USER MOD reduce.3.24.130724 H: found=0, std=0, add=736, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 0 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 71 MET CE :methyl -161:sc= -3.22 (180deg=-5.05!) USER MOD Set 1.2: A 81 MET CE :methyl 172:sc=-0.000997 (180deg=-0.0617) USER MOD Set 2.1: A 65 THR OG1 : rot 180:sc= 0.281 USER MOD Set 2.2: A 85 TYR OH : rot -56:sc= -3.7! USER MOD Set 3.1: A 45 SER OG : rot 180:sc= -0.0463 USER MOD Set 3.2: A 47 SER OG : rot 180:sc= -0.852 USER MOD Set 4.1: A 28 SER OG : rot 149:sc= 1.75 USER MOD Set 4.2: A 77 TYR OH : rot -124:sc= -1.86! USER MOD Set 5.1: A 12 TYR OH : rot -143:sc= -1.98 USER MOD Set 5.2: A 14 ASN : amide:sc= -1.32 K(o=-5.4,f=-9.9!) USER MOD Set 5.3: A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.4: A 53 GLN : amide:sc= -2.06! C(o=-5.4!,f=-9.4!) USER MOD Set 6.1: A 10 THR OG1 : rot -21:sc= 0.208 USER MOD Set 6.2: A 90 SER OG : rot -130:sc= -1.18 USER MOD Single : A 8 ASN : amide:sc= -0.727 X(o=-0.73,f=-0.91!) USER MOD Single : A 9 HIS :FLIP no HD1:sc= -8.57! C(o=-12!,f=-8.6!) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -158:sc= -0.0211 (180deg=-0.534) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 HIS :FLIP no HD1:sc= -3.03! F(o=-3.8,f=-3!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= -0.0457 USER MOD Single : A 63 SER OG : rot 180:sc= 0.0337 USER MOD Single : A 66 ASN :FLIP amide:sc= -0.298! C(o=-2.2!,f=-0.3!) USER MOD Single : A 70 SER OG : rot 174:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -1.22 K(o=-1.2,f=-3.2!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.028) USER MOD Single : A 87 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0197) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0176 USER MOD ----------------------------------------------------------------- ATOM 682 N PRO A 7 31.473 -2.348 -29.043 1.00 0.00 N ATOM 683 CA PRO A 7 31.137 -2.073 -27.635 1.00 0.00 C ATOM 684 C PRO A 7 31.390 -0.594 -27.300 1.00 0.00 C ATOM 685 O PRO A 7 32.341 0.010 -27.795 1.00 0.00 O ATOM 686 CB PRO A 7 32.091 -2.977 -26.849 1.00 0.00 C ATOM 687 CG PRO A 7 33.283 -3.278 -27.788 1.00 0.00 C ATOM 688 CD PRO A 7 32.796 -3.001 -29.223 1.00 0.00 C ATOM 0 HA PRO A 7 30.089 -2.264 -27.403 1.00 0.00 H new ATOM 0 HB2 PRO A 7 32.430 -2.484 -25.938 1.00 0.00 H new ATOM 0 HB3 PRO A 7 31.592 -3.898 -26.547 1.00 0.00 H new ATOM 0 HG2 PRO A 7 34.138 -2.649 -27.541 1.00 0.00 H new ATOM 0 HG3 PRO A 7 33.607 -4.313 -27.682 1.00 0.00 H new ATOM 0 HD2 PRO A 7 33.489 -2.354 -29.760 1.00 0.00 H new ATOM 0 HD3 PRO A 7 32.710 -3.923 -29.798 1.00 0.00 H new ATOM 689 N ASN A 8 30.565 0.004 -26.469 1.00 0.00 N ATOM 690 CA ASN A 8 30.774 1.437 -26.113 1.00 0.00 C ATOM 691 C ASN A 8 30.451 1.638 -24.624 1.00 0.00 C ATOM 692 O ASN A 8 30.106 0.689 -23.924 1.00 0.00 O ATOM 693 CB ASN A 8 29.848 2.315 -26.966 1.00 0.00 C ATOM 694 CG ASN A 8 30.684 3.167 -27.930 1.00 0.00 C ATOM 695 OD1 ASN A 8 31.529 3.948 -27.497 1.00 0.00 O ATOM 696 ND2 ASN A 8 30.496 3.064 -29.224 1.00 0.00 N ATOM 0 H ASN A 8 29.761 -0.441 -26.026 1.00 0.00 H new ATOM 0 HA ASN A 8 31.810 1.717 -26.303 1.00 0.00 H new ATOM 0 HB2 ASN A 8 29.154 1.690 -27.527 1.00 0.00 H new ATOM 0 HB3 ASN A 8 29.248 2.959 -26.323 1.00 0.00 H new ATOM 0 HD21 ASN A 8 31.050 3.631 -29.866 1.00 0.00 H new ATOM 0 HD22 ASN A 8 29.796 2.417 -29.588 1.00 0.00 H new ATOM 697 N HIS A 9 30.549 2.852 -24.122 1.00 0.00 N ATOM 698 CA HIS A 9 30.239 3.084 -22.679 1.00 0.00 C ATOM 699 C HIS A 9 28.831 3.690 -22.529 1.00 0.00 C ATOM 700 O HIS A 9 28.589 4.486 -21.623 1.00 0.00 O ATOM 701 CB HIS A 9 31.269 4.053 -22.090 1.00 0.00 C ATOM 702 CG HIS A 9 31.593 3.659 -20.673 1.00 0.00 C ATOM 703 ND1 HIS A 9 32.735 3.795 -19.923 1.00 0.00 N flip ATOM 704 CD2 HIS A 9 30.674 3.032 -19.846 1.00 0.00 C flip ATOM 705 CE1 HIS A 9 32.532 3.262 -18.656 1.00 0.00 C flip ATOM 706 NE2 HIS A 9 31.276 2.818 -18.663 1.00 0.00 N flip ATOM 0 H HIS A 9 30.828 3.681 -24.647 1.00 0.00 H new ATOM 0 HA HIS A 9 30.277 2.132 -22.150 1.00 0.00 H new ATOM 0 HB2 HIS A 9 32.176 4.045 -22.695 1.00 0.00 H new ATOM 0 HB3 HIS A 9 30.879 5.070 -22.113 1.00 0.00 H new ATOM 0 HD2 HIS A 9 29.660 2.764 -20.105 1.00 0.00 H new ATOM 0 HE1 HIS A 9 33.240 3.217 -17.841 1.00 0.00 H new ATOM 0 HE2 HIS A 9 30.825 2.369 -17.866 1.00 0.00 H new ATOM 707 N THR A 10 27.892 3.336 -23.387 1.00 0.00 N ATOM 708 CA THR A 10 26.513 3.911 -23.264 1.00 0.00 C ATOM 709 C THR A 10 25.537 3.135 -24.166 1.00 0.00 C ATOM 710 O THR A 10 25.748 3.033 -25.373 1.00 0.00 O ATOM 711 CB THR A 10 26.534 5.382 -23.697 1.00 0.00 C ATOM 712 OG1 THR A 10 27.477 6.098 -22.911 1.00 0.00 O ATOM 713 CG2 THR A 10 25.145 5.994 -23.510 1.00 0.00 C ATOM 0 H THR A 10 28.023 2.681 -24.157 1.00 0.00 H new ATOM 0 HA THR A 10 26.186 3.833 -22.227 1.00 0.00 H new ATOM 0 HB THR A 10 26.818 5.443 -24.748 1.00 0.00 H new ATOM 0 HG1 THR A 10 27.646 5.610 -22.078 1.00 0.00 H new ATOM 0 HG21 THR A 10 25.163 7.039 -23.819 1.00 0.00 H new ATOM 0 HG22 THR A 10 24.422 5.449 -24.117 1.00 0.00 H new ATOM 0 HG23 THR A 10 24.858 5.931 -22.460 1.00 0.00 H new ATOM 714 N ILE A 11 24.469 2.594 -23.617 1.00 0.00 N ATOM 715 CA ILE A 11 23.500 1.846 -24.474 1.00 0.00 C ATOM 716 C ILE A 11 22.449 2.828 -25.020 1.00 0.00 C ATOM 717 O ILE A 11 22.313 3.945 -24.521 1.00 0.00 O ATOM 718 CB ILE A 11 22.823 0.731 -23.662 1.00 0.00 C ATOM 719 CG1 ILE A 11 21.998 1.339 -22.512 1.00 0.00 C ATOM 720 CG2 ILE A 11 23.901 -0.195 -23.088 1.00 0.00 C ATOM 721 CD1 ILE A 11 20.509 1.066 -22.742 1.00 0.00 C ATOM 0 H ILE A 11 24.233 2.639 -22.626 1.00 0.00 H new ATOM 0 HA ILE A 11 24.030 1.385 -25.307 1.00 0.00 H new ATOM 0 HB ILE A 11 22.156 0.165 -24.312 1.00 0.00 H new ATOM 0 HG12 ILE A 11 22.313 0.911 -21.560 1.00 0.00 H new ATOM 0 HG13 ILE A 11 22.175 2.413 -22.453 1.00 0.00 H new ATOM 0 HG21 ILE A 11 23.428 -0.989 -22.510 1.00 0.00 H new ATOM 0 HG22 ILE A 11 24.476 -0.633 -23.904 1.00 0.00 H new ATOM 0 HG23 ILE A 11 24.566 0.378 -22.441 1.00 0.00 H new ATOM 0 HD11 ILE A 11 19.930 1.498 -21.926 1.00 0.00 H new ATOM 0 HD12 ILE A 11 20.198 1.515 -23.685 1.00 0.00 H new ATOM 0 HD13 ILE A 11 20.338 -0.010 -22.779 1.00 0.00 H new ATOM 722 N TYR A 12 21.714 2.448 -26.042 1.00 0.00 N ATOM 723 CA TYR A 12 20.698 3.378 -26.617 1.00 0.00 C ATOM 724 C TYR A 12 19.362 2.632 -26.803 1.00 0.00 C ATOM 725 O TYR A 12 19.318 1.560 -27.400 1.00 0.00 O ATOM 726 CB TYR A 12 21.223 3.885 -27.972 1.00 0.00 C ATOM 727 CG TYR A 12 20.147 4.638 -28.726 1.00 0.00 C ATOM 728 CD1 TYR A 12 19.183 3.929 -29.454 1.00 0.00 C ATOM 729 CD2 TYR A 12 20.119 6.037 -28.703 1.00 0.00 C ATOM 730 CE1 TYR A 12 18.194 4.620 -30.161 1.00 0.00 C ATOM 731 CE2 TYR A 12 19.126 6.728 -29.410 1.00 0.00 C ATOM 732 CZ TYR A 12 18.164 6.019 -30.139 1.00 0.00 C ATOM 733 OH TYR A 12 17.187 6.699 -30.838 1.00 0.00 O ATOM 0 H TYR A 12 21.777 1.538 -26.498 1.00 0.00 H new ATOM 0 HA TYR A 12 20.530 4.222 -25.948 1.00 0.00 H new ATOM 0 HB2 TYR A 12 22.083 4.536 -27.812 1.00 0.00 H new ATOM 0 HB3 TYR A 12 21.568 3.042 -28.570 1.00 0.00 H new ATOM 0 HD1 TYR A 12 19.204 2.849 -29.469 1.00 0.00 H new ATOM 0 HD2 TYR A 12 20.862 6.583 -28.141 1.00 0.00 H new ATOM 0 HE1 TYR A 12 17.452 4.073 -30.725 1.00 0.00 H new ATOM 0 HE2 TYR A 12 19.103 7.808 -29.392 1.00 0.00 H new ATOM 0 HH TYR A 12 17.567 7.518 -31.218 1.00 0.00 H new ATOM 734 N ILE A 13 18.269 3.182 -26.316 1.00 0.00 N ATOM 735 CA ILE A 13 16.955 2.497 -26.487 1.00 0.00 C ATOM 736 C ILE A 13 16.150 3.215 -27.581 1.00 0.00 C ATOM 737 O ILE A 13 16.337 4.407 -27.819 1.00 0.00 O ATOM 738 CB ILE A 13 16.177 2.546 -25.170 1.00 0.00 C ATOM 739 CG1 ILE A 13 17.032 1.946 -24.044 1.00 0.00 C ATOM 740 CG2 ILE A 13 14.883 1.741 -25.315 1.00 0.00 C ATOM 741 CD1 ILE A 13 16.903 2.812 -22.789 1.00 0.00 C ATOM 0 H ILE A 13 18.236 4.068 -25.813 1.00 0.00 H new ATOM 0 HA ILE A 13 17.119 1.458 -26.772 1.00 0.00 H new ATOM 0 HB ILE A 13 15.937 3.581 -24.928 1.00 0.00 H new ATOM 0 HG12 ILE A 13 16.708 0.927 -23.831 1.00 0.00 H new ATOM 0 HG13 ILE A 13 18.075 1.891 -24.355 1.00 0.00 H new ATOM 0 HG21 ILE A 13 14.327 1.774 -24.378 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.276 2.169 -26.113 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.124 0.706 -25.557 1.00 0.00 H new ATOM 0 HD11 ILE A 13 17.510 2.387 -21.989 1.00 0.00 H new ATOM 0 HD12 ILE A 13 17.248 3.823 -23.007 1.00 0.00 H new ATOM 0 HD13 ILE A 13 15.860 2.844 -22.475 1.00 0.00 H new ATOM 742 N ASN A 14 15.257 2.520 -28.254 1.00 0.00 N ATOM 743 CA ASN A 14 14.456 3.181 -29.324 1.00 0.00 C ATOM 744 C ASN A 14 13.009 2.667 -29.272 1.00 0.00 C ATOM 745 O ASN A 14 12.711 1.703 -28.571 1.00 0.00 O ATOM 746 CB ASN A 14 15.064 2.858 -30.690 1.00 0.00 C ATOM 747 CG ASN A 14 14.933 4.076 -31.612 1.00 0.00 C ATOM 748 OD1 ASN A 14 14.888 5.210 -31.141 1.00 0.00 O ATOM 749 ND2 ASN A 14 14.868 3.910 -32.912 1.00 0.00 N ATOM 0 H ASN A 14 15.054 1.532 -28.105 1.00 0.00 H new ATOM 0 HA ASN A 14 14.464 4.260 -29.170 1.00 0.00 H new ATOM 0 HB2 ASN A 14 16.113 2.586 -30.577 1.00 0.00 H new ATOM 0 HB3 ASN A 14 14.558 1.999 -31.131 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.781 4.720 -33.526 1.00 0.00 H new ATOM 0 HD22 ASN A 14 14.905 2.971 -33.309 1.00 0.00 H new ATOM 750 N ASN A 15 12.102 3.289 -29.997 1.00 0.00 N ATOM 751 CA ASN A 15 10.686 2.822 -29.975 1.00 0.00 C ATOM 752 C ASN A 15 10.158 2.853 -28.532 1.00 0.00 C ATOM 753 O ASN A 15 9.715 1.835 -28.000 1.00 0.00 O ATOM 754 CB ASN A 15 10.610 1.395 -30.522 1.00 0.00 C ATOM 755 CG ASN A 15 10.530 1.436 -32.053 1.00 0.00 C ATOM 756 OD1 ASN A 15 11.553 1.550 -32.727 1.00 0.00 O ATOM 757 ND2 ASN A 15 9.366 1.351 -32.650 1.00 0.00 N ATOM 0 H ASN A 15 12.286 4.093 -30.597 1.00 0.00 H new ATOM 0 HA ASN A 15 10.076 3.479 -30.596 1.00 0.00 H new ATOM 0 HB2 ASN A 15 11.486 0.827 -30.208 1.00 0.00 H new ATOM 0 HB3 ASN A 15 9.737 0.885 -30.115 1.00 0.00 H new ATOM 0 HD21 ASN A 15 9.312 1.379 -33.668 1.00 0.00 H new ATOM 0 HD22 ASN A 15 8.515 1.256 -32.096 1.00 0.00 H new ATOM 758 N LEU A 16 10.193 3.997 -27.881 1.00 0.00 N ATOM 759 CA LEU A 16 9.692 4.071 -26.477 1.00 0.00 C ATOM 760 C LEU A 16 8.276 4.665 -26.467 1.00 0.00 C ATOM 761 O LEU A 16 7.962 5.523 -25.644 1.00 0.00 O ATOM 762 CB LEU A 16 10.624 4.959 -25.650 1.00 0.00 C ATOM 763 CG LEU A 16 12.010 4.317 -25.579 1.00 0.00 C ATOM 764 CD1 LEU A 16 13.057 5.392 -25.288 1.00 0.00 C ATOM 765 CD2 LEU A 16 12.026 3.271 -24.462 1.00 0.00 C ATOM 0 H LEU A 16 10.546 4.874 -28.263 1.00 0.00 H new ATOM 0 HA LEU A 16 9.667 3.070 -26.047 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.693 5.950 -26.099 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.221 5.092 -24.646 1.00 0.00 H new ATOM 0 HG LEU A 16 12.240 3.838 -26.531 1.00 0.00 H new ATOM 0 HD11 LEU A 16 14.045 4.934 -25.237 1.00 0.00 H new ATOM 0 HD12 LEU A 16 13.043 6.138 -26.083 1.00 0.00 H new ATOM 0 HD13 LEU A 16 12.831 5.872 -24.336 1.00 0.00 H new ATOM 0 HD21 LEU A 16 13.013 2.811 -24.408 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.797 3.751 -23.511 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.279 2.505 -24.670 1.00 0.00 H new ATOM 766 N ASN A 17 7.403 4.212 -27.345 1.00 0.00 N ATOM 767 CA ASN A 17 6.012 4.737 -27.367 1.00 0.00 C ATOM 768 C ASN A 17 6.009 6.262 -27.546 1.00 0.00 C ATOM 769 O ASN A 17 7.012 6.936 -27.321 1.00 0.00 O ATOM 770 CB ASN A 17 5.350 4.355 -26.056 1.00 0.00 C ATOM 771 CG ASN A 17 3.842 4.171 -26.271 1.00 0.00 C ATOM 772 OD1 ASN A 17 3.425 3.299 -27.032 1.00 0.00 O ATOM 773 ND2 ASN A 17 2.992 4.944 -25.641 1.00 0.00 N ATOM 0 H ASN A 17 7.605 3.499 -28.046 1.00 0.00 H new ATOM 0 HA ASN A 17 5.464 4.309 -28.207 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.787 3.433 -25.672 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.529 5.128 -25.309 1.00 0.00 H new ATOM 0 HD21 ASN A 17 1.989 4.821 -25.783 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.333 5.668 -25.009 1.00 0.00 H new ATOM 774 N GLU A 18 4.896 6.824 -27.964 1.00 0.00 N ATOM 775 CA GLU A 18 4.839 8.302 -28.163 1.00 0.00 C ATOM 776 C GLU A 18 3.885 8.934 -27.136 1.00 0.00 C ATOM 777 O GLU A 18 3.172 9.887 -27.450 1.00 0.00 O ATOM 778 CB GLU A 18 4.335 8.605 -29.575 1.00 0.00 C ATOM 779 CG GLU A 18 5.465 8.382 -30.581 1.00 0.00 C ATOM 780 CD GLU A 18 5.177 9.173 -31.858 1.00 0.00 C ATOM 781 OE1 GLU A 18 4.105 8.994 -32.414 1.00 0.00 O ATOM 782 OE2 GLU A 18 6.032 9.946 -32.259 1.00 0.00 O ATOM 0 H GLU A 18 4.033 6.323 -28.173 1.00 0.00 H new ATOM 0 HA GLU A 18 5.837 8.719 -28.030 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.488 7.962 -29.816 1.00 0.00 H new ATOM 0 HB3 GLU A 18 3.981 9.634 -29.633 1.00 0.00 H new ATOM 0 HG2 GLU A 18 6.416 8.698 -30.152 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.557 7.321 -30.811 1.00 0.00 H new ATOM 783 N LYS A 19 3.850 8.436 -25.917 1.00 0.00 N ATOM 784 CA LYS A 19 2.936 9.034 -24.898 1.00 0.00 C ATOM 785 C LYS A 19 3.515 8.847 -23.483 1.00 0.00 C ATOM 786 O LYS A 19 2.769 8.648 -22.525 1.00 0.00 O ATOM 787 CB LYS A 19 1.570 8.349 -24.979 1.00 0.00 C ATOM 788 CG LYS A 19 1.041 8.438 -26.411 1.00 0.00 C ATOM 789 CD LYS A 19 -0.400 7.924 -26.458 1.00 0.00 C ATOM 790 CE LYS A 19 -1.192 8.718 -27.499 1.00 0.00 C ATOM 791 NZ LYS A 19 -2.648 8.466 -27.312 1.00 0.00 N ATOM 0 H LYS A 19 4.411 7.649 -25.591 1.00 0.00 H new ATOM 0 HA LYS A 19 2.831 10.100 -25.100 1.00 0.00 H new ATOM 0 HB2 LYS A 19 1.656 7.306 -24.675 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.871 8.825 -24.291 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.082 9.469 -26.761 1.00 0.00 H new ATOM 0 HG3 LYS A 19 1.670 7.850 -27.079 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -0.411 6.863 -26.709 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -0.865 8.024 -25.477 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.980 9.783 -27.399 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.887 8.426 -28.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.187 9.005 -28.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.842 7.451 -27.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.932 8.766 -26.358 1.00 0.00 H new ATOM 792 N ILE A 20 4.821 8.902 -23.322 1.00 0.00 N ATOM 793 CA ILE A 20 5.411 8.724 -21.964 1.00 0.00 C ATOM 794 C ILE A 20 5.796 10.086 -21.383 1.00 0.00 C ATOM 795 O ILE A 20 6.108 11.021 -22.118 1.00 0.00 O ATOM 796 CB ILE A 20 6.675 7.847 -22.032 1.00 0.00 C ATOM 797 CG1 ILE A 20 6.482 6.688 -23.027 1.00 0.00 C ATOM 798 CG2 ILE A 20 6.972 7.282 -20.636 1.00 0.00 C ATOM 799 CD1 ILE A 20 5.254 5.865 -22.637 1.00 0.00 C ATOM 0 H ILE A 20 5.494 9.062 -24.071 1.00 0.00 H new ATOM 0 HA ILE A 20 4.667 8.240 -21.332 1.00 0.00 H new ATOM 0 HB ILE A 20 7.510 8.459 -22.373 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.362 7.081 -24.037 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.368 6.053 -23.035 1.00 0.00 H new ATOM 0 HG21 ILE A 20 7.866 6.660 -20.678 1.00 0.00 H new ATOM 0 HG22 ILE A 20 7.134 8.103 -19.938 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.127 6.681 -20.300 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.124 5.047 -23.346 1.00 0.00 H new ATOM 0 HD12 ILE A 20 5.392 5.459 -21.635 1.00 0.00 H new ATOM 0 HD13 ILE A 20 4.369 6.502 -22.652 1.00 0.00 H new ATOM 800 N LYS A 21 5.801 10.214 -20.076 1.00 0.00 N ATOM 801 CA LYS A 21 6.192 11.514 -19.464 1.00 0.00 C ATOM 802 C LYS A 21 7.717 11.540 -19.309 1.00 0.00 C ATOM 803 O LYS A 21 8.402 10.604 -19.717 1.00 0.00 O ATOM 804 CB LYS A 21 5.532 11.671 -18.086 1.00 0.00 C ATOM 805 CG LYS A 21 4.311 12.586 -18.201 1.00 0.00 C ATOM 806 CD LYS A 21 3.246 12.145 -17.195 1.00 0.00 C ATOM 807 CE LYS A 21 1.858 12.508 -17.728 1.00 0.00 C ATOM 808 NZ LYS A 21 0.874 11.477 -17.295 1.00 0.00 N ATOM 0 H LYS A 21 5.552 9.478 -19.416 1.00 0.00 H new ATOM 0 HA LYS A 21 5.863 12.334 -20.103 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.233 10.696 -17.702 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.246 12.088 -17.376 1.00 0.00 H new ATOM 0 HG2 LYS A 21 4.599 13.620 -18.012 1.00 0.00 H new ATOM 0 HG3 LYS A 21 3.908 12.547 -19.213 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.313 11.070 -17.027 1.00 0.00 H new ATOM 0 HD3 LYS A 21 3.416 12.630 -16.234 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.560 13.489 -17.358 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.880 12.571 -18.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -0.069 11.724 -17.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.157 10.549 -17.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.847 11.438 -16.256 1.00 0.00 H new ATOM 809 N LYS A 22 8.273 12.581 -18.731 1.00 0.00 N ATOM 810 CA LYS A 22 9.758 12.624 -18.564 1.00 0.00 C ATOM 811 C LYS A 22 10.142 11.913 -17.262 1.00 0.00 C ATOM 812 O LYS A 22 11.129 11.182 -17.215 1.00 0.00 O ATOM 813 CB LYS A 22 10.244 14.074 -18.519 1.00 0.00 C ATOM 814 CG LYS A 22 11.763 14.112 -18.689 1.00 0.00 C ATOM 815 CD LYS A 22 12.188 15.505 -19.158 1.00 0.00 C ATOM 816 CE LYS A 22 13.689 15.509 -19.453 1.00 0.00 C ATOM 817 NZ LYS A 22 14.253 16.853 -19.140 1.00 0.00 N ATOM 0 H LYS A 22 7.768 13.392 -18.373 1.00 0.00 H new ATOM 0 HA LYS A 22 10.227 12.122 -19.410 1.00 0.00 H new ATOM 0 HB2 LYS A 22 9.765 14.653 -19.309 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.963 14.533 -17.571 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.252 13.869 -17.745 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.078 13.361 -19.413 1.00 0.00 H new ATOM 0 HD2 LYS A 22 11.630 15.785 -20.052 1.00 0.00 H new ATOM 0 HD3 LYS A 22 11.955 16.245 -18.392 1.00 0.00 H new ATOM 0 HE2 LYS A 22 14.190 14.745 -18.858 1.00 0.00 H new ATOM 0 HE3 LYS A 22 13.865 15.264 -20.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 15.274 16.856 -19.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.783 17.572 -19.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 14.097 17.070 -18.135 1.00 0.00 H new ATOM 818 N ASP A 23 9.375 12.087 -16.212 1.00 0.00 N ATOM 819 CA ASP A 23 9.700 11.383 -14.937 1.00 0.00 C ATOM 820 C ASP A 23 9.279 9.907 -15.062 1.00 0.00 C ATOM 821 O ASP A 23 9.835 9.042 -14.389 1.00 0.00 O ATOM 822 CB ASP A 23 8.954 12.030 -13.763 1.00 0.00 C ATOM 823 CG ASP A 23 9.858 12.043 -12.530 1.00 0.00 C ATOM 824 OD1 ASP A 23 10.936 12.608 -12.616 1.00 0.00 O ATOM 825 OD2 ASP A 23 9.457 11.489 -11.520 1.00 0.00 O ATOM 0 H ASP A 23 8.546 12.681 -16.185 1.00 0.00 H new ATOM 0 HA ASP A 23 10.772 11.454 -14.750 1.00 0.00 H new ATOM 0 HB2 ASP A 23 8.659 13.047 -14.022 1.00 0.00 H new ATOM 0 HB3 ASP A 23 8.039 11.477 -13.551 1.00 0.00 H new ATOM 826 N GLU A 24 8.308 9.593 -15.906 1.00 0.00 N ATOM 827 CA GLU A 24 7.885 8.168 -16.041 1.00 0.00 C ATOM 828 C GLU A 24 8.916 7.392 -16.867 1.00 0.00 C ATOM 829 O GLU A 24 9.297 6.283 -16.498 1.00 0.00 O ATOM 830 CB GLU A 24 6.513 8.078 -16.725 1.00 0.00 C ATOM 831 CG GLU A 24 5.765 6.847 -16.208 1.00 0.00 C ATOM 832 CD GLU A 24 4.263 7.134 -16.186 1.00 0.00 C ATOM 833 OE1 GLU A 24 3.875 8.111 -15.566 1.00 0.00 O ATOM 834 OE2 GLU A 24 3.525 6.370 -16.787 1.00 0.00 O ATOM 0 H GLU A 24 7.804 10.257 -16.493 1.00 0.00 H new ATOM 0 HA GLU A 24 7.815 7.733 -15.044 1.00 0.00 H new ATOM 0 HB2 GLU A 24 5.934 8.980 -16.523 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.637 8.014 -17.806 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.972 5.988 -16.846 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.112 6.592 -15.207 1.00 0.00 H new ATOM 835 N LEU A 25 9.381 7.933 -17.974 1.00 0.00 N ATOM 836 CA LEU A 25 10.385 7.175 -18.789 1.00 0.00 C ATOM 837 C LEU A 25 11.716 7.057 -18.025 1.00 0.00 C ATOM 838 O LEU A 25 12.422 6.060 -18.157 1.00 0.00 O ATOM 839 CB LEU A 25 10.627 7.874 -20.131 1.00 0.00 C ATOM 840 CG LEU A 25 10.918 6.824 -21.205 1.00 0.00 C ATOM 841 CD1 LEU A 25 9.631 6.069 -21.545 1.00 0.00 C ATOM 842 CD2 LEU A 25 11.446 7.517 -22.461 1.00 0.00 C ATOM 0 H LEU A 25 9.114 8.847 -18.340 1.00 0.00 H new ATOM 0 HA LEU A 25 9.987 6.177 -18.974 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.753 8.463 -20.410 1.00 0.00 H new ATOM 0 HB3 LEU A 25 11.465 8.566 -20.047 1.00 0.00 H new ATOM 0 HG LEU A 25 11.664 6.121 -20.833 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.839 5.321 -22.310 1.00 0.00 H new ATOM 0 HD12 LEU A 25 9.251 5.576 -20.650 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.885 6.771 -21.917 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.654 6.771 -23.228 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.698 8.219 -22.831 1.00 0.00 H new ATOM 0 HD23 LEU A 25 12.362 8.056 -22.221 1.00 0.00 H new ATOM 843 N LYS A 26 12.083 8.043 -17.233 1.00 0.00 N ATOM 844 CA LYS A 26 13.377 7.947 -16.480 1.00 0.00 C ATOM 845 C LYS A 26 13.257 6.914 -15.343 1.00 0.00 C ATOM 846 O LYS A 26 14.238 6.265 -14.988 1.00 0.00 O ATOM 847 CB LYS A 26 13.749 9.316 -15.886 1.00 0.00 C ATOM 848 CG LYS A 26 15.232 9.603 -16.137 1.00 0.00 C ATOM 849 CD LYS A 26 15.741 10.612 -15.103 1.00 0.00 C ATOM 850 CE LYS A 26 16.325 9.866 -13.901 1.00 0.00 C ATOM 851 NZ LYS A 26 15.310 9.810 -12.811 1.00 0.00 N ATOM 0 H LYS A 26 11.549 8.898 -17.078 1.00 0.00 H new ATOM 0 HA LYS A 26 14.156 7.631 -17.174 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.136 10.097 -16.336 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.543 9.327 -14.816 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.808 8.680 -16.073 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.372 9.997 -17.144 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.501 11.254 -15.550 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.926 11.260 -14.781 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.618 8.857 -14.192 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.225 10.370 -13.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.787 9.656 -11.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.784 10.707 -12.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.649 9.028 -12.992 1.00 0.00 H new ATOM 852 N LYS A 27 12.088 6.743 -14.755 1.00 0.00 N ATOM 853 CA LYS A 27 11.956 5.744 -13.642 1.00 0.00 C ATOM 854 C LYS A 27 12.006 4.310 -14.204 1.00 0.00 C ATOM 855 O LYS A 27 12.520 3.404 -13.552 1.00 0.00 O ATOM 856 CB LYS A 27 10.625 5.949 -12.895 1.00 0.00 C ATOM 857 CG LYS A 27 10.885 6.652 -11.560 1.00 0.00 C ATOM 858 CD LYS A 27 11.049 5.605 -10.456 1.00 0.00 C ATOM 859 CE LYS A 27 11.571 6.280 -9.186 1.00 0.00 C ATOM 860 NZ LYS A 27 11.236 5.437 -8.003 1.00 0.00 N ATOM 0 H LYS A 27 11.233 7.245 -14.995 1.00 0.00 H new ATOM 0 HA LYS A 27 12.785 5.891 -12.950 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.943 6.544 -13.503 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.142 4.987 -12.722 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.782 7.267 -11.629 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.058 7.321 -11.322 1.00 0.00 H new ATOM 0 HD2 LYS A 27 10.094 5.119 -10.256 1.00 0.00 H new ATOM 0 HD3 LYS A 27 11.741 4.827 -10.778 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.650 6.420 -9.253 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.127 7.270 -9.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 11.590 5.895 -7.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 10.204 5.325 -7.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 11.680 4.502 -8.106 1.00 0.00 H new ATOM 861 N SER A 28 11.482 4.074 -15.391 1.00 0.00 N ATOM 862 CA SER A 28 11.516 2.683 -15.954 1.00 0.00 C ATOM 863 C SER A 28 12.932 2.336 -16.448 1.00 0.00 C ATOM 864 O SER A 28 13.352 1.183 -16.374 1.00 0.00 O ATOM 865 CB SER A 28 10.531 2.558 -17.121 1.00 0.00 C ATOM 866 OG SER A 28 9.260 3.048 -16.716 1.00 0.00 O ATOM 0 H SER A 28 11.039 4.775 -15.985 1.00 0.00 H new ATOM 0 HA SER A 28 11.231 1.990 -15.163 1.00 0.00 H new ATOM 0 HB2 SER A 28 10.894 3.122 -17.981 1.00 0.00 H new ATOM 0 HB3 SER A 28 10.450 1.517 -17.434 1.00 0.00 H new ATOM 0 HG SER A 28 8.797 3.434 -17.489 1.00 0.00 H new ATOM 867 N LEU A 29 13.680 3.295 -16.956 1.00 0.00 N ATOM 868 CA LEU A 29 15.062 2.977 -17.448 1.00 0.00 C ATOM 869 C LEU A 29 16.026 2.776 -16.263 1.00 0.00 C ATOM 870 O LEU A 29 16.980 2.007 -16.360 1.00 0.00 O ATOM 871 CB LEU A 29 15.583 4.118 -18.334 1.00 0.00 C ATOM 872 CG LEU A 29 14.632 4.322 -19.515 1.00 0.00 C ATOM 873 CD1 LEU A 29 15.061 5.557 -20.309 1.00 0.00 C ATOM 874 CD2 LEU A 29 14.678 3.092 -20.423 1.00 0.00 C ATOM 0 H LEU A 29 13.397 4.270 -17.050 1.00 0.00 H new ATOM 0 HA LEU A 29 15.013 2.056 -18.029 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.661 5.037 -17.753 1.00 0.00 H new ATOM 0 HB3 LEU A 29 16.584 3.884 -18.696 1.00 0.00 H new ATOM 0 HG LEU A 29 13.617 4.464 -19.144 1.00 0.00 H new ATOM 0 HD11 LEU A 29 14.383 5.702 -21.150 1.00 0.00 H new ATOM 0 HD12 LEU A 29 15.030 6.434 -19.663 1.00 0.00 H new ATOM 0 HD13 LEU A 29 16.076 5.416 -20.681 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.001 3.236 -21.265 1.00 0.00 H new ATOM 0 HD22 LEU A 29 15.693 2.951 -20.794 1.00 0.00 H new ATOM 0 HD23 LEU A 29 14.373 2.211 -19.858 1.00 0.00 H new ATOM 875 N HIS A 30 15.811 3.446 -15.150 1.00 0.00 N ATOM 876 CA HIS A 30 16.738 3.272 -13.984 1.00 0.00 C ATOM 877 C HIS A 30 16.359 2.027 -13.154 1.00 0.00 C ATOM 878 O HIS A 30 17.199 1.479 -12.445 1.00 0.00 O ATOM 879 CB HIS A 30 16.682 4.512 -13.083 1.00 0.00 C ATOM 880 CG HIS A 30 17.987 4.658 -12.349 1.00 0.00 C ATOM 881 ND1 HIS A 30 19.219 5.115 -12.750 1.00 0.00 N flip ATOM 882 CD2 HIS A 30 18.130 4.309 -11.016 1.00 0.00 C flip ATOM 883 CE1 HIS A 30 20.112 5.050 -11.685 1.00 0.00 C flip ATOM 884 NE2 HIS A 30 19.405 4.557 -10.665 1.00 0.00 N flip ATOM 0 H HIS A 30 15.041 4.099 -15.001 1.00 0.00 H new ATOM 0 HA HIS A 30 17.747 3.140 -14.374 1.00 0.00 H new ATOM 0 HB2 HIS A 30 16.488 5.402 -13.682 1.00 0.00 H new ATOM 0 HB3 HIS A 30 15.861 4.421 -12.372 1.00 0.00 H new ATOM 0 HD2 HIS A 30 17.358 3.910 -10.375 1.00 0.00 H new ATOM 0 HE1 HIS A 30 21.153 5.337 -11.684 1.00 0.00 H new ATOM 0 HE2 HIS A 30 19.785 4.389 -9.734 1.00 0.00 H new ATOM 885 N ALA A 31 15.125 1.567 -13.208 1.00 0.00 N ATOM 886 CA ALA A 31 14.744 0.363 -12.399 1.00 0.00 C ATOM 887 C ALA A 31 15.080 -0.930 -13.165 1.00 0.00 C ATOM 888 O ALA A 31 15.413 -1.947 -12.557 1.00 0.00 O ATOM 889 CB ALA A 31 13.240 0.391 -12.101 1.00 0.00 C ATOM 0 H ALA A 31 14.376 1.969 -13.771 1.00 0.00 H new ATOM 0 HA ALA A 31 15.307 0.384 -11.466 1.00 0.00 H new ATOM 0 HB1 ALA A 31 12.969 -0.486 -11.513 1.00 0.00 H new ATOM 0 HB2 ALA A 31 12.997 1.293 -11.540 1.00 0.00 H new ATOM 0 HB3 ALA A 31 12.683 0.386 -13.038 1.00 0.00 H new ATOM 890 N ILE A 32 14.984 -0.930 -14.476 1.00 0.00 N ATOM 891 CA ILE A 32 15.273 -2.150 -15.253 1.00 0.00 C ATOM 892 C ILE A 32 16.791 -2.246 -15.555 1.00 0.00 C ATOM 893 O ILE A 32 17.346 -3.342 -15.623 1.00 0.00 O ATOM 894 CB ILE A 32 14.431 -2.051 -16.539 1.00 0.00 C ATOM 895 CG1 ILE A 32 13.012 -2.515 -16.228 1.00 0.00 C ATOM 896 CG2 ILE A 32 15.028 -2.876 -17.647 1.00 0.00 C ATOM 897 CD1 ILE A 32 12.103 -2.289 -17.441 1.00 0.00 C ATOM 0 H ILE A 32 14.714 -0.120 -15.034 1.00 0.00 H new ATOM 0 HA ILE A 32 15.015 -3.056 -14.704 1.00 0.00 H new ATOM 0 HB ILE A 32 14.416 -1.016 -16.881 1.00 0.00 H new ATOM 0 HG12 ILE A 32 13.018 -3.572 -15.961 1.00 0.00 H new ATOM 0 HG13 ILE A 32 12.624 -1.970 -15.367 1.00 0.00 H new ATOM 0 HG21 ILE A 32 14.411 -2.785 -18.541 1.00 0.00 H new ATOM 0 HG22 ILE A 32 16.035 -2.520 -17.864 1.00 0.00 H new ATOM 0 HG23 ILE A 32 15.071 -3.921 -17.340 1.00 0.00 H new ATOM 0 HD11 ILE A 32 11.093 -2.624 -17.206 1.00 0.00 H new ATOM 0 HD12 ILE A 32 12.085 -1.228 -17.689 1.00 0.00 H new ATOM 0 HD13 ILE A 32 12.484 -2.854 -18.292 1.00 0.00 H new ATOM 898 N PHE A 33 17.464 -1.137 -15.763 1.00 0.00 N ATOM 899 CA PHE A 33 18.928 -1.204 -16.085 1.00 0.00 C ATOM 900 C PHE A 33 19.791 -1.146 -14.808 1.00 0.00 C ATOM 901 O PHE A 33 20.899 -1.682 -14.786 1.00 0.00 O ATOM 902 CB PHE A 33 19.305 -0.032 -16.997 1.00 0.00 C ATOM 903 CG PHE A 33 18.759 -0.276 -18.382 1.00 0.00 C ATOM 904 CD1 PHE A 33 17.413 -0.011 -18.660 1.00 0.00 C ATOM 905 CD2 PHE A 33 19.597 -0.769 -19.390 1.00 0.00 C ATOM 906 CE1 PHE A 33 16.904 -0.238 -19.945 1.00 0.00 C ATOM 907 CE2 PHE A 33 19.089 -0.997 -20.674 1.00 0.00 C ATOM 908 CZ PHE A 33 17.743 -0.730 -20.951 1.00 0.00 C ATOM 0 H PHE A 33 17.068 -0.198 -15.724 1.00 0.00 H new ATOM 0 HA PHE A 33 19.119 -2.153 -16.586 1.00 0.00 H new ATOM 0 HB2 PHE A 33 18.904 0.899 -16.595 1.00 0.00 H new ATOM 0 HB3 PHE A 33 20.389 0.078 -17.036 1.00 0.00 H new ATOM 0 HD1 PHE A 33 16.766 0.369 -17.883 1.00 0.00 H new ATOM 0 HD2 PHE A 33 20.636 -0.973 -19.176 1.00 0.00 H new ATOM 0 HE1 PHE A 33 15.865 -0.034 -20.159 1.00 0.00 H new ATOM 0 HE2 PHE A 33 19.735 -1.379 -21.451 1.00 0.00 H new ATOM 0 HZ PHE A 33 17.352 -0.904 -21.942 1.00 0.00 H new ATOM 909 N SER A 34 19.339 -0.499 -13.754 1.00 0.00 N ATOM 910 CA SER A 34 20.186 -0.416 -12.516 1.00 0.00 C ATOM 911 C SER A 34 20.284 -1.785 -11.819 1.00 0.00 C ATOM 912 O SER A 34 21.314 -2.105 -11.226 1.00 0.00 O ATOM 913 CB SER A 34 19.595 0.602 -11.533 1.00 0.00 C ATOM 914 OG SER A 34 20.474 0.750 -10.425 1.00 0.00 O ATOM 0 H SER A 34 18.434 -0.032 -13.697 1.00 0.00 H new ATOM 0 HA SER A 34 21.184 -0.100 -12.820 1.00 0.00 H new ATOM 0 HB2 SER A 34 19.451 1.562 -12.029 1.00 0.00 H new ATOM 0 HB3 SER A 34 18.615 0.269 -11.192 1.00 0.00 H new ATOM 0 HG SER A 34 20.100 1.401 -9.795 1.00 0.00 H new ATOM 915 N ARG A 35 19.249 -2.601 -11.854 1.00 0.00 N ATOM 916 CA ARG A 35 19.334 -3.933 -11.160 1.00 0.00 C ATOM 917 C ARG A 35 20.599 -4.695 -11.600 1.00 0.00 C ATOM 918 O ARG A 35 21.202 -5.411 -10.802 1.00 0.00 O ATOM 919 CB ARG A 35 18.096 -4.784 -11.470 1.00 0.00 C ATOM 920 CG ARG A 35 17.980 -5.001 -12.980 1.00 0.00 C ATOM 921 CD ARG A 35 16.509 -5.162 -13.368 1.00 0.00 C ATOM 922 NE ARG A 35 16.323 -6.453 -14.088 1.00 0.00 N ATOM 923 CZ ARG A 35 15.913 -7.508 -13.439 1.00 0.00 C ATOM 924 NH1 ARG A 35 14.634 -7.743 -13.321 1.00 0.00 N ATOM 925 NH2 ARG A 35 16.779 -8.327 -12.908 1.00 0.00 N ATOM 0 H ARG A 35 18.365 -2.407 -12.324 1.00 0.00 H new ATOM 0 HA ARG A 35 19.382 -3.748 -10.087 1.00 0.00 H new ATOM 0 HB2 ARG A 35 18.167 -5.745 -10.960 1.00 0.00 H new ATOM 0 HB3 ARG A 35 17.200 -4.289 -11.095 1.00 0.00 H new ATOM 0 HG2 ARG A 35 18.416 -4.156 -13.513 1.00 0.00 H new ATOM 0 HG3 ARG A 35 18.542 -5.887 -13.274 1.00 0.00 H new ATOM 0 HD2 ARG A 35 15.882 -5.137 -12.477 1.00 0.00 H new ATOM 0 HD3 ARG A 35 16.196 -4.332 -14.001 1.00 0.00 H new ATOM 0 HE ARG A 35 16.516 -6.512 -15.088 1.00 0.00 H new ATOM 0 HH11 ARG A 35 13.957 -7.102 -13.736 1.00 0.00 H new ATOM 0 HH12 ARG A 35 14.312 -8.567 -12.814 1.00 0.00 H new ATOM 0 HH21 ARG A 35 17.778 -8.143 -13.000 1.00 0.00 H new ATOM 0 HH22 ARG A 35 16.457 -9.151 -12.401 1.00 0.00 H new ATOM 926 N PHE A 36 21.020 -4.565 -12.842 1.00 0.00 N ATOM 927 CA PHE A 36 22.250 -5.299 -13.284 1.00 0.00 C ATOM 928 C PHE A 36 23.457 -4.782 -12.488 1.00 0.00 C ATOM 929 O PHE A 36 24.199 -5.561 -11.893 1.00 0.00 O ATOM 930 CB PHE A 36 22.499 -5.078 -14.783 1.00 0.00 C ATOM 931 CG PHE A 36 21.681 -6.068 -15.579 1.00 0.00 C ATOM 932 CD1 PHE A 36 21.839 -7.442 -15.361 1.00 0.00 C ATOM 933 CD2 PHE A 36 20.764 -5.611 -16.532 1.00 0.00 C ATOM 934 CE1 PHE A 36 21.080 -8.359 -16.097 1.00 0.00 C ATOM 935 CE2 PHE A 36 20.006 -6.529 -17.270 1.00 0.00 C ATOM 936 CZ PHE A 36 20.164 -7.902 -17.051 1.00 0.00 C ATOM 0 H PHE A 36 20.571 -3.991 -13.556 1.00 0.00 H new ATOM 0 HA PHE A 36 22.110 -6.365 -13.105 1.00 0.00 H new ATOM 0 HB2 PHE A 36 22.229 -4.059 -15.061 1.00 0.00 H new ATOM 0 HB3 PHE A 36 23.558 -5.200 -15.009 1.00 0.00 H new ATOM 0 HD1 PHE A 36 22.547 -7.794 -14.625 1.00 0.00 H new ATOM 0 HD2 PHE A 36 20.641 -4.551 -16.698 1.00 0.00 H new ATOM 0 HE1 PHE A 36 21.201 -9.419 -15.929 1.00 0.00 H new ATOM 0 HE2 PHE A 36 19.300 -6.177 -18.008 1.00 0.00 H new ATOM 0 HZ PHE A 36 19.578 -8.610 -17.619 1.00 0.00 H new ATOM 937 N GLY A 37 23.671 -3.484 -12.459 1.00 0.00 N ATOM 938 CA GLY A 37 24.831 -2.937 -11.694 1.00 0.00 C ATOM 939 C GLY A 37 24.467 -1.555 -11.131 1.00 0.00 C ATOM 940 O GLY A 37 23.682 -1.447 -10.190 1.00 0.00 O ATOM 0 H GLY A 37 23.094 -2.788 -12.930 1.00 0.00 H new ATOM 0 HA2 GLY A 37 25.097 -3.614 -10.882 1.00 0.00 H new ATOM 0 HA3 GLY A 37 25.704 -2.859 -12.342 1.00 0.00 H new ATOM 941 N GLN A 38 25.015 -0.495 -11.684 1.00 0.00 N ATOM 942 CA GLN A 38 24.686 0.866 -11.169 1.00 0.00 C ATOM 943 C GLN A 38 24.679 1.867 -12.334 1.00 0.00 C ATOM 944 O GLN A 38 25.624 1.922 -13.117 1.00 0.00 O ATOM 945 CB GLN A 38 25.735 1.290 -10.139 1.00 0.00 C ATOM 946 CG GLN A 38 25.195 2.455 -9.309 1.00 0.00 C ATOM 947 CD GLN A 38 26.313 3.010 -8.416 1.00 0.00 C ATOM 948 OE1 GLN A 38 26.677 2.390 -7.420 1.00 0.00 O ATOM 949 NE2 GLN A 38 26.882 4.152 -8.715 1.00 0.00 N ATOM 0 H GLN A 38 25.671 -0.518 -12.465 1.00 0.00 H new ATOM 0 HA GLN A 38 23.703 0.848 -10.699 1.00 0.00 H new ATOM 0 HB2 GLN A 38 25.982 0.450 -9.489 1.00 0.00 H new ATOM 0 HB3 GLN A 38 26.656 1.585 -10.642 1.00 0.00 H new ATOM 0 HG2 GLN A 38 24.817 3.239 -9.966 1.00 0.00 H new ATOM 0 HG3 GLN A 38 24.358 2.121 -8.696 1.00 0.00 H new ATOM 0 HE21 GLN A 38 26.583 4.670 -9.541 1.00 0.00 H new ATOM 0 HE22 GLN A 38 27.624 4.523 -8.122 1.00 0.00 H new ATOM 950 N ILE A 39 23.639 2.662 -12.468 1.00 0.00 N ATOM 951 CA ILE A 39 23.601 3.650 -13.589 1.00 0.00 C ATOM 952 C ILE A 39 24.117 5.005 -13.084 1.00 0.00 C ATOM 953 O ILE A 39 23.878 5.381 -11.938 1.00 0.00 O ATOM 954 CB ILE A 39 22.164 3.802 -14.095 1.00 0.00 C ATOM 955 CG1 ILE A 39 21.635 2.433 -14.531 1.00 0.00 C ATOM 956 CG2 ILE A 39 22.137 4.759 -15.290 1.00 0.00 C ATOM 957 CD1 ILE A 39 20.120 2.508 -14.719 1.00 0.00 C ATOM 0 H ILE A 39 22.824 2.667 -11.854 1.00 0.00 H new ATOM 0 HA ILE A 39 24.231 3.300 -14.406 1.00 0.00 H new ATOM 0 HB ILE A 39 21.539 4.202 -13.297 1.00 0.00 H new ATOM 0 HG12 ILE A 39 22.113 2.126 -15.461 1.00 0.00 H new ATOM 0 HG13 ILE A 39 21.882 1.680 -13.782 1.00 0.00 H new ATOM 0 HG21 ILE A 39 21.113 4.865 -15.648 1.00 0.00 H new ATOM 0 HG22 ILE A 39 22.517 5.734 -14.984 1.00 0.00 H new ATOM 0 HG23 ILE A 39 22.761 4.360 -16.090 1.00 0.00 H new ATOM 0 HD11 ILE A 39 19.743 1.533 -15.029 1.00 0.00 H new ATOM 0 HD12 ILE A 39 19.650 2.796 -13.778 1.00 0.00 H new ATOM 0 HD13 ILE A 39 19.884 3.248 -15.484 1.00 0.00 H new ATOM 958 N LEU A 40 24.827 5.746 -13.908 1.00 0.00 N ATOM 959 CA LEU A 40 25.353 7.065 -13.450 1.00 0.00 C ATOM 960 C LEU A 40 24.391 8.191 -13.853 1.00 0.00 C ATOM 961 O LEU A 40 24.188 9.140 -13.096 1.00 0.00 O ATOM 962 CB LEU A 40 26.731 7.320 -14.072 1.00 0.00 C ATOM 963 CG LEU A 40 27.746 6.320 -13.510 1.00 0.00 C ATOM 964 CD1 LEU A 40 29.099 6.527 -14.193 1.00 0.00 C ATOM 965 CD2 LEU A 40 27.903 6.536 -12.002 1.00 0.00 C ATOM 0 H LEU A 40 25.060 5.493 -14.868 1.00 0.00 H new ATOM 0 HA LEU A 40 25.443 7.047 -12.364 1.00 0.00 H new ATOM 0 HB2 LEU A 40 26.674 7.224 -15.156 1.00 0.00 H new ATOM 0 HB3 LEU A 40 27.054 8.339 -13.858 1.00 0.00 H new ATOM 0 HG LEU A 40 27.392 5.306 -13.697 1.00 0.00 H new ATOM 0 HD11 LEU A 40 29.821 5.815 -13.793 1.00 0.00 H new ATOM 0 HD12 LEU A 40 28.992 6.371 -15.266 1.00 0.00 H new ATOM 0 HD13 LEU A 40 29.449 7.542 -14.007 1.00 0.00 H new ATOM 0 HD21 LEU A 40 28.626 5.823 -11.606 1.00 0.00 H new ATOM 0 HD22 LEU A 40 28.254 7.551 -11.814 1.00 0.00 H new ATOM 0 HD23 LEU A 40 26.941 6.388 -11.511 1.00 0.00 H new ATOM 966 N ASP A 41 23.796 8.122 -15.024 1.00 0.00 N ATOM 967 CA ASP A 41 22.859 9.213 -15.439 1.00 0.00 C ATOM 968 C ASP A 41 22.031 8.780 -16.661 1.00 0.00 C ATOM 969 O ASP A 41 22.533 8.100 -17.555 1.00 0.00 O ATOM 970 CB ASP A 41 23.666 10.463 -15.796 1.00 0.00 C ATOM 971 CG ASP A 41 22.764 11.696 -15.710 1.00 0.00 C ATOM 972 OD1 ASP A 41 21.833 11.780 -16.495 1.00 0.00 O ATOM 973 OD2 ASP A 41 23.018 12.533 -14.860 1.00 0.00 O ATOM 0 H ASP A 41 23.918 7.368 -15.700 1.00 0.00 H new ATOM 0 HA ASP A 41 22.181 9.426 -14.612 1.00 0.00 H new ATOM 0 HB2 ASP A 41 24.511 10.570 -15.116 1.00 0.00 H new ATOM 0 HB3 ASP A 41 24.076 10.369 -16.802 1.00 0.00 H new ATOM 974 N ILE A 42 20.774 9.166 -16.724 1.00 0.00 N ATOM 975 CA ILE A 42 19.932 8.782 -17.893 1.00 0.00 C ATOM 976 C ILE A 42 19.429 10.056 -18.586 1.00 0.00 C ATOM 977 O ILE A 42 18.638 10.809 -18.019 1.00 0.00 O ATOM 978 CB ILE A 42 18.738 7.952 -17.414 1.00 0.00 C ATOM 979 CG1 ILE A 42 19.238 6.777 -16.568 1.00 0.00 C ATOM 980 CG2 ILE A 42 17.969 7.416 -18.622 1.00 0.00 C ATOM 981 CD1 ILE A 42 18.056 6.130 -15.845 1.00 0.00 C ATOM 0 H ILE A 42 20.302 9.728 -16.016 1.00 0.00 H new ATOM 0 HA ILE A 42 20.521 8.190 -18.594 1.00 0.00 H new ATOM 0 HB ILE A 42 18.080 8.580 -16.813 1.00 0.00 H new ATOM 0 HG12 ILE A 42 19.735 6.044 -17.203 1.00 0.00 H new ATOM 0 HG13 ILE A 42 19.975 7.124 -15.844 1.00 0.00 H new ATOM 0 HG21 ILE A 42 17.119 6.825 -18.280 1.00 0.00 H new ATOM 0 HG22 ILE A 42 17.611 8.251 -19.225 1.00 0.00 H new ATOM 0 HG23 ILE A 42 18.627 6.789 -19.224 1.00 0.00 H new ATOM 0 HD11 ILE A 42 18.411 5.294 -15.243 1.00 0.00 H new ATOM 0 HD12 ILE A 42 17.578 6.866 -15.198 1.00 0.00 H new ATOM 0 HD13 ILE A 42 17.335 5.769 -16.578 1.00 0.00 H new ATOM 982 N LEU A 43 19.872 10.326 -19.795 1.00 0.00 N ATOM 983 CA LEU A 43 19.412 11.563 -20.496 1.00 0.00 C ATOM 984 C LEU A 43 18.208 11.242 -21.394 1.00 0.00 C ATOM 985 O LEU A 43 18.331 10.509 -22.373 1.00 0.00 O ATOM 986 CB LEU A 43 20.551 12.124 -21.355 1.00 0.00 C ATOM 987 CG LEU A 43 21.743 12.478 -20.464 1.00 0.00 C ATOM 988 CD1 LEU A 43 22.735 11.314 -20.448 1.00 0.00 C ATOM 989 CD2 LEU A 43 22.436 13.728 -21.012 1.00 0.00 C ATOM 0 H LEU A 43 20.527 9.746 -20.320 1.00 0.00 H new ATOM 0 HA LEU A 43 19.118 12.302 -19.751 1.00 0.00 H new ATOM 0 HB2 LEU A 43 20.850 11.391 -22.104 1.00 0.00 H new ATOM 0 HB3 LEU A 43 20.212 13.009 -21.893 1.00 0.00 H new ATOM 0 HG LEU A 43 21.392 12.670 -19.450 1.00 0.00 H new ATOM 0 HD11 LEU A 43 23.584 11.568 -19.813 1.00 0.00 H new ATOM 0 HD12 LEU A 43 22.244 10.423 -20.058 1.00 0.00 H new ATOM 0 HD13 LEU A 43 23.086 11.121 -21.462 1.00 0.00 H new ATOM 0 HD21 LEU A 43 23.285 13.981 -20.377 1.00 0.00 H new ATOM 0 HD22 LEU A 43 22.785 13.535 -22.026 1.00 0.00 H new ATOM 0 HD23 LEU A 43 21.731 14.559 -21.023 1.00 0.00 H new ATOM 990 N VAL A 44 17.047 11.784 -21.091 1.00 0.00 N ATOM 991 CA VAL A 44 15.850 11.513 -21.943 1.00 0.00 C ATOM 992 C VAL A 44 15.480 12.803 -22.686 1.00 0.00 C ATOM 993 O VAL A 44 15.886 13.893 -22.285 1.00 0.00 O ATOM 994 CB VAL A 44 14.668 11.070 -21.068 1.00 0.00 C ATOM 995 CG1 VAL A 44 13.571 10.475 -21.954 1.00 0.00 C ATOM 996 CG2 VAL A 44 15.127 10.010 -20.061 1.00 0.00 C ATOM 0 H VAL A 44 16.882 12.398 -20.294 1.00 0.00 H new ATOM 0 HA VAL A 44 16.077 10.718 -22.653 1.00 0.00 H new ATOM 0 HB VAL A 44 14.283 11.936 -20.530 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.732 10.161 -21.333 1.00 0.00 H new ATOM 0 HG12 VAL A 44 13.233 11.226 -22.668 1.00 0.00 H new ATOM 0 HG13 VAL A 44 13.966 9.614 -22.493 1.00 0.00 H new ATOM 0 HG21 VAL A 44 14.282 9.703 -19.445 1.00 0.00 H new ATOM 0 HG22 VAL A 44 15.519 9.145 -20.596 1.00 0.00 H new ATOM 0 HG23 VAL A 44 15.907 10.427 -19.424 1.00 0.00 H new ATOM 997 N SER A 45 14.725 12.719 -23.760 1.00 0.00 N ATOM 998 CA SER A 45 14.358 13.963 -24.503 1.00 0.00 C ATOM 999 C SER A 45 13.047 13.757 -25.277 1.00 0.00 C ATOM 1000 O SER A 45 12.591 12.629 -25.457 1.00 0.00 O ATOM 1001 CB SER A 45 15.475 14.313 -25.486 1.00 0.00 C ATOM 1002 OG SER A 45 15.168 15.544 -26.127 1.00 0.00 O ATOM 0 H SER A 45 14.353 11.852 -24.148 1.00 0.00 H new ATOM 0 HA SER A 45 14.223 14.774 -23.788 1.00 0.00 H new ATOM 0 HB2 SER A 45 16.427 14.391 -24.960 1.00 0.00 H new ATOM 0 HB3 SER A 45 15.584 13.521 -26.227 1.00 0.00 H new ATOM 0 HG SER A 45 15.883 15.772 -26.757 1.00 0.00 H new ATOM 1003 N ARG A 46 12.431 14.824 -25.742 1.00 0.00 N ATOM 1004 CA ARG A 46 11.158 14.676 -26.502 1.00 0.00 C ATOM 1005 C ARG A 46 11.207 15.547 -27.769 1.00 0.00 C ATOM 1006 O ARG A 46 10.207 16.148 -28.155 1.00 0.00 O ATOM 1007 CB ARG A 46 9.986 15.122 -25.625 1.00 0.00 C ATOM 1008 CG ARG A 46 9.649 14.017 -24.621 1.00 0.00 C ATOM 1009 CD ARG A 46 9.099 14.642 -23.338 1.00 0.00 C ATOM 1010 NE ARG A 46 7.891 15.453 -23.659 1.00 0.00 N ATOM 1011 CZ ARG A 46 6.701 14.954 -23.468 1.00 0.00 C ATOM 1012 NH1 ARG A 46 6.400 14.403 -22.324 1.00 0.00 N ATOM 1013 NH2 ARG A 46 5.811 15.006 -24.420 1.00 0.00 N ATOM 0 H ARG A 46 12.758 15.783 -25.625 1.00 0.00 H new ATOM 0 HA ARG A 46 11.027 13.632 -26.785 1.00 0.00 H new ATOM 0 HB2 ARG A 46 10.242 16.041 -25.098 1.00 0.00 H new ATOM 0 HB3 ARG A 46 9.117 15.342 -26.245 1.00 0.00 H new ATOM 0 HG2 ARG A 46 8.915 13.334 -25.049 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.540 13.429 -24.399 1.00 0.00 H new ATOM 0 HD2 ARG A 46 8.846 13.862 -22.620 1.00 0.00 H new ATOM 0 HD3 ARG A 46 9.858 15.270 -22.872 1.00 0.00 H new ATOM 0 HE ARG A 46 7.995 16.398 -24.028 1.00 0.00 H new ATOM 0 HH11 ARG A 46 7.095 14.362 -21.579 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.469 14.013 -22.175 1.00 0.00 H new ATOM 0 HH21 ARG A 46 6.045 15.437 -25.314 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.881 14.616 -24.270 1.00 0.00 H new ATOM 1014 N SER A 47 12.343 15.625 -28.432 1.00 0.00 N ATOM 1015 CA SER A 47 12.422 16.456 -29.674 1.00 0.00 C ATOM 1016 C SER A 47 12.054 15.578 -30.879 1.00 0.00 C ATOM 1017 O SER A 47 12.031 14.352 -30.774 1.00 0.00 O ATOM 1018 CB SER A 47 13.843 17.004 -29.848 1.00 0.00 C ATOM 1019 OG SER A 47 14.774 15.934 -29.754 1.00 0.00 O ATOM 0 H SER A 47 13.208 15.153 -28.167 1.00 0.00 H new ATOM 0 HA SER A 47 11.730 17.295 -29.600 1.00 0.00 H new ATOM 0 HB2 SER A 47 13.938 17.500 -30.814 1.00 0.00 H new ATOM 0 HB3 SER A 47 14.053 17.752 -29.083 1.00 0.00 H new ATOM 0 HG SER A 47 15.684 16.281 -29.867 1.00 0.00 H new ATOM 1020 N LEU A 48 11.761 16.164 -32.023 1.00 0.00 N ATOM 1021 CA LEU A 48 11.397 15.318 -33.208 1.00 0.00 C ATOM 1022 C LEU A 48 12.568 14.382 -33.536 1.00 0.00 C ATOM 1023 O LEU A 48 12.396 13.168 -33.635 1.00 0.00 O ATOM 1024 CB LEU A 48 11.093 16.192 -34.431 1.00 0.00 C ATOM 1025 CG LEU A 48 10.295 15.385 -35.453 1.00 0.00 C ATOM 1026 CD1 LEU A 48 9.364 16.322 -36.222 1.00 0.00 C ATOM 1027 CD2 LEU A 48 11.256 14.703 -36.430 1.00 0.00 C ATOM 0 H LEU A 48 11.758 17.171 -32.184 1.00 0.00 H new ATOM 0 HA LEU A 48 10.506 14.740 -32.963 1.00 0.00 H new ATOM 0 HB2 LEU A 48 10.529 17.074 -34.129 1.00 0.00 H new ATOM 0 HB3 LEU A 48 12.022 16.546 -34.878 1.00 0.00 H new ATOM 0 HG LEU A 48 9.705 14.627 -34.938 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.793 15.749 -36.952 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.680 16.807 -35.526 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.955 17.080 -36.737 1.00 0.00 H new ATOM 0 HD21 LEU A 48 10.686 14.127 -37.159 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.847 15.459 -36.947 1.00 0.00 H new ATOM 0 HD23 LEU A 48 11.921 14.036 -35.881 1.00 0.00 H new ATOM 1028 N LYS A 49 13.760 14.916 -33.705 1.00 0.00 N ATOM 1029 CA LYS A 49 14.929 14.034 -34.025 1.00 0.00 C ATOM 1030 C LYS A 49 15.126 13.016 -32.891 1.00 0.00 C ATOM 1031 O LYS A 49 15.421 11.849 -33.139 1.00 0.00 O ATOM 1032 CB LYS A 49 16.208 14.873 -34.175 1.00 0.00 C ATOM 1033 CG LYS A 49 16.249 15.501 -35.572 1.00 0.00 C ATOM 1034 CD LYS A 49 17.119 14.644 -36.495 1.00 0.00 C ATOM 1035 CE LYS A 49 18.575 15.102 -36.394 1.00 0.00 C ATOM 1036 NZ LYS A 49 19.308 14.708 -37.631 1.00 0.00 N ATOM 0 H LYS A 49 13.970 15.912 -33.636 1.00 0.00 H new ATOM 0 HA LYS A 49 14.731 13.516 -34.963 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.235 15.653 -33.414 1.00 0.00 H new ATOM 0 HB3 LYS A 49 17.086 14.246 -34.021 1.00 0.00 H new ATOM 0 HG2 LYS A 49 15.240 15.579 -35.976 1.00 0.00 H new ATOM 0 HG3 LYS A 49 16.649 16.513 -35.515 1.00 0.00 H new ATOM 0 HD2 LYS A 49 17.037 13.593 -36.217 1.00 0.00 H new ATOM 0 HD3 LYS A 49 16.770 14.730 -37.524 1.00 0.00 H new ATOM 0 HE2 LYS A 49 18.619 16.183 -36.262 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.048 14.654 -35.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.298 15.020 -37.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.277 13.674 -37.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 18.861 15.155 -38.457 1.00 0.00 H new ATOM 1037 N MET A 50 14.970 13.428 -31.649 1.00 0.00 N ATOM 1038 CA MET A 50 15.152 12.471 -30.521 1.00 0.00 C ATOM 1039 C MET A 50 13.778 12.092 -29.948 1.00 0.00 C ATOM 1040 O MET A 50 13.473 12.386 -28.793 1.00 0.00 O ATOM 1041 CB MET A 50 16.003 13.126 -29.430 1.00 0.00 C ATOM 1042 CG MET A 50 17.306 13.649 -30.039 1.00 0.00 C ATOM 1043 SD MET A 50 18.298 14.443 -28.750 1.00 0.00 S ATOM 1044 CE MET A 50 19.500 13.108 -28.536 1.00 0.00 C ATOM 0 H MET A 50 14.726 14.380 -31.377 1.00 0.00 H new ATOM 0 HA MET A 50 15.655 11.573 -30.880 1.00 0.00 H new ATOM 0 HB2 MET A 50 15.452 13.945 -28.967 1.00 0.00 H new ATOM 0 HB3 MET A 50 16.222 12.404 -28.643 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.865 12.828 -30.489 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.088 14.361 -30.835 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.224 13.389 -27.771 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.983 12.198 -28.230 1.00 0.00 H new ATOM 0 HE3 MET A 50 20.019 12.931 -29.478 1.00 0.00 H new ATOM 1045 N ARG A 51 12.936 11.448 -30.728 1.00 0.00 N ATOM 1046 CA ARG A 51 11.591 11.065 -30.213 1.00 0.00 C ATOM 1047 C ARG A 51 11.530 9.541 -30.019 1.00 0.00 C ATOM 1048 O ARG A 51 12.010 8.779 -30.855 1.00 0.00 O ATOM 1049 CB ARG A 51 10.517 11.497 -31.218 1.00 0.00 C ATOM 1050 CG ARG A 51 9.321 12.098 -30.471 1.00 0.00 C ATOM 1051 CD ARG A 51 8.575 13.076 -31.385 1.00 0.00 C ATOM 1052 NE ARG A 51 8.286 14.331 -30.636 1.00 0.00 N ATOM 1053 CZ ARG A 51 7.299 14.370 -29.782 1.00 0.00 C ATOM 1054 NH1 ARG A 51 6.083 14.592 -30.201 1.00 0.00 N ATOM 1055 NH2 ARG A 51 7.528 14.188 -28.511 1.00 0.00 N ATOM 0 H ARG A 51 13.127 11.175 -31.692 1.00 0.00 H new ATOM 0 HA ARG A 51 11.414 11.559 -29.258 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.929 12.229 -31.913 1.00 0.00 H new ATOM 0 HB3 ARG A 51 10.195 10.641 -31.811 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.648 11.305 -30.146 1.00 0.00 H new ATOM 0 HG3 ARG A 51 9.663 12.614 -29.574 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.176 13.296 -32.268 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.646 12.627 -31.736 1.00 0.00 H new ATOM 0 HE ARG A 51 8.859 15.160 -30.790 1.00 0.00 H new ATOM 0 HH11 ARG A 51 5.904 14.735 -31.195 1.00 0.00 H new ATOM 0 HH12 ARG A 51 5.312 14.623 -29.534 1.00 0.00 H new ATOM 0 HH21 ARG A 51 8.478 14.015 -28.184 1.00 0.00 H new ATOM 0 HH22 ARG A 51 6.757 14.219 -27.844 1.00 0.00 H new ATOM 1056 N GLY A 52 10.944 9.079 -28.935 1.00 0.00 N ATOM 1057 CA GLY A 52 10.854 7.607 -28.702 1.00 0.00 C ATOM 1058 C GLY A 52 12.262 7.008 -28.554 1.00 0.00 C ATOM 1059 O GLY A 52 12.525 5.902 -29.028 1.00 0.00 O ATOM 0 H GLY A 52 10.527 9.659 -28.207 1.00 0.00 H new ATOM 0 HA2 GLY A 52 10.270 7.408 -27.804 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.333 7.131 -29.533 1.00 0.00 H new ATOM 1060 N GLN A 53 13.177 7.700 -27.906 1.00 0.00 N ATOM 1061 CA GLN A 53 14.555 7.141 -27.741 1.00 0.00 C ATOM 1062 C GLN A 53 15.201 7.724 -26.472 1.00 0.00 C ATOM 1063 O GLN A 53 14.794 8.779 -25.989 1.00 0.00 O ATOM 1064 CB GLN A 53 15.404 7.506 -28.960 1.00 0.00 C ATOM 1065 CG GLN A 53 15.417 9.024 -29.145 1.00 0.00 C ATOM 1066 CD GLN A 53 16.539 9.411 -30.115 1.00 0.00 C ATOM 1067 OE1 GLN A 53 16.564 8.947 -31.253 1.00 0.00 O ATOM 1068 NE2 GLN A 53 17.477 10.242 -29.733 1.00 0.00 N ATOM 0 H GLN A 53 13.027 8.619 -27.489 1.00 0.00 H new ATOM 0 HA GLN A 53 14.496 6.056 -27.651 1.00 0.00 H new ATOM 0 HB2 GLN A 53 16.421 7.137 -28.830 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.002 7.025 -29.852 1.00 0.00 H new ATOM 0 HG2 GLN A 53 14.455 9.362 -29.531 1.00 0.00 H new ATOM 0 HG3 GLN A 53 15.566 9.517 -28.184 1.00 0.00 H new ATOM 0 HE21 GLN A 53 17.461 10.630 -28.790 1.00 0.00 H new ATOM 0 HE22 GLN A 53 18.223 10.501 -30.379 1.00 0.00 H new ATOM 1069 N ALA A 54 16.197 7.063 -25.917 1.00 0.00 N ATOM 1070 CA ALA A 54 16.842 7.600 -24.682 1.00 0.00 C ATOM 1071 C ALA A 54 18.304 7.129 -24.600 1.00 0.00 C ATOM 1072 O ALA A 54 18.754 6.323 -25.414 1.00 0.00 O ATOM 1073 CB ALA A 54 16.080 7.101 -23.452 1.00 0.00 C ATOM 0 H ALA A 54 16.583 6.186 -26.266 1.00 0.00 H new ATOM 0 HA ALA A 54 16.819 8.689 -24.715 1.00 0.00 H new ATOM 0 HB1 ALA A 54 16.550 7.492 -22.550 1.00 0.00 H new ATOM 0 HB2 ALA A 54 15.046 7.443 -23.501 1.00 0.00 H new ATOM 0 HB3 ALA A 54 16.101 6.011 -23.429 1.00 0.00 H new ATOM 1074 N PHE A 55 19.057 7.611 -23.633 1.00 0.00 N ATOM 1075 CA PHE A 55 20.481 7.184 -23.509 1.00 0.00 C ATOM 1076 C PHE A 55 20.757 6.753 -22.062 1.00 0.00 C ATOM 1077 O PHE A 55 20.592 7.542 -21.133 1.00 0.00 O ATOM 1078 CB PHE A 55 21.401 8.357 -23.857 1.00 0.00 C ATOM 1079 CG PHE A 55 21.309 8.667 -25.331 1.00 0.00 C ATOM 1080 CD1 PHE A 55 20.126 9.189 -25.866 1.00 0.00 C ATOM 1081 CD2 PHE A 55 22.413 8.442 -26.163 1.00 0.00 C ATOM 1082 CE1 PHE A 55 20.046 9.486 -27.232 1.00 0.00 C ATOM 1083 CE2 PHE A 55 22.333 8.736 -27.529 1.00 0.00 C ATOM 1084 CZ PHE A 55 21.149 9.259 -28.064 1.00 0.00 C ATOM 0 H PHE A 55 18.742 8.279 -22.930 1.00 0.00 H new ATOM 0 HA PHE A 55 20.668 6.353 -24.190 1.00 0.00 H new ATOM 0 HB2 PHE A 55 21.121 9.235 -23.274 1.00 0.00 H new ATOM 0 HB3 PHE A 55 22.430 8.114 -23.592 1.00 0.00 H new ATOM 0 HD1 PHE A 55 19.274 9.363 -25.225 1.00 0.00 H new ATOM 0 HD2 PHE A 55 23.327 8.041 -25.750 1.00 0.00 H new ATOM 0 HE1 PHE A 55 19.133 9.890 -27.644 1.00 0.00 H new ATOM 0 HE2 PHE A 55 23.184 8.560 -28.170 1.00 0.00 H new ATOM 0 HZ PHE A 55 21.087 9.487 -29.118 1.00 0.00 H new ATOM 1085 N VAL A 56 21.185 5.528 -21.840 1.00 0.00 N ATOM 1086 CA VAL A 56 21.473 5.089 -20.443 1.00 0.00 C ATOM 1087 C VAL A 56 22.993 4.960 -20.267 1.00 0.00 C ATOM 1088 O VAL A 56 23.670 4.347 -21.092 1.00 0.00 O ATOM 1089 CB VAL A 56 20.801 3.739 -20.173 1.00 0.00 C ATOM 1090 CG1 VAL A 56 21.094 3.292 -18.737 1.00 0.00 C ATOM 1091 CG2 VAL A 56 19.289 3.876 -20.364 1.00 0.00 C ATOM 0 H VAL A 56 21.344 4.824 -22.561 1.00 0.00 H new ATOM 0 HA VAL A 56 21.082 5.822 -19.738 1.00 0.00 H new ATOM 0 HB VAL A 56 21.193 2.997 -20.868 1.00 0.00 H new ATOM 0 HG11 VAL A 56 20.614 2.331 -18.550 1.00 0.00 H new ATOM 0 HG12 VAL A 56 22.171 3.192 -18.599 1.00 0.00 H new ATOM 0 HG13 VAL A 56 20.706 4.034 -18.039 1.00 0.00 H new ATOM 0 HG21 VAL A 56 18.810 2.916 -20.172 1.00 0.00 H new ATOM 0 HG22 VAL A 56 18.901 4.621 -19.669 1.00 0.00 H new ATOM 0 HG23 VAL A 56 19.078 4.189 -21.387 1.00 0.00 H new ATOM 1092 N ILE A 57 23.549 5.524 -19.217 1.00 0.00 N ATOM 1093 CA ILE A 57 25.023 5.423 -19.017 1.00 0.00 C ATOM 1094 C ILE A 57 25.315 4.418 -17.896 1.00 0.00 C ATOM 1095 O ILE A 57 24.606 4.375 -16.890 1.00 0.00 O ATOM 1096 CB ILE A 57 25.600 6.792 -18.628 1.00 0.00 C ATOM 1097 CG1 ILE A 57 25.011 7.901 -19.520 1.00 0.00 C ATOM 1098 CG2 ILE A 57 27.121 6.762 -18.791 1.00 0.00 C ATOM 1099 CD1 ILE A 57 25.322 7.626 -20.996 1.00 0.00 C ATOM 0 H ILE A 57 23.046 6.045 -18.498 1.00 0.00 H new ATOM 0 HA ILE A 57 25.485 5.091 -19.947 1.00 0.00 H new ATOM 0 HB ILE A 57 25.339 7.003 -17.591 1.00 0.00 H new ATOM 0 HG12 ILE A 57 23.932 7.958 -19.374 1.00 0.00 H new ATOM 0 HG13 ILE A 57 25.424 8.867 -19.229 1.00 0.00 H new ATOM 0 HG21 ILE A 57 27.536 7.732 -18.516 1.00 0.00 H new ATOM 0 HG22 ILE A 57 27.541 5.991 -18.145 1.00 0.00 H new ATOM 0 HG23 ILE A 57 27.371 6.541 -19.829 1.00 0.00 H new ATOM 0 HD11 ILE A 57 24.898 8.420 -21.611 1.00 0.00 H new ATOM 0 HD12 ILE A 57 26.402 7.593 -21.140 1.00 0.00 H new ATOM 0 HD13 ILE A 57 24.887 6.670 -21.287 1.00 0.00 H new ATOM 1100 N PHE A 58 26.340 3.606 -18.038 1.00 0.00 N ATOM 1101 CA PHE A 58 26.657 2.618 -16.970 1.00 0.00 C ATOM 1102 C PHE A 58 28.037 2.936 -16.376 1.00 0.00 C ATOM 1103 O PHE A 58 28.946 3.357 -17.089 1.00 0.00 O ATOM 1104 CB PHE A 58 26.673 1.209 -17.567 1.00 0.00 C ATOM 1105 CG PHE A 58 25.338 0.543 -17.327 1.00 0.00 C ATOM 1106 CD1 PHE A 58 24.970 0.152 -16.033 1.00 0.00 C ATOM 1107 CD2 PHE A 58 24.470 0.312 -18.400 1.00 0.00 C ATOM 1108 CE1 PHE A 58 23.734 -0.468 -15.814 1.00 0.00 C ATOM 1109 CE2 PHE A 58 23.234 -0.308 -18.181 1.00 0.00 C ATOM 1110 CZ PHE A 58 22.867 -0.698 -16.887 1.00 0.00 C ATOM 0 H PHE A 58 26.964 3.590 -18.845 1.00 0.00 H new ATOM 0 HA PHE A 58 25.901 2.672 -16.187 1.00 0.00 H new ATOM 0 HB2 PHE A 58 26.880 1.258 -18.636 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.471 0.620 -17.115 1.00 0.00 H new ATOM 0 HD1 PHE A 58 25.640 0.329 -15.204 1.00 0.00 H new ATOM 0 HD2 PHE A 58 24.754 0.612 -19.398 1.00 0.00 H new ATOM 0 HE1 PHE A 58 23.450 -0.769 -14.816 1.00 0.00 H new ATOM 0 HE2 PHE A 58 22.564 -0.485 -19.009 1.00 0.00 H new ATOM 0 HZ PHE A 58 21.914 -1.177 -16.718 1.00 0.00 H new ATOM 1111 N LYS A 59 28.221 2.745 -15.086 1.00 0.00 N ATOM 1112 CA LYS A 59 29.556 3.044 -14.467 1.00 0.00 C ATOM 1113 C LYS A 59 30.664 2.318 -15.249 1.00 0.00 C ATOM 1114 O LYS A 59 31.739 2.872 -15.475 1.00 0.00 O ATOM 1115 CB LYS A 59 29.585 2.575 -13.005 1.00 0.00 C ATOM 1116 CG LYS A 59 30.790 3.191 -12.293 1.00 0.00 C ATOM 1117 CD LYS A 59 31.307 2.220 -11.229 1.00 0.00 C ATOM 1118 CE LYS A 59 30.255 2.061 -10.129 1.00 0.00 C ATOM 1119 NZ LYS A 59 30.854 1.346 -8.967 1.00 0.00 N ATOM 0 H LYS A 59 27.511 2.398 -14.441 1.00 0.00 H new ATOM 0 HA LYS A 59 29.721 4.121 -14.502 1.00 0.00 H new ATOM 0 HB2 LYS A 59 28.664 2.866 -12.501 1.00 0.00 H new ATOM 0 HB3 LYS A 59 29.641 1.487 -12.962 1.00 0.00 H new ATOM 0 HG2 LYS A 59 31.578 3.411 -13.013 1.00 0.00 H new ATOM 0 HG3 LYS A 59 30.508 4.137 -11.831 1.00 0.00 H new ATOM 0 HD2 LYS A 59 31.526 1.252 -11.680 1.00 0.00 H new ATOM 0 HD3 LYS A 59 32.239 2.592 -10.804 1.00 0.00 H new ATOM 0 HE2 LYS A 59 29.888 3.039 -9.818 1.00 0.00 H new ATOM 0 HE3 LYS A 59 29.398 1.505 -10.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 30.139 1.238 -8.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 31.183 0.407 -9.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 31.659 1.893 -8.600 1.00 0.00 H new ATOM 1120 N GLU A 60 30.427 1.094 -15.670 1.00 0.00 N ATOM 1121 CA GLU A 60 31.468 0.358 -16.434 1.00 0.00 C ATOM 1122 C GLU A 60 30.875 -0.120 -17.767 1.00 0.00 C ATOM 1123 O GLU A 60 29.683 -0.410 -17.859 1.00 0.00 O ATOM 1124 CB GLU A 60 31.947 -0.847 -15.621 1.00 0.00 C ATOM 1125 CG GLU A 60 32.571 -0.362 -14.311 1.00 0.00 C ATOM 1126 CD GLU A 60 33.262 -1.533 -13.608 1.00 0.00 C ATOM 1127 OE1 GLU A 60 32.560 -2.391 -13.100 1.00 0.00 O ATOM 1128 OE2 GLU A 60 34.481 -1.552 -13.592 1.00 0.00 O ATOM 0 H GLU A 60 29.559 0.582 -15.514 1.00 0.00 H new ATOM 0 HA GLU A 60 32.314 1.018 -16.627 1.00 0.00 H new ATOM 0 HB2 GLU A 60 31.111 -1.515 -15.413 1.00 0.00 H new ATOM 0 HB3 GLU A 60 32.677 -1.419 -16.194 1.00 0.00 H new ATOM 0 HG2 GLU A 60 33.291 0.431 -14.511 1.00 0.00 H new ATOM 0 HG3 GLU A 60 31.802 0.061 -13.665 1.00 0.00 H new ATOM 1129 N VAL A 61 31.676 -0.203 -18.806 1.00 0.00 N ATOM 1130 CA VAL A 61 31.136 -0.659 -20.128 1.00 0.00 C ATOM 1131 C VAL A 61 30.569 -2.084 -20.006 1.00 0.00 C ATOM 1132 O VAL A 61 29.589 -2.421 -20.666 1.00 0.00 O ATOM 1133 CB VAL A 61 32.245 -0.631 -21.192 1.00 0.00 C ATOM 1134 CG1 VAL A 61 31.679 -1.065 -22.549 1.00 0.00 C ATOM 1135 CG2 VAL A 61 32.807 0.794 -21.298 1.00 0.00 C ATOM 0 H VAL A 61 32.671 0.023 -18.796 1.00 0.00 H new ATOM 0 HA VAL A 61 30.337 0.018 -20.430 1.00 0.00 H new ATOM 0 HB VAL A 61 33.040 -1.319 -20.904 1.00 0.00 H new ATOM 0 HG11 VAL A 61 32.471 -1.042 -23.298 1.00 0.00 H new ATOM 0 HG12 VAL A 61 31.282 -2.077 -22.471 1.00 0.00 H new ATOM 0 HG13 VAL A 61 30.881 -0.384 -22.845 1.00 0.00 H new ATOM 0 HG21 VAL A 61 33.594 0.820 -22.051 1.00 0.00 H new ATOM 0 HG22 VAL A 61 32.009 1.480 -21.583 1.00 0.00 H new ATOM 0 HG23 VAL A 61 33.217 1.096 -20.334 1.00 0.00 H new ATOM 1136 N SER A 62 31.154 -2.930 -19.188 1.00 0.00 N ATOM 1137 CA SER A 62 30.618 -4.326 -19.055 1.00 0.00 C ATOM 1138 C SER A 62 29.167 -4.281 -18.543 1.00 0.00 C ATOM 1139 O SER A 62 28.330 -5.073 -18.969 1.00 0.00 O ATOM 1140 CB SER A 62 31.473 -5.136 -18.073 1.00 0.00 C ATOM 1141 OG SER A 62 31.157 -4.745 -16.743 1.00 0.00 O ATOM 0 H SER A 62 31.970 -2.718 -18.613 1.00 0.00 H new ATOM 0 HA SER A 62 30.649 -4.803 -20.034 1.00 0.00 H new ATOM 0 HB2 SER A 62 31.288 -6.202 -18.205 1.00 0.00 H new ATOM 0 HB3 SER A 62 32.532 -4.970 -18.272 1.00 0.00 H new ATOM 0 HG SER A 62 31.700 -5.262 -16.112 1.00 0.00 H new ATOM 1142 N SER A 63 28.848 -3.382 -17.634 1.00 0.00 N ATOM 1143 CA SER A 63 27.440 -3.320 -17.108 1.00 0.00 C ATOM 1144 C SER A 63 26.446 -3.059 -18.256 1.00 0.00 C ATOM 1145 O SER A 63 25.325 -3.570 -18.240 1.00 0.00 O ATOM 1146 CB SER A 63 27.310 -2.201 -16.068 1.00 0.00 C ATOM 1147 OG SER A 63 28.510 -2.120 -15.311 1.00 0.00 O ATOM 0 H SER A 63 29.492 -2.697 -17.238 1.00 0.00 H new ATOM 0 HA SER A 63 27.210 -4.279 -16.643 1.00 0.00 H new ATOM 0 HB2 SER A 63 27.114 -1.250 -16.563 1.00 0.00 H new ATOM 0 HB3 SER A 63 26.464 -2.398 -15.410 1.00 0.00 H new ATOM 0 HG SER A 63 28.430 -1.404 -14.647 1.00 0.00 H new ATOM 1148 N ALA A 64 26.821 -2.287 -19.257 1.00 0.00 N ATOM 1149 CA ALA A 64 25.872 -2.027 -20.384 1.00 0.00 C ATOM 1150 C ALA A 64 25.753 -3.291 -21.240 1.00 0.00 C ATOM 1151 O ALA A 64 24.684 -3.589 -21.769 1.00 0.00 O ATOM 1152 CB ALA A 64 26.370 -0.863 -21.253 1.00 0.00 C ATOM 0 H ALA A 64 27.731 -1.834 -19.338 1.00 0.00 H new ATOM 0 HA ALA A 64 24.898 -1.760 -19.973 1.00 0.00 H new ATOM 0 HB1 ALA A 64 25.666 -0.690 -22.067 1.00 0.00 H new ATOM 0 HB2 ALA A 64 26.450 0.038 -20.644 1.00 0.00 H new ATOM 0 HB3 ALA A 64 27.348 -1.110 -21.666 1.00 0.00 H new ATOM 1153 N THR A 65 26.821 -4.048 -21.389 1.00 0.00 N ATOM 1154 CA THR A 65 26.729 -5.288 -22.213 1.00 0.00 C ATOM 1155 C THR A 65 25.663 -6.221 -21.613 1.00 0.00 C ATOM 1156 O THR A 65 24.906 -6.861 -22.341 1.00 0.00 O ATOM 1157 CB THR A 65 28.082 -6.015 -22.250 1.00 0.00 C ATOM 1158 OG1 THR A 65 29.116 -5.074 -22.502 1.00 0.00 O ATOM 1159 CG2 THR A 65 28.066 -7.068 -23.359 1.00 0.00 C ATOM 0 H THR A 65 27.736 -3.859 -20.980 1.00 0.00 H new ATOM 0 HA THR A 65 26.453 -5.013 -23.231 1.00 0.00 H new ATOM 0 HB THR A 65 28.260 -6.503 -21.292 1.00 0.00 H new ATOM 0 HG1 THR A 65 29.980 -5.536 -22.524 1.00 0.00 H new ATOM 0 HG21 THR A 65 29.026 -7.584 -23.385 1.00 0.00 H new ATOM 0 HG22 THR A 65 27.272 -7.789 -23.165 1.00 0.00 H new ATOM 0 HG23 THR A 65 27.889 -6.583 -24.319 1.00 0.00 H new ATOM 1160 N ASN A 66 25.579 -6.309 -20.299 1.00 0.00 N ATOM 1161 CA ASN A 66 24.544 -7.200 -19.679 1.00 0.00 C ATOM 1162 C ASN A 66 23.150 -6.595 -19.910 1.00 0.00 C ATOM 1163 O ASN A 66 22.187 -7.319 -20.150 1.00 0.00 O ATOM 1164 CB ASN A 66 24.792 -7.342 -18.171 1.00 0.00 C ATOM 1165 CG ASN A 66 24.531 -8.792 -17.743 1.00 0.00 C ATOM 1166 OD1 ASN A 66 25.395 -9.729 -18.046 1.00 0.00 O flip ATOM 1167 ND2 ASN A 66 23.513 -9.080 -17.116 1.00 0.00 N flip ATOM 0 H ASN A 66 26.175 -5.808 -19.640 1.00 0.00 H new ATOM 0 HA ASN A 66 24.605 -8.186 -20.140 1.00 0.00 H new ATOM 0 HB2 ASN A 66 25.818 -7.060 -17.932 1.00 0.00 H new ATOM 0 HB3 ASN A 66 24.139 -6.666 -17.619 1.00 0.00 H new ATOM 0 HD21 ASN A 66 22.838 -8.353 -16.878 1.00 0.00 H new ATOM 0 HD22 ASN A 66 23.344 -10.045 -16.834 1.00 0.00 H new ATOM 1168 N ALA A 67 23.014 -5.284 -19.850 1.00 0.00 N ATOM 1169 CA ALA A 67 21.666 -4.667 -20.082 1.00 0.00 C ATOM 1170 C ALA A 67 21.340 -4.579 -21.594 1.00 0.00 C ATOM 1171 O ALA A 67 20.244 -4.155 -21.962 1.00 0.00 O ATOM 1172 CB ALA A 67 21.628 -3.255 -19.484 1.00 0.00 C ATOM 0 H ALA A 67 23.768 -4.626 -19.653 1.00 0.00 H new ATOM 0 HA ALA A 67 20.923 -5.301 -19.599 1.00 0.00 H new ATOM 0 HB1 ALA A 67 20.647 -2.813 -19.656 1.00 0.00 H new ATOM 0 HB2 ALA A 67 21.819 -3.309 -18.412 1.00 0.00 H new ATOM 0 HB3 ALA A 67 22.392 -2.638 -19.958 1.00 0.00 H new ATOM 1173 N LEU A 68 22.243 -4.957 -22.484 1.00 0.00 N ATOM 1174 CA LEU A 68 21.931 -4.869 -23.944 1.00 0.00 C ATOM 1175 C LEU A 68 21.445 -6.233 -24.458 1.00 0.00 C ATOM 1176 O LEU A 68 20.469 -6.313 -25.201 1.00 0.00 O ATOM 1177 CB LEU A 68 23.192 -4.459 -24.712 1.00 0.00 C ATOM 1178 CG LEU A 68 22.840 -4.198 -26.179 1.00 0.00 C ATOM 1179 CD1 LEU A 68 22.625 -2.699 -26.393 1.00 0.00 C ATOM 1180 CD2 LEU A 68 23.985 -4.681 -27.073 1.00 0.00 C ATOM 0 H LEU A 68 23.170 -5.318 -22.258 1.00 0.00 H new ATOM 0 HA LEU A 68 21.148 -4.126 -24.098 1.00 0.00 H new ATOM 0 HB2 LEU A 68 23.626 -3.563 -24.267 1.00 0.00 H new ATOM 0 HB3 LEU A 68 23.944 -5.245 -24.643 1.00 0.00 H new ATOM 0 HG LEU A 68 21.927 -4.737 -26.434 1.00 0.00 H new ATOM 0 HD11 LEU A 68 22.374 -2.513 -27.437 1.00 0.00 H new ATOM 0 HD12 LEU A 68 21.810 -2.354 -25.757 1.00 0.00 H new ATOM 0 HD13 LEU A 68 23.537 -2.160 -26.137 1.00 0.00 H new ATOM 0 HD21 LEU A 68 23.734 -4.495 -28.117 1.00 0.00 H new ATOM 0 HD22 LEU A 68 24.898 -4.143 -26.818 1.00 0.00 H new ATOM 0 HD23 LEU A 68 24.139 -5.749 -26.921 1.00 0.00 H new ATOM 1181 N ARG A 69 22.102 -7.312 -24.084 1.00 0.00 N ATOM 1182 CA ARG A 69 21.656 -8.657 -24.570 1.00 0.00 C ATOM 1183 C ARG A 69 20.488 -9.152 -23.705 1.00 0.00 C ATOM 1184 O ARG A 69 19.511 -9.694 -24.215 1.00 0.00 O ATOM 1185 CB ARG A 69 22.813 -9.662 -24.488 1.00 0.00 C ATOM 1186 CG ARG A 69 24.031 -9.099 -25.221 1.00 0.00 C ATOM 1187 CD ARG A 69 25.147 -10.145 -25.236 1.00 0.00 C ATOM 1188 NE ARG A 69 25.958 -9.991 -26.477 1.00 0.00 N ATOM 1189 CZ ARG A 69 25.727 -10.756 -27.509 1.00 0.00 C ATOM 1190 NH1 ARG A 69 26.182 -11.979 -27.531 1.00 0.00 N ATOM 1191 NH2 ARG A 69 25.042 -10.297 -28.520 1.00 0.00 N ATOM 0 H ARG A 69 22.917 -7.317 -23.471 1.00 0.00 H new ATOM 0 HA ARG A 69 21.335 -8.569 -25.608 1.00 0.00 H new ATOM 0 HB2 ARG A 69 23.063 -9.861 -23.446 1.00 0.00 H new ATOM 0 HB3 ARG A 69 22.515 -10.612 -24.932 1.00 0.00 H new ATOM 0 HG2 ARG A 69 23.761 -8.826 -26.241 1.00 0.00 H new ATOM 0 HG3 ARG A 69 24.377 -8.190 -24.729 1.00 0.00 H new ATOM 0 HD2 ARG A 69 25.782 -10.027 -24.358 1.00 0.00 H new ATOM 0 HD3 ARG A 69 24.721 -11.147 -25.190 1.00 0.00 H new ATOM 0 HE ARG A 69 26.695 -9.287 -26.520 1.00 0.00 H new ATOM 0 HH11 ARG A 69 26.719 -12.338 -26.741 1.00 0.00 H new ATOM 0 HH12 ARG A 69 26.001 -12.576 -28.338 1.00 0.00 H new ATOM 0 HH21 ARG A 69 24.687 -9.341 -28.504 1.00 0.00 H new ATOM 0 HH22 ARG A 69 24.861 -10.894 -29.327 1.00 0.00 H new ATOM 1192 N SER A 70 20.568 -8.977 -22.406 1.00 0.00 N ATOM 1193 CA SER A 70 19.448 -9.441 -21.521 1.00 0.00 C ATOM 1194 C SER A 70 18.161 -8.657 -21.838 1.00 0.00 C ATOM 1195 O SER A 70 17.059 -9.190 -21.709 1.00 0.00 O ATOM 1196 CB SER A 70 19.813 -9.230 -20.046 1.00 0.00 C ATOM 1197 OG SER A 70 20.864 -10.118 -19.690 1.00 0.00 O ATOM 0 H SER A 70 21.352 -8.538 -21.923 1.00 0.00 H new ATOM 0 HA SER A 70 19.283 -10.503 -21.705 1.00 0.00 H new ATOM 0 HB2 SER A 70 20.122 -8.198 -19.880 1.00 0.00 H new ATOM 0 HB3 SER A 70 18.942 -9.408 -19.415 1.00 0.00 H new ATOM 0 HG SER A 70 21.168 -9.917 -18.780 1.00 0.00 H new ATOM 1198 N MET A 71 18.261 -7.408 -22.252 1.00 0.00 N ATOM 1199 CA MET A 71 17.031 -6.627 -22.566 1.00 0.00 C ATOM 1200 C MET A 71 16.842 -6.548 -24.090 1.00 0.00 C ATOM 1201 O MET A 71 16.412 -5.522 -24.616 1.00 0.00 O ATOM 1202 CB MET A 71 17.167 -5.212 -22.000 1.00 0.00 C ATOM 1203 CG MET A 71 17.098 -5.260 -20.473 1.00 0.00 C ATOM 1204 SD MET A 71 15.396 -5.589 -19.953 1.00 0.00 S ATOM 1205 CE MET A 71 14.650 -4.092 -20.646 1.00 0.00 C ATOM 0 H MET A 71 19.139 -6.906 -22.383 1.00 0.00 H new ATOM 0 HA MET A 71 16.168 -7.120 -22.118 1.00 0.00 H new ATOM 0 HB2 MET A 71 18.112 -4.772 -22.317 1.00 0.00 H new ATOM 0 HB3 MET A 71 16.372 -4.576 -22.390 1.00 0.00 H new ATOM 0 HG2 MET A 71 17.762 -6.037 -20.093 1.00 0.00 H new ATOM 0 HG3 MET A 71 17.441 -4.314 -20.053 1.00 0.00 H new ATOM 0 HE1 MET A 71 13.687 -3.911 -20.169 1.00 0.00 H new ATOM 0 HE2 MET A 71 15.309 -3.242 -20.469 1.00 0.00 H new ATOM 0 HE3 MET A 71 14.505 -4.221 -21.719 1.00 0.00 H new ATOM 1206 N GLN A 72 17.151 -7.603 -24.815 1.00 0.00 N ATOM 1207 CA GLN A 72 16.977 -7.559 -26.301 1.00 0.00 C ATOM 1208 C GLN A 72 15.492 -7.744 -26.644 1.00 0.00 C ATOM 1209 O GLN A 72 14.946 -8.840 -26.508 1.00 0.00 O ATOM 1210 CB GLN A 72 17.794 -8.677 -26.965 1.00 0.00 C ATOM 1211 CG GLN A 72 18.235 -8.235 -28.362 1.00 0.00 C ATOM 1212 CD GLN A 72 19.690 -7.753 -28.313 1.00 0.00 C ATOM 1213 OE1 GLN A 72 20.528 -8.373 -27.662 1.00 0.00 O ATOM 1214 NE2 GLN A 72 20.044 -6.674 -28.968 1.00 0.00 N ATOM 0 H GLN A 72 17.512 -8.482 -24.444 1.00 0.00 H new ATOM 0 HA GLN A 72 17.327 -6.595 -26.671 1.00 0.00 H new ATOM 0 HB2 GLN A 72 18.666 -8.914 -26.356 1.00 0.00 H new ATOM 0 HB3 GLN A 72 17.196 -9.586 -27.033 1.00 0.00 H new ATOM 0 HG2 GLN A 72 18.139 -9.063 -29.064 1.00 0.00 H new ATOM 0 HG3 GLN A 72 17.588 -7.435 -28.723 1.00 0.00 H new ATOM 0 HE21 GLN A 72 19.352 -6.156 -29.510 1.00 0.00 H new ATOM 0 HE22 GLN A 72 21.011 -6.352 -28.936 1.00 0.00 H new ATOM 1215 N GLY A 73 14.819 -6.703 -27.085 1.00 0.00 N ATOM 1216 CA GLY A 73 13.374 -6.840 -27.427 1.00 0.00 C ATOM 1217 C GLY A 73 12.565 -7.075 -26.143 1.00 0.00 C ATOM 1218 O GLY A 73 11.882 -8.089 -26.006 1.00 0.00 O ATOM 0 H GLY A 73 15.211 -5.771 -27.220 1.00 0.00 H new ATOM 0 HA2 GLY A 73 13.022 -5.941 -27.932 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.230 -7.671 -28.118 1.00 0.00 H new ATOM 1219 N PHE A 74 12.626 -6.164 -25.195 1.00 0.00 N ATOM 1220 CA PHE A 74 11.859 -6.356 -23.929 1.00 0.00 C ATOM 1221 C PHE A 74 10.590 -5.483 -23.949 1.00 0.00 C ATOM 1222 O PHE A 74 10.429 -4.653 -24.841 1.00 0.00 O ATOM 1223 CB PHE A 74 12.737 -5.961 -22.736 1.00 0.00 C ATOM 1224 CG PHE A 74 13.204 -7.205 -22.014 1.00 0.00 C ATOM 1225 CD1 PHE A 74 13.943 -8.176 -22.701 1.00 0.00 C ATOM 1226 CD2 PHE A 74 12.898 -7.387 -20.660 1.00 0.00 C ATOM 1227 CE1 PHE A 74 14.375 -9.329 -22.033 1.00 0.00 C ATOM 1228 CE2 PHE A 74 13.330 -8.539 -19.993 1.00 0.00 C ATOM 1229 CZ PHE A 74 14.068 -9.511 -20.680 1.00 0.00 C ATOM 0 H PHE A 74 13.171 -5.304 -25.247 1.00 0.00 H new ATOM 0 HA PHE A 74 11.570 -7.403 -23.838 1.00 0.00 H new ATOM 0 HB2 PHE A 74 13.596 -5.384 -23.079 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.175 -5.322 -22.054 1.00 0.00 H new ATOM 0 HD1 PHE A 74 14.180 -8.036 -23.745 1.00 0.00 H new ATOM 0 HD2 PHE A 74 12.328 -6.638 -20.130 1.00 0.00 H new ATOM 0 HE1 PHE A 74 14.945 -10.078 -22.563 1.00 0.00 H new ATOM 0 HE2 PHE A 74 13.094 -8.678 -18.948 1.00 0.00 H new ATOM 0 HZ PHE A 74 14.400 -10.401 -20.166 1.00 0.00 H new ATOM 1230 N PRO A 75 9.711 -5.681 -22.977 1.00 0.00 N ATOM 1231 CA PRO A 75 8.458 -4.909 -22.887 1.00 0.00 C ATOM 1232 C PRO A 75 8.716 -3.524 -22.267 1.00 0.00 C ATOM 1233 O PRO A 75 9.451 -3.398 -21.290 1.00 0.00 O ATOM 1234 CB PRO A 75 7.577 -5.756 -21.963 1.00 0.00 C ATOM 1235 CG PRO A 75 8.535 -6.638 -21.130 1.00 0.00 C ATOM 1236 CD PRO A 75 9.872 -6.682 -21.892 1.00 0.00 C ATOM 0 HA PRO A 75 8.002 -4.727 -23.860 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.972 -5.122 -21.315 1.00 0.00 H new ATOM 0 HB3 PRO A 75 6.887 -6.371 -22.541 1.00 0.00 H new ATOM 0 HG2 PRO A 75 8.672 -6.224 -20.131 1.00 0.00 H new ATOM 0 HG3 PRO A 75 8.127 -7.641 -21.006 1.00 0.00 H new ATOM 0 HD2 PRO A 75 10.709 -6.431 -21.241 1.00 0.00 H new ATOM 0 HD3 PRO A 75 10.068 -7.676 -22.294 1.00 0.00 H new ATOM 1237 N PHE A 76 8.125 -2.482 -22.811 1.00 0.00 N ATOM 1238 CA PHE A 76 8.340 -1.117 -22.241 1.00 0.00 C ATOM 1239 C PHE A 76 7.130 -0.228 -22.577 1.00 0.00 C ATOM 1240 O PHE A 76 6.952 0.180 -23.724 1.00 0.00 O ATOM 1241 CB PHE A 76 9.608 -0.506 -22.845 1.00 0.00 C ATOM 1242 CG PHE A 76 10.359 0.264 -21.783 1.00 0.00 C ATOM 1243 CD1 PHE A 76 10.705 -0.362 -20.580 1.00 0.00 C ATOM 1244 CD2 PHE A 76 10.707 1.603 -22.001 1.00 0.00 C ATOM 1245 CE1 PHE A 76 11.401 0.350 -19.596 1.00 0.00 C ATOM 1246 CE2 PHE A 76 11.403 2.314 -21.016 1.00 0.00 C ATOM 1247 CZ PHE A 76 11.749 1.688 -19.814 1.00 0.00 C ATOM 0 H PHE A 76 7.507 -2.521 -23.621 1.00 0.00 H new ATOM 0 HA PHE A 76 8.451 -1.186 -21.159 1.00 0.00 H new ATOM 0 HB2 PHE A 76 10.242 -1.292 -23.255 1.00 0.00 H new ATOM 0 HB3 PHE A 76 9.347 0.156 -23.671 1.00 0.00 H new ATOM 0 HD1 PHE A 76 10.435 -1.394 -20.411 1.00 0.00 H new ATOM 0 HD2 PHE A 76 10.439 2.087 -22.928 1.00 0.00 H new ATOM 0 HE1 PHE A 76 11.670 -0.133 -18.668 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.673 3.346 -21.184 1.00 0.00 H new ATOM 0 HZ PHE A 76 12.285 2.237 -19.054 1.00 0.00 H new ATOM 1248 N TYR A 77 6.292 0.074 -21.609 1.00 0.00 N ATOM 1249 CA TYR A 77 5.101 0.927 -21.892 1.00 0.00 C ATOM 1250 C TYR A 77 4.231 0.261 -22.969 1.00 0.00 C ATOM 1251 O TYR A 77 3.770 0.916 -23.901 1.00 0.00 O ATOM 1252 CB TYR A 77 5.561 2.305 -22.371 1.00 0.00 C ATOM 1253 CG TYR A 77 6.236 3.019 -21.229 1.00 0.00 C ATOM 1254 CD1 TYR A 77 7.594 2.803 -20.972 1.00 0.00 C ATOM 1255 CD2 TYR A 77 5.500 3.891 -20.421 1.00 0.00 C ATOM 1256 CE1 TYR A 77 8.218 3.460 -19.907 1.00 0.00 C ATOM 1257 CE2 TYR A 77 6.121 4.550 -19.354 1.00 0.00 C ATOM 1258 CZ TYR A 77 7.480 4.334 -19.096 1.00 0.00 C ATOM 1259 OH TYR A 77 8.093 4.981 -18.045 1.00 0.00 O ATOM 0 H TYR A 77 6.385 -0.234 -20.641 1.00 0.00 H new ATOM 0 HA TYR A 77 4.513 1.042 -20.982 1.00 0.00 H new ATOM 0 HB2 TYR A 77 6.249 2.202 -23.210 1.00 0.00 H new ATOM 0 HB3 TYR A 77 4.709 2.884 -22.727 1.00 0.00 H new ATOM 0 HD1 TYR A 77 8.161 2.128 -21.597 1.00 0.00 H new ATOM 0 HD2 TYR A 77 4.451 4.056 -20.620 1.00 0.00 H new ATOM 0 HE1 TYR A 77 9.267 3.295 -19.709 1.00 0.00 H new ATOM 0 HE2 TYR A 77 5.553 5.224 -18.730 1.00 0.00 H new ATOM 0 HH TYR A 77 7.612 4.785 -17.214 1.00 0.00 H new ATOM 1260 N ASP A 78 3.992 -1.029 -22.860 1.00 0.00 N ATOM 1261 CA ASP A 78 3.147 -1.723 -23.877 1.00 0.00 C ATOM 1262 C ASP A 78 3.754 -1.533 -25.276 1.00 0.00 C ATOM 1263 O ASP A 78 3.181 -0.849 -26.123 1.00 0.00 O ATOM 1264 CB ASP A 78 1.733 -1.136 -23.847 1.00 0.00 C ATOM 1265 CG ASP A 78 0.938 -1.780 -22.709 1.00 0.00 C ATOM 1266 OD1 ASP A 78 1.221 -1.468 -21.564 1.00 0.00 O ATOM 1267 OD2 ASP A 78 0.060 -2.574 -23.002 1.00 0.00 O ATOM 0 H ASP A 78 4.347 -1.625 -22.112 1.00 0.00 H new ATOM 0 HA ASP A 78 3.106 -2.788 -23.647 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.779 -0.056 -23.707 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.234 -1.313 -24.800 1.00 0.00 H new ATOM 1268 N LYS A 79 4.898 -2.128 -25.546 1.00 0.00 N ATOM 1269 CA LYS A 79 5.518 -1.971 -26.904 1.00 0.00 C ATOM 1270 C LYS A 79 6.867 -2.720 -26.960 1.00 0.00 C ATOM 1271 O LYS A 79 7.530 -2.861 -25.934 1.00 0.00 O ATOM 1272 CB LYS A 79 5.754 -0.480 -27.192 1.00 0.00 C ATOM 1273 CG LYS A 79 4.735 0.020 -28.223 1.00 0.00 C ATOM 1274 CD LYS A 79 5.409 1.013 -29.173 1.00 0.00 C ATOM 1275 CE LYS A 79 4.601 1.110 -30.468 1.00 0.00 C ATOM 1276 NZ LYS A 79 5.147 0.148 -31.467 1.00 0.00 N ATOM 0 H LYS A 79 5.423 -2.709 -24.892 1.00 0.00 H new ATOM 0 HA LYS A 79 4.844 -2.389 -27.652 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.665 0.096 -26.271 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.767 -0.329 -27.566 1.00 0.00 H new ATOM 0 HG2 LYS A 79 4.331 -0.821 -28.787 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.896 0.498 -27.717 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.479 1.993 -28.701 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.427 0.690 -29.391 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.551 0.891 -30.272 1.00 0.00 H new ATOM 0 HE3 LYS A 79 4.646 2.125 -30.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 4.598 0.213 -32.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 6.143 0.377 -31.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.082 -0.819 -31.089 1.00 0.00 H new ATOM 1277 N PRO A 80 7.257 -3.179 -28.137 1.00 0.00 N ATOM 1278 CA PRO A 80 8.532 -3.901 -28.305 1.00 0.00 C ATOM 1279 C PRO A 80 9.700 -2.903 -28.332 1.00 0.00 C ATOM 1280 O PRO A 80 9.624 -1.871 -28.997 1.00 0.00 O ATOM 1281 CB PRO A 80 8.379 -4.601 -29.658 1.00 0.00 C ATOM 1282 CG PRO A 80 7.305 -3.810 -30.441 1.00 0.00 C ATOM 1283 CD PRO A 80 6.487 -3.028 -29.398 1.00 0.00 C ATOM 0 HA PRO A 80 8.742 -4.601 -27.496 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.325 -4.611 -30.199 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.077 -5.640 -29.526 1.00 0.00 H new ATOM 0 HG2 PRO A 80 7.769 -3.132 -31.157 1.00 0.00 H new ATOM 0 HG3 PRO A 80 6.665 -4.485 -31.009 1.00 0.00 H new ATOM 0 HD2 PRO A 80 6.384 -1.980 -29.678 1.00 0.00 H new ATOM 0 HD3 PRO A 80 5.479 -3.432 -29.299 1.00 0.00 H new ATOM 1284 N MET A 81 10.775 -3.177 -27.624 1.00 0.00 N ATOM 1285 CA MET A 81 11.920 -2.219 -27.627 1.00 0.00 C ATOM 1286 C MET A 81 13.244 -2.966 -27.868 1.00 0.00 C ATOM 1287 O MET A 81 13.622 -3.852 -27.101 1.00 0.00 O ATOM 1288 CB MET A 81 11.977 -1.479 -26.283 1.00 0.00 C ATOM 1289 CG MET A 81 12.236 -2.465 -25.140 1.00 0.00 C ATOM 1290 SD MET A 81 13.894 -2.189 -24.471 1.00 0.00 S ATOM 1291 CE MET A 81 13.371 -1.630 -22.834 1.00 0.00 C ATOM 0 H MET A 81 10.904 -4.012 -27.053 1.00 0.00 H new ATOM 0 HA MET A 81 11.774 -1.499 -28.432 1.00 0.00 H new ATOM 0 HB2 MET A 81 12.765 -0.727 -26.308 1.00 0.00 H new ATOM 0 HB3 MET A 81 11.039 -0.952 -26.111 1.00 0.00 H new ATOM 0 HG2 MET A 81 11.490 -2.334 -24.356 1.00 0.00 H new ATOM 0 HG3 MET A 81 12.144 -3.489 -25.501 1.00 0.00 H new ATOM 0 HE1 MET A 81 14.243 -1.533 -22.187 1.00 0.00 H new ATOM 0 HE2 MET A 81 12.874 -0.664 -22.921 1.00 0.00 H new ATOM 0 HE3 MET A 81 12.680 -2.356 -22.405 1.00 0.00 H new ATOM 1292 N ARG A 82 13.967 -2.615 -28.912 1.00 0.00 N ATOM 1293 CA ARG A 82 15.268 -3.293 -29.181 1.00 0.00 C ATOM 1294 C ARG A 82 16.399 -2.386 -28.683 1.00 0.00 C ATOM 1295 O ARG A 82 16.295 -1.162 -28.756 1.00 0.00 O ATOM 1296 CB ARG A 82 15.425 -3.529 -30.685 1.00 0.00 C ATOM 1297 CG ARG A 82 14.530 -4.693 -31.115 1.00 0.00 C ATOM 1298 CD ARG A 82 14.812 -5.041 -32.578 1.00 0.00 C ATOM 1299 NE ARG A 82 15.855 -6.104 -32.644 1.00 0.00 N ATOM 1300 CZ ARG A 82 15.663 -7.159 -33.387 1.00 0.00 C ATOM 1301 NH1 ARG A 82 15.001 -8.179 -32.915 1.00 0.00 N ATOM 1302 NH2 ARG A 82 16.134 -7.194 -34.604 1.00 0.00 N ATOM 0 H ARG A 82 13.708 -1.891 -29.582 1.00 0.00 H new ATOM 0 HA ARG A 82 15.302 -4.254 -28.667 1.00 0.00 H new ATOM 0 HB2 ARG A 82 15.156 -2.627 -31.235 1.00 0.00 H new ATOM 0 HB3 ARG A 82 16.466 -3.749 -30.923 1.00 0.00 H new ATOM 0 HG2 ARG A 82 14.715 -5.561 -30.482 1.00 0.00 H new ATOM 0 HG3 ARG A 82 13.481 -4.424 -30.990 1.00 0.00 H new ATOM 0 HD2 ARG A 82 13.898 -5.383 -33.064 1.00 0.00 H new ATOM 0 HD3 ARG A 82 15.147 -4.154 -33.116 1.00 0.00 H new ATOM 0 HE ARG A 82 16.718 -6.007 -32.109 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.633 -8.152 -31.964 1.00 0.00 H new ATOM 0 HH12 ARG A 82 14.851 -9.003 -33.497 1.00 0.00 H new ATOM 0 HH21 ARG A 82 16.652 -6.397 -34.974 1.00 0.00 H new ATOM 0 HH22 ARG A 82 15.984 -8.019 -35.185 1.00 0.00 H new ATOM 1303 N ILE A 83 17.469 -2.944 -28.162 1.00 0.00 N ATOM 1304 CA ILE A 83 18.573 -2.078 -27.656 1.00 0.00 C ATOM 1305 C ILE A 83 19.831 -2.247 -28.518 1.00 0.00 C ATOM 1306 O ILE A 83 20.242 -3.360 -28.838 1.00 0.00 O ATOM 1307 CB ILE A 83 18.897 -2.450 -26.210 1.00 0.00 C ATOM 1308 CG1 ILE A 83 17.615 -2.396 -25.374 1.00 0.00 C ATOM 1309 CG2 ILE A 83 19.916 -1.455 -25.650 1.00 0.00 C ATOM 1310 CD1 ILE A 83 17.917 -2.858 -23.949 1.00 0.00 C ATOM 0 H ILE A 83 17.620 -3.948 -28.068 1.00 0.00 H new ATOM 0 HA ILE A 83 18.248 -1.039 -27.706 1.00 0.00 H new ATOM 0 HB ILE A 83 19.313 -3.457 -26.172 1.00 0.00 H new ATOM 0 HG12 ILE A 83 17.218 -1.381 -25.362 1.00 0.00 H new ATOM 0 HG13 ILE A 83 16.850 -3.032 -25.820 1.00 0.00 H new ATOM 0 HG21 ILE A 83 20.150 -1.716 -24.618 1.00 0.00 H new ATOM 0 HG22 ILE A 83 20.826 -1.490 -26.249 1.00 0.00 H new ATOM 0 HG23 ILE A 83 19.498 -0.449 -25.684 1.00 0.00 H new ATOM 0 HD11 ILE A 83 17.005 -2.820 -23.353 1.00 0.00 H new ATOM 0 HD12 ILE A 83 18.294 -3.880 -23.970 1.00 0.00 H new ATOM 0 HD13 ILE A 83 18.668 -2.204 -23.506 1.00 0.00 H new ATOM 1311 N GLN A 84 20.462 -1.155 -28.890 1.00 0.00 N ATOM 1312 CA GLN A 84 21.700 -1.236 -29.715 1.00 0.00 C ATOM 1313 C GLN A 84 22.764 -0.346 -29.061 1.00 0.00 C ATOM 1314 O GLN A 84 22.448 0.732 -28.560 1.00 0.00 O ATOM 1315 CB GLN A 84 21.421 -0.723 -31.132 1.00 0.00 C ATOM 1316 CG GLN A 84 20.203 -1.438 -31.727 1.00 0.00 C ATOM 1317 CD GLN A 84 19.339 -0.426 -32.494 1.00 0.00 C ATOM 1318 OE1 GLN A 84 19.055 -0.622 -33.674 1.00 0.00 O ATOM 1319 NE2 GLN A 84 18.899 0.652 -31.890 1.00 0.00 N ATOM 0 H GLN A 84 20.166 -0.208 -28.653 1.00 0.00 H new ATOM 0 HA GLN A 84 22.040 -2.270 -29.774 1.00 0.00 H new ATOM 0 HB2 GLN A 84 21.244 0.352 -31.108 1.00 0.00 H new ATOM 0 HB3 GLN A 84 22.293 -0.889 -31.764 1.00 0.00 H new ATOM 0 HG2 GLN A 84 20.527 -2.236 -32.395 1.00 0.00 H new ATOM 0 HG3 GLN A 84 19.618 -1.904 -30.934 1.00 0.00 H new ATOM 0 HE21 GLN A 84 19.132 0.819 -30.911 1.00 0.00 H new ATOM 0 HE22 GLN A 84 18.324 1.323 -32.399 1.00 0.00 H new ATOM 1320 N TYR A 85 24.016 -0.756 -29.042 1.00 0.00 N ATOM 1321 CA TYR A 85 25.068 0.105 -28.398 1.00 0.00 C ATOM 1322 C TYR A 85 24.994 1.530 -28.978 1.00 0.00 C ATOM 1323 O TYR A 85 24.303 1.769 -29.966 1.00 0.00 O ATOM 1324 CB TYR A 85 26.471 -0.470 -28.650 1.00 0.00 C ATOM 1325 CG TYR A 85 26.773 -1.572 -27.655 1.00 0.00 C ATOM 1326 CD1 TYR A 85 26.515 -1.390 -26.285 1.00 0.00 C ATOM 1327 CD2 TYR A 85 27.319 -2.781 -28.105 1.00 0.00 C ATOM 1328 CE1 TYR A 85 26.804 -2.415 -25.376 1.00 0.00 C ATOM 1329 CE2 TYR A 85 27.606 -3.804 -27.194 1.00 0.00 C ATOM 1330 CZ TYR A 85 27.349 -3.621 -25.831 1.00 0.00 C ATOM 1331 OH TYR A 85 27.636 -4.631 -24.936 1.00 0.00 O ATOM 0 H TYR A 85 24.351 -1.635 -29.438 1.00 0.00 H new ATOM 0 HA TYR A 85 24.885 0.129 -27.324 1.00 0.00 H new ATOM 0 HB2 TYR A 85 26.535 -0.860 -29.666 1.00 0.00 H new ATOM 0 HB3 TYR A 85 27.216 0.321 -28.565 1.00 0.00 H new ATOM 0 HD1 TYR A 85 26.094 -0.460 -25.934 1.00 0.00 H new ATOM 0 HD2 TYR A 85 27.519 -2.924 -29.157 1.00 0.00 H new ATOM 0 HE1 TYR A 85 26.606 -2.275 -24.324 1.00 0.00 H new ATOM 0 HE2 TYR A 85 28.026 -4.735 -27.543 1.00 0.00 H new ATOM 0 HH TYR A 85 28.240 -4.292 -24.243 1.00 0.00 H new ATOM 1332 N ALA A 86 25.682 2.483 -28.385 1.00 0.00 N ATOM 1333 CA ALA A 86 25.625 3.878 -28.914 1.00 0.00 C ATOM 1334 C ALA A 86 26.744 4.088 -29.945 1.00 0.00 C ATOM 1335 O ALA A 86 27.584 3.214 -30.150 1.00 0.00 O ATOM 1336 CB ALA A 86 25.792 4.881 -27.767 1.00 0.00 C ATOM 0 H ALA A 86 26.274 2.352 -27.565 1.00 0.00 H new ATOM 0 HA ALA A 86 24.658 4.036 -29.391 1.00 0.00 H new ATOM 0 HB1 ALA A 86 25.749 5.896 -28.162 1.00 0.00 H new ATOM 0 HB2 ALA A 86 24.991 4.740 -27.041 1.00 0.00 H new ATOM 0 HB3 ALA A 86 26.755 4.721 -27.281 1.00 0.00 H new ATOM 1337 N LYS A 87 26.777 5.229 -30.602 1.00 0.00 N ATOM 1338 CA LYS A 87 27.845 5.476 -31.614 1.00 0.00 C ATOM 1339 C LYS A 87 28.999 6.252 -30.963 1.00 0.00 C ATOM 1340 O LYS A 87 30.168 5.932 -31.172 1.00 0.00 O ATOM 1341 CB LYS A 87 27.279 6.294 -32.779 1.00 0.00 C ATOM 1342 CG LYS A 87 26.015 5.618 -33.317 1.00 0.00 C ATOM 1343 CD LYS A 87 25.257 6.598 -34.215 1.00 0.00 C ATOM 1344 CE LYS A 87 23.879 6.024 -34.549 1.00 0.00 C ATOM 1345 NZ LYS A 87 24.033 4.891 -35.506 1.00 0.00 N ATOM 0 H LYS A 87 26.112 5.992 -30.478 1.00 0.00 H new ATOM 0 HA LYS A 87 28.210 4.520 -31.988 1.00 0.00 H new ATOM 0 HB2 LYS A 87 27.049 7.306 -32.447 1.00 0.00 H new ATOM 0 HB3 LYS A 87 28.023 6.380 -33.571 1.00 0.00 H new ATOM 0 HG2 LYS A 87 26.280 4.723 -33.879 1.00 0.00 H new ATOM 0 HG3 LYS A 87 25.380 5.299 -32.490 1.00 0.00 H new ATOM 0 HD2 LYS A 87 25.150 7.560 -33.713 1.00 0.00 H new ATOM 0 HD3 LYS A 87 25.820 6.778 -35.131 1.00 0.00 H new ATOM 0 HE2 LYS A 87 23.385 5.682 -33.640 1.00 0.00 H new ATOM 0 HE3 LYS A 87 23.246 6.798 -34.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 23.094 4.555 -35.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 24.563 5.212 -36.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 24.550 4.115 -35.045 1.00 0.00 H new ATOM 1346 N THR A 88 28.703 7.269 -30.182 1.00 0.00 N ATOM 1347 CA THR A 88 29.794 8.051 -29.534 1.00 0.00 C ATOM 1348 C THR A 88 29.976 7.580 -28.084 1.00 0.00 C ATOM 1349 O THR A 88 29.256 6.701 -27.613 1.00 0.00 O ATOM 1350 CB THR A 88 29.435 9.540 -29.546 1.00 0.00 C ATOM 1351 OG1 THR A 88 28.073 9.698 -29.176 1.00 0.00 O ATOM 1352 CG2 THR A 88 29.653 10.111 -30.947 1.00 0.00 C ATOM 0 H THR A 88 27.757 7.585 -29.970 1.00 0.00 H new ATOM 0 HA THR A 88 30.723 7.897 -30.084 1.00 0.00 H new ATOM 0 HB THR A 88 30.071 10.072 -28.838 1.00 0.00 H new ATOM 0 HG1 THR A 88 27.841 10.650 -29.181 1.00 0.00 H new ATOM 0 HG21 THR A 88 29.397 11.170 -30.952 1.00 0.00 H new ATOM 0 HG22 THR A 88 30.698 9.989 -31.231 1.00 0.00 H new ATOM 0 HG23 THR A 88 29.020 9.581 -31.658 1.00 0.00 H new ATOM 1353 N ASP A 89 30.920 8.144 -27.361 1.00 0.00 N ATOM 1354 CA ASP A 89 31.130 7.718 -25.948 1.00 0.00 C ATOM 1355 C ASP A 89 30.478 8.741 -25.005 1.00 0.00 C ATOM 1356 O ASP A 89 29.885 9.720 -25.454 1.00 0.00 O ATOM 1357 CB ASP A 89 32.631 7.636 -25.656 1.00 0.00 C ATOM 1358 CG ASP A 89 33.255 6.526 -26.503 1.00 0.00 C ATOM 1359 OD1 ASP A 89 33.110 5.372 -26.132 1.00 0.00 O ATOM 1360 OD2 ASP A 89 33.870 6.847 -27.507 1.00 0.00 O ATOM 0 H ASP A 89 31.548 8.877 -27.692 1.00 0.00 H new ATOM 0 HA ASP A 89 30.677 6.739 -25.792 1.00 0.00 H new ATOM 0 HB2 ASP A 89 33.108 8.590 -25.879 1.00 0.00 H new ATOM 0 HB3 ASP A 89 32.796 7.437 -24.597 1.00 0.00 H new ATOM 1361 N SER A 90 30.571 8.539 -23.707 1.00 0.00 N ATOM 1362 CA SER A 90 29.950 9.510 -22.759 1.00 0.00 C ATOM 1363 C SER A 90 31.051 10.313 -22.050 1.00 0.00 C ATOM 1364 O SER A 90 32.197 9.875 -21.970 1.00 0.00 O ATOM 1365 CB SER A 90 29.117 8.747 -21.725 1.00 0.00 C ATOM 1366 OG SER A 90 27.767 9.191 -21.793 1.00 0.00 O ATOM 0 H SER A 90 31.047 7.749 -23.272 1.00 0.00 H new ATOM 0 HA SER A 90 29.305 10.196 -23.308 1.00 0.00 H new ATOM 0 HB2 SER A 90 29.170 7.675 -21.917 1.00 0.00 H new ATOM 0 HB3 SER A 90 29.517 8.912 -20.725 1.00 0.00 H new ATOM 0 HG SER A 90 27.450 9.413 -20.893 1.00 0.00 H new ATOM 1367 N ASP A 91 30.732 11.480 -21.532 1.00 0.00 N ATOM 1368 CA ASP A 91 31.766 12.294 -20.834 1.00 0.00 C ATOM 1369 C ASP A 91 31.750 12.007 -19.325 1.00 0.00 C ATOM 1370 O ASP A 91 32.774 12.154 -18.659 1.00 0.00 O ATOM 1371 CB ASP A 91 31.509 13.785 -21.076 1.00 0.00 C ATOM 1372 CG ASP A 91 32.673 14.602 -20.512 1.00 0.00 C ATOM 1373 OD1 ASP A 91 33.790 14.387 -20.951 1.00 0.00 O ATOM 1374 OD2 ASP A 91 32.427 15.428 -19.649 1.00 0.00 O ATOM 0 H ASP A 91 29.802 11.897 -21.566 1.00 0.00 H new ATOM 0 HA ASP A 91 32.744 12.025 -21.233 1.00 0.00 H new ATOM 0 HB2 ASP A 91 31.399 13.977 -22.143 1.00 0.00 H new ATOM 0 HB3 ASP A 91 30.576 14.086 -20.600 1.00 0.00 H new ATOM 1375 N ILE A 92 30.632 11.595 -18.756 1.00 0.00 N ATOM 1376 CA ILE A 92 30.628 11.298 -17.293 1.00 0.00 C ATOM 1377 C ILE A 92 31.703 10.232 -16.981 1.00 0.00 C ATOM 1378 O ILE A 92 32.250 10.207 -15.881 1.00 0.00 O ATOM 1379 CB ILE A 92 29.244 10.800 -16.854 1.00 0.00 C ATOM 1380 CG1 ILE A 92 28.895 9.509 -17.601 1.00 0.00 C ATOM 1381 CG2 ILE A 92 28.196 11.871 -17.167 1.00 0.00 C ATOM 1382 CD1 ILE A 92 29.203 8.305 -16.707 1.00 0.00 C ATOM 0 H ILE A 92 29.743 11.456 -19.237 1.00 0.00 H new ATOM 0 HA ILE A 92 30.856 12.210 -16.742 1.00 0.00 H new ATOM 0 HB ILE A 92 29.256 10.601 -15.782 1.00 0.00 H new ATOM 0 HG12 ILE A 92 27.841 9.510 -17.878 1.00 0.00 H new ATOM 0 HG13 ILE A 92 29.468 9.445 -18.526 1.00 0.00 H new ATOM 0 HG21 ILE A 92 27.212 11.519 -16.856 1.00 0.00 H new ATOM 0 HG22 ILE A 92 28.440 12.787 -16.630 1.00 0.00 H new ATOM 0 HG23 ILE A 92 28.188 12.070 -18.239 1.00 0.00 H new ATOM 0 HD11 ILE A 92 28.955 7.385 -17.237 1.00 0.00 H new ATOM 0 HD12 ILE A 92 30.263 8.303 -16.452 1.00 0.00 H new ATOM 0 HD13 ILE A 92 28.611 8.369 -15.794 1.00 0.00 H new ATOM 1383 N ILE A 93 32.050 9.367 -17.929 1.00 0.00 N ATOM 1384 CA ILE A 93 33.120 8.356 -17.643 1.00 0.00 C ATOM 1385 C ILE A 93 34.432 9.127 -17.459 1.00 0.00 C ATOM 1386 O ILE A 93 35.199 8.872 -16.538 1.00 0.00 O ATOM 1387 CB ILE A 93 33.326 7.338 -18.797 1.00 0.00 C ATOM 1388 CG1 ILE A 93 32.060 7.078 -19.640 1.00 0.00 C ATOM 1389 CG2 ILE A 93 33.786 6.010 -18.199 1.00 0.00 C ATOM 1390 CD1 ILE A 93 30.840 6.856 -18.750 1.00 0.00 C ATOM 0 H ILE A 93 31.643 9.325 -18.864 1.00 0.00 H new ATOM 0 HA ILE A 93 32.822 7.790 -16.760 1.00 0.00 H new ATOM 0 HB ILE A 93 34.068 7.773 -19.467 1.00 0.00 H new ATOM 0 HG12 ILE A 93 31.881 7.925 -20.302 1.00 0.00 H new ATOM 0 HG13 ILE A 93 32.215 6.205 -20.274 1.00 0.00 H new ATOM 0 HG21 ILE A 93 33.935 5.284 -18.998 1.00 0.00 H new ATOM 0 HG22 ILE A 93 34.724 6.158 -17.663 1.00 0.00 H new ATOM 0 HG23 ILE A 93 33.028 5.640 -17.509 1.00 0.00 H new ATOM 0 HD11 ILE A 93 29.964 6.675 -19.372 1.00 0.00 H new ATOM 0 HD12 ILE A 93 31.012 5.994 -18.106 1.00 0.00 H new ATOM 0 HD13 ILE A 93 30.672 7.740 -18.135 1.00 0.00 H new