 10.00 H new ATOM 0 HB3 ALA A 123 8.270 -4.166 14.217 1.00 10.00 H new ATOM 1548 N ASN A 124 6.537 -6.030 11.123 1.00 10.00 N ATOM 1549 CA ASN A 124 5.358 -5.722 10.309 1.00 10.00 C ATOM 1550 C ASN A 124 5.186 -4.220 10.143 1.00 10.00 C ATOM 1551 O ASN A 124 4.071 -3.696 10.148 1.00 10.00 O ATOM 1552 CB ASN A 124 4.093 -6.330 10.919 1.00 10.00 C ATOM 1553 CG ASN A 124 4.112 -7.843 10.896 1.00 10.00 C ATOM 1554 OD1 ASN A 124 4.443 -8.484 11.895 1.00 10.00 O ATOM 1555 ND2 ASN A 124 3.772 -8.426 9.757 1.00 10.00 N ATOM 0 H ASN A 124 7.198 -6.661 10.670 1.00 10.00 H new ATOM 0 HA ASN A 124 5.515 -6.165 9.325 1.00 10.00 H new ATOM 0 HB2 ASN A 124 3.988 -5.986 11.948 1.00 10.00 H new ATOM 0 HB3 ASN A 124 3.221 -5.972 10.372 1.00 10.00 H new ATOM 0 HD21 ASN A 124 3.778 -9.443 9.683 1.00 10.00 H new ATOM 0 HD22 ASN A 124 3.504 -7.858 8.953 1.00 10.00 H new ATOM 1562 N LYS A 125 6.300 -3.535 9.993 1.00 10.00 N ATOM 1563 CA LYS A 125 6.304 -2.100 9.825 1.00 10.00 C ATOM 1564 C LYS A 125 7.369 -1.720 8.814 1.00 10.00 C ATOM 1565 O LYS A 125 8.500 -2.203 8.883 1.00 10.00 O ATOM 1566 CB LYS A 125 6.586 -1.420 11.164 1.00 10.00 C ATOM 1567 CG LYS A 125 6.395 0.085 11.154 1.00 10.00 C ATOM 1568 CD LYS A 125 6.798 0.684 12.492 1.00 10.00 C ATOM 1569 CE LYS A 125 5.752 1.649 13.022 1.00 10.00 C ATOM 1570 NZ LYS A 125 5.689 1.618 14.507 1.00 10.00 N ATOM 0 H LYS A 125 7.228 -3.959 9.984 1.00 10.00 H new ATOM 0 HA LYS A 125 5.329 -1.772 9.465 1.00 10.00 H new ATOM 0 HB2 LYS A 125 5.933 -1.852 11.922 1.00 10.00 H new ATOM 0 HB3 LYS A 125 7.611 -1.642 11.462 1.00 10.00 H new ATOM 0 HG2 LYS A 125 6.992 0.528 10.357 1.00 10.00 H new ATOM 0 HG3 LYS A 125 5.353 0.323 10.942 1.00 10.00 H new ATOM 0 HD2 LYS A 125 6.952 -0.116 13.216 1.00 10.00 H new ATOM 0 HD3 LYS A 125 7.750 1.204 12.384 1.00 10.00 H new ATOM 0 HE2 LYS A 125 5.984 2.660 12.687 1.00 10.00 H new ATOM 0 HE3 LYS A 125 4.776 1.393 12.609 1.00 10.00 H new ATOM 0 HZ1 LYS A 125 4.965 2.288 14.838 1.00 10.00 H new ATOM 0 HZ2 LYS A 125 5.443 0.658 14.824 1.00 10.00 H new ATOM 0 HZ3 LYS A 125 6.614 1.886 14.899 1.00 10.00 H new ATOM 1584 N LEU A 126 7.006 -0.886 7.866 1.00 10.00 N ATOM 1585 CA LEU A 126 7.948 -0.451 6.855 1.00 10.00 C ATOM 1586 C LEU A 126 8.671 0.791 7.344 1.00 10.00 C ATOM 1587 O LEU A 126 8.047 1.803 7.659 1.00 10.00 O ATOM 1588 CB LEU A 126 7.233 -0.175 5.533 1.00 10.00 C ATOM 1589 CG LEU A 126 6.507 -1.382 4.930 1.00 10.00 C ATOM 1590 CD1 LEU A 126 5.814 -0.990 3.636 1.00 10.00 C ATOM 1591 CD2 LEU A 126 7.481 -2.528 4.690 1.00 10.00 C ATOM 0 H LEU A 126 6.069 -0.495 7.772 1.00 10.00 H new ATOM 0 HA LEU A 126 8.676 -1.243 6.679 1.00 10.00 H new ATOM 0 HB2 LEU A 126 6.510 0.626 5.688 1.00 10.00 H new ATOM 0 HB3 LEU A 126 7.963 0.190 4.811 1.00 10.00 H new ATOM 0 HG LEU A 126 5.751 -1.720 5.639 1.00 10.00 H new ATOM 0 HD11 LEU A 126 5.303 -1.858 3.220 1.00 10.00 H new ATOM 0 HD12 LEU A 126 5.088 -0.203 3.836 1.00 10.00 H new ATOM 0 HD13 LEU A 126 6.554 -0.628 2.922 1.00 10.00 H new ATOM 0 HD21 LEU A 126 6.947 -3.376 4.262 1.00 10.00 H new ATOM 0 HD22 LEU A 126 8.261 -2.204 4.000 1.00 10.00 H new ATOM 0 HD23 LEU A 126 7.934 -2.825 5.636 1.00 10.00 H new ATOM 1603 N LEU A 127 9.984 0.705 7.417 1.00 10.00 N ATOM 1604 CA LEU A 127 10.794 1.812 7.886 1.00 10.00 C ATOM 1605 C LEU A 127 11.558 2.446 6.743 1.00 10.00 C ATOM 1606 O LEU A 127 12.400 1.805 6.112 1.00 10.00 O ATOM 1607 CB LEU A 127 11.787 1.344 8.953 1.00 10.00 C ATOM 1608 CG LEU A 127 11.385 1.592 10.412 1.00 10.00 C ATOM 1609 CD1 LEU A 127 11.291 3.081 10.699 1.00 10.00 C ATOM 1610 CD2 LEU A 127 10.070 0.898 10.736 1.00 10.00 C ATOM 0 H LEU A 127 10.516 -0.125 7.156 1.00 10.00 H new ATOM 0 HA LEU A 127 10.119 2.550 8.319 1.00 10.00 H new ATOM 0 HB2 LEU A 127 11.952 0.275 8.821 1.00 10.00 H new ATOM 0 HB3 LEU A 127 12.741 1.839 8.772 1.00 10.00 H new ATOM 0 HG LEU A 127 12.159 1.170 11.053 1.00 10.00 H new ATOM 0 HD11 LEU A 127 11.005 3.234 11.740 1.00 10.00 H new ATOM 0 HD12 LEU A 127 12.259 3.548 10.517 1.00 10.00 H new ATOM 0 HD13 LEU A 127 10.542 3.531 10.047 1.00 10.00 H new ATOM 0 HD21 LEU A 127 9.805 1.088 11.776 1.00 10.00 H new ATOM 0 HD22 LEU A 127 9.285 1.284 10.085 1.00 10.00 H new ATOM 0 HD23 LEU A 127 10.177 -0.175 10.579 1.00 10.00 H new ATOM 1622 N VAL A 128 11.247 3.692 6.460 1.00 10.00 N ATOM 1623 CA VAL A 128 11.937 4.416 5.415 1.00 10.00 C ATOM 1624 C VAL A 128 12.927 5.363 6.065 1.00 10.00 C ATOM 1625 O VAL A 128 12.535 6.258 6.815 1.00 10.00 O ATOM 1626 CB VAL A 128 10.965 5.225 4.532 1.00 10.00 C ATOM 1627 CG1 VAL A 128 11.654 5.685 3.257 1.00 10.00 C ATOM 1628 CG2 VAL A 128 9.725 4.408 4.211 1.00 10.00 C ATOM 0 H VAL A 128 10.521 4.225 6.939 1.00 10.00 H new ATOM 0 HA VAL A 128 12.442 3.695 4.772 1.00 10.00 H new ATOM 0 HB VAL A 128 10.654 6.110 5.088 1.00 10.00 H new ATOM 0 HG11 VAL A 128 10.951 6.254 2.648 1.00 10.00 H new ATOM 0 HG12 VAL A 128 12.506 6.315 3.511 1.00 10.00 H new ATOM 0 HG13 VAL A 128 11.999 4.816 2.696 1.00 10.00 H new ATOM 0 HG21 VAL A 128 9.053 4.997 3.587 1.00 10.00 H new ATOM 0 HG22 VAL A 128 10.014 3.502 3.678 1.00 10.00 H new ATOM 0 HG23 VAL A 128 9.218 4.138 5.137 1.00 10.00 H new ATOM 1638 N GLN A 129 14.199 5.177 5.777 1.00 10.00 N ATOM 1639 CA GLN A 129 15.232 6.006 6.366 1.00 10.00 C ATOM 1640 C GLN A 129 16.216 6.465 5.305 1.00 10.00 C ATOM 1641 O GLN A 129 16.595 5.696 4.420 1.00 10.00 O ATOM 1642 CB GLN A 129 15.979 5.236 7.457 1.00 10.00 C ATOM 1643 CG GLN A 129 15.087 4.735 8.583 1.00 10.00 C ATOM 1644 CD GLN A 129 15.815 3.807 9.535 1.00 10.00 C ATOM 1645 OE1 GLN A 129 17.019 3.942 9.755 1.00 10.00 O ATOM 1646 NE2 GLN A 129 15.093 2.861 10.111 1.00 10.00 N ATOM 0 H GLN A 129 14.543 4.459 5.139 1.00 10.00 H new ATOM 0 HA GLN A 129 14.753 6.879 6.809 1.00 10.00 H new ATOM 0 HB2 GLN A 129 16.487 4.385 7.004 1.00 10.00 H new ATOM 0 HB3 GLN A 129 16.751 5.880 7.878 1.00 10.00 H new ATOM 0 HG2 GLN A 129 14.697 5.587 9.139 1.00 10.00 H new ATOM 0 HG3 GLN A 129 14.230 4.213 8.158 1.00 10.00 H new ATOM 0 HE21 GLN A 129 14.098 2.781 9.903 1.00 10.00 H new ATOM 0 HE22 GLN A 129 15.531 2.211 10.763 1.00 10.00 H new ATOM 1655 N PRO A 130 16.628 7.729 5.369 1.00 10.00 N ATOM 1656 CA PRO A 130 17.585 8.282 4.422 1.00 10.00 C ATOM 1657 C PRO A 130 19.011 7.835 4.735 1.00 10.00 C ATOM 1658 O PRO A 130 19.371 7.631 5.900 1.00 10.00 O ATOM 1659 CB PRO A 130 17.436 9.789 4.618 1.00 10.00 C ATOM 1660 CG PRO A 130 17.008 9.945 6.036 1.00 10.00 C ATOM 1661 CD PRO A 130 16.182 8.728 6.359 1.00 10.00 C ATOM 0 HA PRO A 130 17.399 7.955 3.399 1.00 10.00 H new ATOM 0 HB2 PRO A 130 18.376 10.308 4.429 1.00 10.00 H new ATOM 0 HB3 PRO A 130 16.698 10.206 3.933 1.00 10.00 H new ATOM 0 HG2 PRO A 130 17.871 10.017 6.698 1.00 10.00 H new ATOM 0 HG3 PRO A 130 16.427 10.857 6.170 1.00 10.00 H new ATOM 0 HD2 PRO A 130 16.356 8.386 7.379 1.00 10.00 H new ATOM 0 HD3 PRO A 130 15.115 8.933 6.269 1.00 10.00 H new ATOM 1669 N VAL A 131 19.810 7.658 3.697 1.00 10.00 N ATOM 1670 CA VAL A 131 21.193 7.249 3.869 1.00 10.00 C ATOM 1671 C VAL A 131 22.116 8.440 3.630 1.00 10.00 C ATOM 1672 O VAL A 131 21.767 9.359 2.886 1.00 10.00 O ATOM 1673 CB VAL A 131 21.580 6.076 2.939 1.00 10.00 C ATOM 1674 CG1 VAL A 131 21.280 4.751 3.616 1.00 10.00 C ATOM 1675 CG2 VAL A 131 20.855 6.163 1.608 1.00 10.00 C ATOM 0 H VAL A 131 19.525 7.791 2.727 1.00 10.00 H new ATOM 0 HA VAL A 131 21.306 6.894 4.893 1.00 10.00 H new ATOM 0 HB VAL A 131 22.650 6.142 2.742 1.00 10.00 H new ATOM 0 HG11 VAL A 131 21.557 3.932 2.952 1.00 10.00 H new ATOM 0 HG12 VAL A 131 21.852 4.677 4.541 1.00 10.00 H new ATOM 0 HG13 VAL A 131 20.215 4.691 3.842 1.00 10.00 H new ATOM 0 HG21 VAL A 131 21.149 5.324 0.978 1.00 10.00 H new ATOM 0 HG22 VAL A 131 19.779 6.130 1.777 1.00 10.00 H new ATOM 0 HG23 VAL A 131 21.116 7.098 1.112 1.00 10.00 H new