==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANDROGEN RECEPTOR 27-DEC-01 1GS4 . COMPND 2 MOLECULE: ANDROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.M.MATIAS,M.A.CARRONDO,R.COELHO,M.THOMAZ,X.-Y.ZHAO,A.WEGG, . 244 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11804.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 77.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 5 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 139 57.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 1 0 0 2 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 670 A Q 0 0 126 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 -94.0 18.4 7.6 25.4 2 671 A P > + 0 0 71 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.326 360.0 105.5 -86.4 10.5 16.7 7.7 22.0 3 672 A I H > S+ 0 0 112 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.933 76.7 48.8 -60.5 -48.3 13.3 8.1 23.7 4 673 A F H > S+ 0 0 28 -3,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.929 116.1 43.0 -57.1 -49.2 12.8 11.8 22.9 5 674 A L H > S+ 0 0 29 -4,-0.3 4,-2.7 1,-0.2 5,-0.4 0.867 107.2 59.8 -67.0 -36.2 13.7 11.4 19.3 6 675 A N H X S+ 0 0 82 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.946 109.8 45.6 -53.7 -42.9 11.6 8.2 18.9 7 676 A V H X S+ 0 0 43 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.959 111.8 48.9 -66.9 -49.8 8.7 10.3 19.9 8 677 A L H X S+ 0 0 3 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.902 114.3 46.6 -58.7 -42.0 9.4 13.3 17.7 9 678 A E H >< S+ 0 0 86 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.916 112.0 51.0 -67.0 -41.1 9.9 11.1 14.7 10 679 A A H 3< S+ 0 0 85 -4,-2.3 -2,-0.2 -5,-0.4 -1,-0.2 0.871 113.8 42.9 -69.5 -30.2 6.7 9.1 15.4 11 680 A I H 3< S+ 0 0 38 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.606 79.2 125.9 -93.1 -1.7 4.5 12.2 15.7 12 681 A E << - 0 0 64 -4,-0.8 -3,-0.0 -3,-0.6 -4,-0.0 -0.275 64.2-122.1 -56.9 121.6 5.9 14.1 12.7 13 682 A P - 0 0 44 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.216 25.0-129.7 -61.5 156.8 2.9 14.9 10.5 14 683 A G - 0 0 58 1,-0.2 2,-0.1 31,-0.0 31,-0.0 -0.158 46.9 -42.5 -92.9-166.0 2.9 13.7 6.9 15 684 A V - 0 0 115 -2,-0.1 2,-0.4 81,-0.0 -1,-0.2 -0.364 51.0-164.6 -62.5 132.9 2.2 15.5 3.6 16 685 A V - 0 0 21 -3,-0.1 2,-0.2 -2,-0.1 26,-0.1 -0.986 8.7-146.3-117.3 127.7 -0.7 18.0 3.5 17 686 A C - 0 0 58 -2,-0.4 24,-0.1 79,-0.2 79,-0.0 -0.673 9.5-144.1 -89.6 156.9 -2.1 19.2 0.1 18 687 A A - 0 0 2 -2,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.635 33.3-127.5 -86.4 -24.6 -3.5 22.7 -0.4 19 688 A G + 0 0 50 1,-0.2 80,-0.0 18,-0.1 -2,-0.0 0.605 48.2 170.3 81.6 16.0 -6.2 21.5 -2.7 20 689 A H - 0 0 14 1,-0.1 2,-1.0 14,-0.1 -1,-0.2 -0.331 36.7-132.8 -65.2 140.7 -5.0 24.1 -5.2 21 690 A D > - 0 0 68 1,-0.1 3,-1.8 9,-0.1 -1,-0.1 -0.800 19.7-171.5 -90.9 95.8 -6.4 24.0 -8.8 22 691 A N T 3 S+ 0 0 79 -2,-1.0 -1,-0.1 1,-0.3 4,-0.1 0.547 78.1 72.9 -72.1 -3.3 -3.2 24.3 -10.8 23 692 A N T 3 S+ 0 0 129 2,-0.1 -1,-0.3 -3,-0.0 3,-0.1 0.608 81.7 96.5 -82.4 -10.8 -5.3 24.8 -14.0 24 693 A Q S < S- 0 0 73 -3,-1.8 3,-0.0 1,-0.1 -4,-0.0 -0.514 89.7-101.7 -73.9 139.2 -6.2 28.2 -12.7 25 694 A P - 0 0 111 0, 0.0 2,-1.0 0, 0.0 -1,-0.1 -0.366 45.2-102.2 -58.2 145.1 -4.2 31.3 -13.9 26 695 A D + 0 0 32 -4,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.644 61.7 160.9 -72.8 98.8 -1.7 32.4 -11.2 27 696 A S > - 0 0 43 -2,-1.0 4,-2.4 1,-0.1 5,-0.3 -0.873 51.1-115.0-124.0 153.5 -3.5 35.3 -9.6 28 697 A F H > S+ 0 0 17 -2,-0.3 4,-2.2 1,-0.2 5,-0.3 0.933 114.3 44.5 -50.8 -58.6 -3.1 37.1 -6.2 29 698 A A H > S+ 0 0 21 1,-0.2 4,-1.9 2,-0.2 189,-0.3 0.920 115.0 47.3 -58.9 -46.6 -6.6 36.1 -4.9 30 699 A A H > S+ 0 0 11 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.908 113.3 48.2 -66.4 -35.5 -6.4 32.5 -6.0 31 700 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.968 114.9 42.0 -70.4 -51.0 -2.9 31.9 -4.6 32 701 A H H X S+ 0 0 10 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.867 111.7 58.4 -66.8 -27.7 -3.4 33.4 -1.2 33 702 A S H X S+ 0 0 27 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.943 109.4 43.5 -62.1 -44.9 -6.8 31.6 -1.1 34 703 A S H X S+ 0 0 14 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.876 111.9 53.6 -66.0 -39.7 -5.0 28.3 -1.6 35 704 A L H X S+ 0 0 25 -4,-2.7 4,-3.2 1,-0.2 -1,-0.2 0.901 108.4 49.4 -64.2 -37.9 -2.4 29.2 1.0 36 705 A N H X S+ 0 0 23 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.875 111.3 48.9 -65.4 -39.8 -5.0 30.0 3.6 37 706 A E H X S+ 0 0 71 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.924 112.0 49.7 -66.2 -42.6 -6.7 26.7 2.9 38 707 A L H X S+ 0 0 6 -4,-2.9 4,-2.9 1,-0.2 5,-0.3 0.949 108.6 53.2 -54.1 -52.5 -3.3 25.1 3.2 39 708 A G H X S+ 0 0 10 -4,-3.2 4,-2.8 1,-0.2 -2,-0.2 0.934 108.1 49.9 -50.2 -48.7 -2.8 26.9 6.5 40 709 A E H X S+ 0 0 35 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.938 112.5 46.8 -61.9 -42.7 -6.1 25.7 7.9 41 710 A R H X S+ 0 0 94 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.885 114.0 47.7 -65.6 -38.9 -5.3 22.0 7.0 42 711 A Q H X S+ 0 0 19 -4,-2.9 4,-2.7 -5,-0.2 3,-0.2 0.914 105.7 59.1 -69.1 -36.9 -1.8 22.3 8.4 43 712 A L H X S+ 0 0 11 -4,-2.8 4,-2.4 -5,-0.3 5,-0.2 0.915 100.4 56.3 -59.1 -41.4 -3.1 23.9 11.6 44 713 A V H X S+ 0 0 75 -4,-1.8 4,-1.3 1,-0.2 -1,-0.3 0.921 111.5 43.2 -52.7 -44.2 -5.3 20.8 12.2 45 714 A H H X S+ 0 0 73 -4,-1.2 4,-2.2 -3,-0.2 -2,-0.2 0.857 109.2 57.2 -73.4 -32.5 -2.2 18.7 12.1 46 715 A V H X S+ 0 0 18 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.891 104.7 52.8 -66.6 -34.5 -0.1 21.1 14.2 47 716 A V H X S+ 0 0 41 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.928 111.6 44.1 -65.1 -41.1 -2.6 20.9 17.0 48 717 A K H X S+ 0 0 138 -4,-1.3 4,-0.7 -5,-0.2 -1,-0.2 0.882 114.3 50.6 -72.1 -35.8 -2.5 17.1 17.1 49 718 A W H >< S+ 0 0 12 -4,-2.2 3,-0.7 2,-0.2 4,-0.3 0.935 110.9 48.1 -64.7 -50.4 1.3 17.1 16.9 50 719 A A H >< S+ 0 0 0 -4,-2.7 3,-2.0 1,-0.2 -2,-0.2 0.931 106.9 55.4 -60.0 -44.2 1.8 19.6 19.6 51 720 A K H 3< S+ 0 0 92 -4,-2.2 -1,-0.2 1,-0.3 6,-0.2 0.748 108.8 50.6 -63.7 -18.9 -0.6 17.7 22.0 52 721 A A T << S+ 0 0 47 -3,-0.7 -1,-0.3 -4,-0.7 -2,-0.2 0.424 83.8 112.3 -98.3 2.9 1.5 14.6 21.6 53 722 A L S X S- 0 0 5 -3,-2.0 3,-1.4 -4,-0.3 4,-0.5 -0.527 85.5 -86.7 -73.5 150.1 4.8 16.2 22.3 54 723 A P T 3 S- 0 0 42 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.322 108.2 -3.4 -53.5 125.2 6.5 15.1 25.5 55 724 A G T > S+ 0 0 42 1,-0.1 3,-2.5 -4,-0.1 4,-0.4 0.235 92.9 121.2 78.0 -12.7 5.3 17.2 28.5 56 725 A F G X S+ 0 0 0 -3,-1.4 3,-2.0 1,-0.3 -5,-0.1 0.884 71.3 57.4 -54.1 -39.1 3.1 19.5 26.4 57 726 A R G 3 S+ 0 0 171 -4,-0.5 -1,-0.3 1,-0.3 4,-0.1 0.604 88.0 76.7 -74.9 -1.9 -0.0 18.5 28.4 58 727 A N G < S+ 0 0 62 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.790 80.4 90.5 -70.5 -23.8 1.8 19.6 31.5 59 728 A L S < S- 0 0 3 -3,-2.0 5,-0.1 -4,-0.4 96,-0.1 -0.422 99.9 -92.9 -67.0 144.0 1.0 23.2 30.4 60 729 A H >> - 0 0 54 94,-0.2 4,-2.5 1,-0.1 3,-1.1 -0.327 37.7-118.0 -50.7 138.0 -2.3 24.7 31.5 61 730 A V H 3> S+ 0 0 90 1,-0.3 4,-1.6 2,-0.2 -1,-0.1 0.809 116.8 56.3 -52.7 -34.7 -4.9 23.9 28.8 62 731 A D H 3> S+ 0 0 94 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.843 109.0 45.6 -60.6 -40.1 -5.3 27.7 28.3 63 732 A D H <> S+ 0 0 6 -3,-1.1 4,-3.0 2,-0.2 5,-0.3 0.843 104.4 64.2 -75.0 -36.7 -1.5 28.0 27.6 64 733 A Q H X S+ 0 0 21 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.941 107.5 40.4 -51.1 -53.1 -1.7 25.0 25.3 65 734 A M H X S+ 0 0 122 -4,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.888 114.6 53.0 -67.3 -38.9 -3.9 26.7 22.9 66 735 A A H X S+ 0 0 12 -4,-1.4 4,-2.6 2,-0.2 5,-0.3 0.926 107.3 47.9 -66.4 -46.3 -2.1 30.1 23.1 67 736 A V H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.906 113.9 49.1 -68.1 -30.3 1.4 28.8 22.4 68 737 A I H X S+ 0 0 8 -4,-1.5 4,-1.1 -5,-0.3 -1,-0.2 0.931 113.0 47.4 -68.1 -39.7 0.0 26.9 19.4 69 738 A Q H < S+ 0 0 31 -4,-2.5 4,-0.2 1,-0.2 -2,-0.2 0.817 116.5 42.9 -75.3 -26.7 -1.8 30.0 18.2 70 739 A Y H < S+ 0 0 20 -4,-2.6 4,-0.3 76,-0.2 3,-0.2 0.814 120.2 39.4 -83.0 -31.0 1.2 32.3 18.6 71 740 A S H X S+ 0 0 4 -4,-2.1 4,-2.5 -5,-0.3 5,-0.2 0.512 84.7 95.3 -97.8 -2.7 3.8 30.0 17.2 72 741 A W H X S+ 0 0 14 -4,-1.1 4,-2.6 1,-0.2 5,-0.3 0.889 81.9 54.9 -62.5 -37.5 2.1 28.4 14.2 73 742 A M H > S+ 0 0 19 -4,-0.2 4,-2.5 -3,-0.2 5,-0.2 0.960 112.2 42.9 -58.6 -49.9 3.4 30.8 11.6 74 743 A G H > S+ 0 0 6 -4,-0.3 4,-2.7 1,-0.2 5,-0.3 0.927 114.0 51.5 -62.8 -42.9 7.0 30.2 12.6 75 744 A L H X S+ 0 0 5 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.916 113.1 45.0 -55.9 -44.5 6.5 26.5 12.9 76 745 A M H X S+ 0 0 19 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.857 113.2 49.2 -76.4 -36.2 4.9 26.3 9.4 77 746 A V H X S+ 0 0 8 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.951 113.2 47.4 -65.1 -48.3 7.5 28.5 7.7 78 747 A F H X S+ 0 0 0 -4,-2.7 4,-1.9 -5,-0.2 -2,-0.2 0.946 114.0 46.5 -57.4 -49.7 10.3 26.5 9.3 79 748 A A H X S+ 0 0 17 -4,-2.6 4,-2.4 -5,-0.3 -1,-0.2 0.899 111.0 53.3 -62.8 -35.4 8.7 23.2 8.2 80 749 A M H X S+ 0 0 5 -4,-2.2 4,-2.3 1,-0.2 14,-0.4 0.879 106.0 52.7 -66.0 -36.0 8.1 24.6 4.7 81 750 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.887 109.5 49.4 -65.7 -38.8 11.7 25.5 4.4 82 751 A W H X S+ 0 0 42 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.932 111.0 49.2 -64.9 -46.3 12.7 22.0 5.3 83 752 A R H X S+ 0 0 53 -4,-2.4 4,-1.3 1,-0.2 5,-0.4 0.906 112.0 49.1 -53.0 -46.9 10.2 20.6 2.8 84 753 A S H X S+ 0 0 0 -4,-2.3 6,-2.9 2,-0.2 4,-2.2 0.914 112.7 47.9 -67.0 -40.7 11.6 22.9 0.2 85 754 A F H X S+ 0 0 47 -4,-2.5 4,-0.9 4,-0.3 -2,-0.2 0.950 116.6 41.0 -61.3 -54.3 15.2 21.9 1.0 86 755 A T H < S+ 0 0 65 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.658 124.7 35.5 -75.0 -10.4 14.6 18.1 1.0 87 756 A N H < S+ 0 0 78 -4,-1.3 -2,-0.2 -5,-0.2 -3,-0.2 0.808 135.9 10.1-112.1 -34.8 12.3 18.1 -2.1 88 757 A V H >< S- 0 0 17 -4,-2.2 3,-3.3 -5,-0.4 4,-0.3 -0.091 100.3-106.4-136.4 30.6 13.6 20.8 -4.5 89 758 A N T 3< S- 0 0 107 -4,-0.9 -4,-0.3 1,-0.3 -3,-0.1 0.790 70.4 -69.7 43.8 34.2 16.9 21.6 -2.9 90 759 A S T 3 S+ 0 0 5 -6,-2.9 -1,-0.3 2,-0.2 -5,-0.2 0.683 103.6 128.1 64.7 18.8 15.3 24.9 -1.8 91 760 A R S < S+ 0 0 153 -3,-3.3 2,-0.3 -7,-0.4 -2,-0.1 0.801 79.0 11.5 -79.4 -25.9 15.2 26.2 -5.4 92 761 A M S S- 0 0 59 -4,-0.3 2,-0.8 -8,-0.2 10,-0.2 -0.906 93.4 -90.2-137.4 169.0 11.6 27.0 -5.1 93 762 A L E -A 101 0A 0 8,-1.2 8,-3.0 -2,-0.3 2,-1.3 -0.766 33.3-160.8 -87.1 111.1 9.1 27.3 -2.2 94 763 A Y E +A 100 0A 46 -2,-0.8 6,-0.2 -14,-0.4 -11,-0.1 -0.588 25.3 159.5 -88.2 72.1 7.4 23.9 -1.7 95 764 A F E S- 0 0 19 -2,-1.3 -1,-0.2 4,-0.9 5,-0.2 0.929 73.3 -20.0 -62.7 -41.3 4.3 24.9 0.3 96 765 A A E > S-A 99 0A 0 3,-0.8 3,-2.1 -3,-0.2 -1,-0.2 -0.969 71.1 -96.4-158.1 161.0 2.6 21.6 -0.7 97 766 A P T 3 S+ 0 0 55 0, 0.0 3,-0.2 0, 0.0 -80,-0.1 0.885 129.1 37.2 -51.9 -38.2 2.9 18.9 -3.4 98 767 A D T 3 S+ 0 0 33 1,-0.2 2,-0.1 -4,-0.1 -81,-0.1 0.226 115.9 54.7 -99.5 16.1 0.2 20.7 -5.3 99 768 A L E < +A 96 0A 0 -3,-2.1 -4,-0.9 2,-0.0 -3,-0.8 -0.484 63.0 159.0-148.4 73.5 1.3 24.3 -4.5 100 769 A V E -A 94 0A 32 -3,-0.2 2,-0.5 -6,-0.2 -6,-0.2 -0.855 33.0-137.0 -99.7 123.8 4.9 24.9 -5.5 101 770 A F E -A 93 0A 0 -8,-3.0 -8,-1.2 -2,-0.5 2,-0.2 -0.769 21.6-178.3 -88.2 127.9 5.9 28.5 -6.0 102 771 A N > - 0 0 62 -2,-0.5 4,-1.9 -10,-0.2 5,-0.2 -0.409 51.4 -84.4-100.2-178.9 8.1 29.4 -8.9 103 772 A E H > S+ 0 0 99 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.898 128.6 55.8 -60.1 -38.3 9.3 33.0 -9.5 104 773 A Y H > S+ 0 0 129 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.949 108.6 46.8 -59.4 -46.0 6.2 34.0 -11.4 105 774 A R H > S+ 0 0 20 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.876 107.3 57.8 -65.9 -33.3 4.0 32.9 -8.4 106 775 A M H <>S+ 0 0 1 -4,-1.9 5,-1.1 1,-0.2 -1,-0.2 0.933 112.4 41.7 -59.1 -44.4 6.3 34.8 -6.0 107 776 A H H ><5S+ 0 0 122 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.895 113.5 49.5 -71.8 -42.0 5.6 37.9 -8.0 108 777 A K H 3<5S+ 0 0 71 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.829 104.0 61.1 -69.3 -24.6 1.9 37.4 -8.5 109 778 A S T 3<5S- 0 0 0 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.602 104.3-133.3 -75.7 -9.2 1.4 36.7 -4.8 110 779 A R T < 5S+ 0 0 164 -3,-1.4 -3,-0.2 -4,-0.2 -2,-0.1 0.693 85.7 92.5 63.7 21.6 2.8 40.2 -4.1 111 780 A M >< + 0 0 12 -5,-1.1 4,-2.6 1,-0.1 5,-0.2 -0.173 39.8 138.5-133.6 45.0 5.1 39.0 -1.4 112 781 A Y H > S+ 0 0 86 1,-0.2 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4,-0.7 0.923 104.6 57.0 -52.6 -45.3 15.3 27.2 3.3 123 792 A Q H >X S+ 0 0 50 -4,-2.8 4,-2.5 1,-0.3 3,-0.6 0.803 94.1 68.8 -62.2 -26.8 18.9 27.4 1.9 124 793 A E H S+ 0 0 0 -3,-1.2 5,-2.4 -4,-0.8 4,-0.3 0.915 111.6 41.0 -54.6 -38.5 19.2 23.7 5.9 126 795 A G H X<5S+ 0 0 28 -4,-0.7 3,-0.6 -3,-0.6 -2,-0.2 0.895 113.5 51.0 -74.5 -47.7 21.6 23.0 3.0 127 796 A W H 3<5S+ 0 0 169 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.904 119.4 37.1 -55.8 -46.7 24.4 25.3 4.1 128 797 A L T 3<5S- 0 0 27 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.463 103.0-127.9 -89.9 -1.2 24.5 23.9 7.6 129 798 A Q T < 5 - 0 0 152 -3,-0.6 -3,-0.2 -4,-0.3 2,-0.1 0.932 33.8-158.4 52.7 47.0 23.8 20.3 6.6 130 799 A I < - 0 0 8 -5,-2.4 -1,-0.2 -6,-0.3 -5,-0.0 -0.297 6.9-134.3 -59.1 126.0 21.0 20.3 9.2 131 800 A T > - 0 0 34 -3,-0.2 4,-3.1 -2,-0.1 5,-0.2 -0.481 17.7-114.5 -80.9 158.3 20.2 16.7 10.2 132 801 A P H > S+ 0 0 71 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.850 119.6 52.2 -60.1 -33.4 16.6 15.3 10.3 133 802 A Q H > S+ 0 0 65 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.910 110.4 46.1 -71.2 -37.1 17.1 14.9 14.1 134 803 A E H > S+ 0 0 1 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.936 112.0 52.8 -68.0 -43.1 18.2 18.5 14.5 135 804 A F H X S+ 0 0 5 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.959 110.0 48.0 -53.5 -51.3 15.3 19.7 12.3 136 805 A L H X S+ 0 0 16 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.904 114.6 44.7 -62.1 -42.5 12.8 17.8 14.5 137 806 A C H X S+ 0 0 3 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.925 113.5 49.9 -68.2 -42.8 14.3 19.2 17.7 138 807 A M H X S+ 0 0 0 -4,-3.0 4,-1.6 1,-0.2 -2,-0.2 0.896 109.5 52.0 -60.9 -40.7 14.5 22.7 16.4 139 808 A K H X S+ 0 0 10 -4,-2.8 4,-0.8 -5,-0.3 -1,-0.2 0.925 108.2 51.0 -65.6 -38.0 10.9 22.6 15.2 140 809 A A H >X S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 4,-0.6 0.930 107.9 52.7 -64.2 -42.3 9.7 21.4 18.6 141 810 A L H >< S+ 0 0 0 -4,-2.2 3,-1.0 1,-0.2 -1,-0.2 0.815 98.7 65.2 -62.9 -29.7 11.5 24.3 20.3 142 811 A L H >< S+ 0 0 4 -4,-1.6 3,-1.4 1,-0.3 -1,-0.2 0.801 91.6 63.6 -60.8 -28.8 9.8 26.8 17.9 143 812 A L H << S+ 0 0 0 -3,-0.9 3,-0.3 -4,-0.8 -1,-0.3 0.862 107.5 43.4 -64.7 -27.6 6.5 25.8 19.5 144 813 A F T << S+ 0 0 0 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 -0.086 91.8 89.6-106.3 33.4 7.9 27.3 22.8 145 814 A S S < S+ 0 0 5 -3,-1.4 97,-3.7 1,-0.2 2,-0.3 0.313 77.0 53.9-118.7 12.4 9.5 30.4 21.3 146 815 A I E +B 241 0B 5 -3,-0.3 -1,-0.2 95,-0.3 -76,-0.2 -0.910 59.8 152.7-152.5 122.0 6.8 33.1 21.5 147 816 A I E -B 240 0B 21 93,-2.0 93,-2.5 -2,-0.3 -3,-0.0 -0.940 47.3 -77.3-146.7 160.9 4.7 34.2 24.5 148 817 A P E > -B 239 0B 21 0, 0.0 3,-1.7 0, 0.0 91,-0.3 -0.284 36.2-130.1 -57.6 140.9 2.8 37.1 26.1 149 818 A V T 3 S+ 0 0 77 89,-3.5 90,-0.1 1,-0.3 3,-0.1 0.829 111.9 54.1 -65.3 -24.4 5.0 39.8 27.6 150 819 A D T 3 S- 0 0 151 88,-0.5 -1,-0.3 1,-0.2 89,-0.1 0.381 118.8-116.0 -94.4 15.5 2.8 39.5 30.7 151 820 A G < - 0 0 26 -3,-1.7 -1,-0.2 3,-0.1 -2,-0.1 0.150 30.9 -73.3 81.3 168.4 3.5 35.8 30.8 152 821 A L > - 0 0 22 -3,-0.1 3,-0.8 -4,-0.1 4,-0.1 -0.244 48.4 -93.0 -87.7 177.9 1.2 32.7 30.5 153 822 A K T 3 S+ 0 0 141 1,-0.3 2,-0.4 2,-0.1 -1,-0.0 0.938 125.7 18.1 -56.8 -51.7 -1.4 31.3 32.8 154 823 A N T 3> S+ 0 0 52 1,-0.1 4,-1.3 -94,-0.1 3,-0.5 -0.696 77.1 167.5-122.1 81.1 1.2 28.9 34.3 155 824 A Q H <> S+ 0 0 45 -3,-0.8 4,-2.7 -2,-0.4 5,-0.2 0.853 70.8 60.0 -65.5 -38.8 4.5 30.4 33.2 156 825 A K H > S+ 0 0 175 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.896 103.7 52.8 -60.3 -35.7 6.7 28.3 35.4 157 826 A F H > S+ 0 0 109 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.908 109.7 48.8 -63.2 -41.5 5.5 25.2 33.7 158 827 A F H X S+ 0 0 0 -4,-1.3 4,-3.2 1,-0.2 5,-0.3 0.928 107.2 55.4 -64.2 -45.5 6.4 26.7 30.3 159 828 A D H X S+ 0 0 80 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.857 109.0 45.8 -56.9 -37.3 9.8 27.7 31.4 160 829 A E H X S+ 0 0 111 -4,-1.6 4,-3.1 2,-0.2 -1,-0.2 0.882 113.7 49.8 -75.7 -35.1 10.8 24.1 32.5 161 830 A L H X S+ 0 0 19 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.961 113.3 45.0 -63.1 -49.5 9.4 22.7 29.3 162 831 A R H X S+ 0 0 25 -4,-3.2 4,-2.3 1,-0.2 5,-0.3 0.933 112.5 53.5 -62.6 -43.6 11.3 25.2 27.2 163 832 A M H X S+ 0 0 76 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.961 109.2 47.9 -54.2 -48.1 14.3 24.5 29.3 164 833 A N H X S+ 0 0 50 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.925 108.7 53.0 -66.5 -35.0 14.1 20.8 28.7 165 834 A Y H X S+ 0 0 7 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.875 107.6 51.7 -67.5 -29.7 13.6 21.2 24.9 166 835 A I H X S+ 0 0 39 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.933 109.6 51.3 -68.4 -37.3 16.7 23.3 24.7 167 836 A K H X S+ 0 0 103 -4,-2.1 4,-2.8 -5,-0.3 -2,-0.2 0.912 105.5 53.9 -60.8 -42.3 18.5 20.5 26.6 168 837 A E H X S+ 0 0 39 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.879 109.0 51.2 -61.0 -34.9 17.2 17.9 24.2 169 838 A L H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 5,-0.2 0.936 108.4 48.1 -65.9 -53.4 18.7 20.0 21.4 170 839 A D H X S+ 0 0 79 -4,-2.6 4,-3.4 1,-0.2 -2,-0.2 0.952 113.0 52.3 -52.7 -44.3 22.1 20.3 23.0 171 840 A R H X S+ 0 0 129 -4,-2.8 4,-0.5 1,-0.2 -2,-0.2 0.922 106.1 50.6 -58.1 -44.2 21.9 16.5 23.5 172 841 A I H < S+ 0 0 27 -4,-2.2 3,-0.3 1,-0.2 -1,-0.2 0.848 115.2 45.2 -67.7 -26.5 21.1 15.8 19.9 173 842 A I H >< S+ 0 0 3 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.967 110.9 51.4 -76.8 -47.6 24.1 17.9 19.0 174 843 A A H 3< S+ 0 0 64 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.463 105.9 58.4 -66.9 0.2 26.3 16.3 21.6 175 844 A C T 3< S+ 0 0 99 -4,-0.5 -1,-0.3 -3,-0.3 2,-0.2 -0.023 87.4 115.4-120.0 31.4 25.3 12.9 20.3 176 845 A K < 0 0 84 -3,-1.5 -3,-0.1 1,-0.0 4,-0.0 -0.668 360.0 360.0-103.9 150.9 26.6 13.6 16.8 177 846 A R 0 0 295 -2,-0.2 -3,-0.1 0, 0.0 -4,-0.0 0.211 360.0 360.0 -69.0 360.0 29.4 12.1 14.6 178 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 179 851 A S > 0 0 119 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 104.8 32.6 21.8 18.1 180 852 A C H > + 0 0 65 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.905 360.0 59.5 -64.5 -37.4 29.3 21.3 19.8 181 853 A S H > S+ 0 0 100 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.918 107.5 43.9 -52.9 -47.1 29.8 24.9 21.0 182 854 A R H > S+ 0 0 170 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.911 113.7 50.7 -70.9 -37.3 29.9 26.1 17.4 183 855 A R H X S+ 0 0 25 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.969 108.7 50.6 -63.5 -48.9 26.9 23.9 16.3 184 856 A F H X S+ 0 0 49 -4,-3.4 4,-2.1 1,-0.3 5,-0.2 0.922 109.7 50.9 -58.5 -41.9 24.7 25.1 19.1 185 857 A Y H X S+ 0 0 124 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.3 0.894 111.9 48.9 -59.3 -39.0 25.5 28.8 18.3 186 858 A Q H X S+ 0 0 39 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.932 111.4 46.3 -69.4 -44.5 24.7 28.1 14.6 187 859 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.822 111.8 52.2 -70.9 -29.8 21.3 26.4 15.3 188 860 A T H X S+ 0 0 2 -4,-2.1 4,-2.4 -5,-0.3 56,-0.3 0.889 108.8 50.1 -75.2 -34.6 20.3 29.1 17.8 189 861 A K H X S+ 0 0 85 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.915 111.5 49.6 -62.8 -41.8 21.0 31.7 15.2 190 862 A L H X S+ 0 0 7 -4,-2.2 4,-0.7 2,-0.2 3,-0.3 0.968 110.9 48.8 -61.5 -49.7 19.0 29.8 12.7 191 863 A L H >X S+ 0 0 4 -4,-2.5 3,-1.3 1,-0.2 4,-0.7 0.923 110.1 51.4 -52.7 -47.5 16.1 29.5 15.1 192 864 A D H >< S+ 0 0 18 -4,-2.4 3,-0.9 1,-0.3 -1,-0.2 0.864 101.8 62.6 -58.3 -33.8 16.2 33.2 15.9 193 865 A S H 3X S+ 0 0 43 -4,-1.7 4,-0.8 -3,-0.3 -1,-0.3 0.672 91.1 67.4 -71.5 -14.4 16.1 33.9 12.2 194 866 A V H S+ 0 0 45 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.852 114.3 49.2 -59.6 -34.1 11.6 38.2 11.8 197 869 A I H X S+ 0 0 6 -4,-0.8 4,-2.1 2,-0.2 5,-0.2 0.938 110.4 49.3 -67.7 -48.9 10.3 36.2 8.8 198 870 A A H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.876 108.9 54.3 -53.4 -43.6 7.2 35.1 10.9 199 871 A R H X S+ 0 0 116 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.894 107.0 50.4 -62.8 -40.6 6.7 38.7 11.9 200 872 A E H X S+ 0 0 62 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.915 112.2 46.5 -63.3 -41.8 6.6 39.8 8.2 201 873 A L H X S+ 0 0 16 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.877 109.2 55.2 -70.4 -35.5 4.1 37.1 7.3 202 874 A H H X S+ 0 0 4 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.947 110.2 45.7 -59.3 -45.0 1.9 38.0 10.3 203 875 A Q H X S+ 0 0 67 -4,-1.9 4,-2.7 -5,-0.2 5,-0.2 0.933 113.5 50.3 -63.2 -43.2 1.8 41.6 9.1 204 876 A F H X S+ 0 0 40 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.943 111.7 46.1 -64.3 -45.5 1.1 40.5 5.6 205 877 A A H X S+ 0 0 16 -4,-3.3 4,-2.8 2,-0.2 -1,-0.2 0.906 112.1 52.2 -66.5 -36.7 -1.7 38.2 6.6 206 878 A F H X S+ 0 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