==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 29-JAN-09 3G0W . COMPND 2 MOLECULE: ANDROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR J.S.SACK . 249 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12095.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 77.1 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 3.6 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 . 7 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 56.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 0 194 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 60.1 36.9 27.6 22.2 2 671 A P > + 0 0 71 0, 0.0 4,-2.2 0, 0.0 5,-0.2 -0.027 360.0 142.2 -98.6 88.0 37.7 25.7 20.1 3 672 A I H > S+ 0 0 121 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.874 72.0 50.1 -55.0 -46.8 41.2 25.4 21.8 4 673 A F H > S+ 0 0 24 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.958 115.2 41.5 -60.6 -50.1 41.6 21.6 21.2 5 674 A L H > S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.810 108.7 61.3 -68.2 -32.1 40.8 21.8 17.5 6 675 A N H X S+ 0 0 81 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.942 108.0 45.5 -56.7 -48.2 42.9 25.0 17.2 7 676 A V H X S+ 0 0 44 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.935 110.3 51.0 -60.7 -52.6 45.9 23.0 18.3 8 677 A L H X S+ 0 0 3 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.891 113.2 46.6 -55.1 -42.2 45.3 19.9 16.1 9 678 A E H >< S+ 0 0 86 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.929 111.0 53.4 -66.6 -43.1 45.0 22.2 13.0 10 679 A A H 3< S+ 0 0 85 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.869 113.9 39.3 -60.4 -40.7 48.1 24.1 14.0 11 680 A I H 3< S+ 0 0 37 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.472 81.1 126.2 -89.7 -6.7 50.4 21.1 14.4 12 681 A E << - 0 0 61 -4,-0.8 -3,-0.0 -3,-0.7 124,-0.0 -0.385 67.2-108.5 -59.4 128.0 49.1 19.1 11.4 13 682 A P - 0 0 45 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.106 26.8-132.0 -55.0 151.5 52.1 18.2 9.1 14 683 A G - 0 0 60 1,-0.2 2,-0.2 0, 0.0 0, 0.0 -0.007 53.7 -44.9 -85.6-161.1 52.6 19.9 5.7 15 684 A V - 0 0 115 81,-0.0 2,-0.5 1,-0.0 -1,-0.2 -0.466 53.8-160.5 -72.2 136.8 53.4 18.0 2.5 16 685 A V - 0 0 13 -2,-0.2 2,-0.2 79,-0.1 26,-0.1 -0.978 7.1-151.6-123.2 117.8 56.0 15.3 2.7 17 686 A C - 0 0 59 -2,-0.5 24,-0.1 79,-0.1 79,-0.0 -0.611 10.5-150.4 -90.1 150.4 57.7 14.2 -0.5 18 687 A A - 0 0 2 -2,-0.2 -1,-0.1 2,-0.1 23,-0.1 0.758 29.0-131.6 -88.1 -28.9 59.2 10.7 -1.1 19 688 A G + 0 0 53 1,-0.2 2,-0.1 18,-0.1 80,-0.1 0.718 45.7 167.3 81.3 23.4 61.9 11.7 -3.5 20 689 A H - 0 0 17 78,-0.1 2,-1.2 1,-0.1 -1,-0.2 -0.438 41.7-122.2 -73.8 144.1 60.8 8.9 -5.9 21 690 A D + 0 0 77 1,-0.2 3,-0.4 -2,-0.1 -1,-0.1 -0.727 36.1 170.2 -87.0 94.6 62.2 8.8 -9.5 22 691 A N + 0 0 66 -2,-1.2 -1,-0.2 1,-0.2 4,-0.1 0.547 62.0 81.3 -80.5 -9.0 59.0 8.9 -11.5 23 692 A N S S+ 0 0 159 -3,-0.1 -1,-0.2 2,-0.1 -2,-0.0 -0.034 89.9 57.7 -89.3 33.6 60.9 9.5 -14.8 24 693 A Q S S- 0 0 96 -3,-0.4 -3,-0.0 0, 0.0 0, 0.0 -0.976 98.4 -74.2-161.7 146.9 61.7 5.8 -15.2 25 694 A P - 0 0 114 0, 0.0 -2,-0.1 0, 0.0 2,-0.0 -0.023 56.9-105.6 -41.8 136.2 59.9 2.4 -15.4 26 695 A D - 0 0 35 -4,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.355 40.7-179.9 -66.2 146.9 58.5 1.1 -12.2 27 696 A S > - 0 0 47 1,-0.1 4,-2.5 -2,-0.0 5,-0.2 -0.967 37.6-122.6-145.1 148.3 60.3 -1.7 -10.4 28 697 A F H > S+ 0 0 17 -2,-0.3 4,-2.4 2,-0.2 5,-0.3 0.914 114.0 51.9 -58.6 -42.0 59.5 -3.5 -7.1 29 698 A A H > S+ 0 0 26 1,-0.2 4,-2.5 2,-0.2 192,-0.4 0.941 112.4 44.0 -61.4 -49.5 62.9 -2.5 -5.7 30 699 A A H > S+ 0 0 25 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.895 114.5 48.7 -61.8 -46.5 62.5 1.2 -6.6 31 700 A L H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.926 115.3 42.9 -63.3 -45.6 58.9 1.5 -5.4 32 701 A L H X S+ 0 0 6 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.914 110.6 55.0 -71.4 -37.7 59.6 -0.2 -2.0 33 702 A S H X S+ 0 0 28 -4,-2.5 4,-2.0 -5,-0.3 -1,-0.2 0.894 110.3 48.8 -61.4 -32.8 62.9 1.6 -1.5 34 703 A S H X S+ 0 0 17 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.851 108.2 51.5 -74.8 -34.5 60.8 4.8 -1.9 35 704 A L H X S+ 0 0 29 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.898 110.0 52.2 -67.6 -36.2 58.1 3.7 0.5 36 705 A N H X S+ 0 0 15 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.945 111.6 44.6 -64.3 -44.3 60.9 3.0 3.0 37 706 A E H X S+ 0 0 66 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.925 116.4 45.9 -65.9 -45.9 62.4 6.5 2.6 38 707 A L H X S+ 0 0 5 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.897 109.1 56.7 -62.5 -40.6 58.9 8.1 2.8 39 708 A G H X S+ 0 0 7 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.905 108.9 46.6 -58.4 -41.1 58.1 6.0 5.8 40 709 A E H X S+ 0 0 37 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.939 110.3 51.0 -67.8 -48.4 61.2 7.3 7.5 41 710 A R H X S+ 0 0 87 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.889 111.8 49.2 -54.7 -39.6 60.4 11.0 6.6 42 711 A Q H X S+ 0 0 19 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.890 107.1 53.8 -68.7 -41.1 56.8 10.5 8.0 43 712 A L H X S+ 0 0 8 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.929 106.9 52.9 -58.5 -43.1 58.0 9.0 11.2 44 713 A V H X S+ 0 0 54 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.906 114.7 41.0 -59.2 -43.5 60.3 12.0 11.8 45 714 A H H X S+ 0 0 63 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.825 111.0 56.7 -72.3 -37.9 57.2 14.3 11.3 46 715 A V H X S+ 0 0 12 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.880 105.2 53.0 -62.0 -37.6 54.9 12.1 13.3 47 716 A V H X S+ 0 0 33 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.926 111.9 43.8 -62.8 -44.8 57.3 12.4 16.3 48 717 A K H X S+ 0 0 134 -4,-1.3 4,-0.6 -5,-0.2 -2,-0.2 0.895 116.2 48.4 -67.9 -39.2 57.3 16.2 16.1 49 718 A W H >< S+ 0 0 13 -4,-2.5 3,-1.4 2,-0.2 4,-0.3 0.965 112.2 47.6 -62.7 -54.2 53.5 16.2 15.6 50 719 A A H >< S+ 0 0 0 -4,-3.0 3,-1.7 1,-0.3 -2,-0.2 0.896 107.2 56.8 -55.0 -45.1 52.9 13.8 18.5 51 720 A K H 3< S+ 0 0 66 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.661 106.1 52.0 -62.9 -17.0 55.2 15.7 20.9 52 721 A A T << S+ 0 0 45 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.396 84.1 114.8-100.1 0.4 53.1 18.8 20.3 53 722 A L S X S- 0 0 7 -3,-1.7 3,-1.5 -4,-0.3 4,-0.4 -0.409 81.1 -91.1 -71.2 146.8 49.7 17.2 21.1 54 723 A P T 3 S+ 0 0 42 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.323 109.7 3.5 -57.7 135.1 47.7 18.4 24.1 55 724 A G T > S+ 0 0 29 1,-0.1 3,-2.9 -3,-0.1 4,-0.5 0.214 91.8 122.5 75.4 -13.3 48.7 16.4 27.2 56 725 A F G X + 0 0 0 -3,-1.5 3,-1.4 1,-0.3 -1,-0.1 0.816 69.2 56.7 -50.4 -38.7 51.3 14.3 25.4 57 726 A R G 3 S+ 0 0 196 -4,-0.4 -1,-0.3 1,-0.3 4,-0.1 0.473 88.0 79.2 -75.7 1.9 54.1 15.3 27.8 58 727 A N G < S+ 0 0 100 -3,-2.9 -1,-0.3 99,-0.1 -2,-0.2 0.768 80.0 86.9 -73.7 -29.8 51.9 13.9 30.6 59 728 A L S < S- 0 0 5 -3,-1.4 5,-0.1 -4,-0.5 96,-0.1 -0.379 96.6 -93.7 -69.7 153.6 53.1 10.5 29.5 60 729 A H > - 0 0 69 94,-0.3 4,-1.8 1,-0.1 3,-0.3 -0.338 36.8-112.5 -65.0 146.9 56.4 9.1 30.9 61 730 A V H > S+ 0 0 102 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.806 117.5 46.2 -49.8 -37.7 59.4 9.8 28.7 62 731 A D H > S+ 0 0 79 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.851 110.6 52.0 -75.8 -36.4 59.8 6.1 27.8 63 732 A D H > S+ 0 0 3 -3,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.758 101.1 67.3 -68.9 -27.4 56.1 5.6 27.1 64 733 A Q H X S+ 0 0 17 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.971 105.8 34.8 -60.3 -58.8 56.3 8.6 24.8 65 734 A M H X S+ 0 0 59 -4,-1.1 4,-2.9 1,-0.2 5,-0.2 0.882 116.6 55.9 -67.3 -34.8 58.6 7.1 22.1 66 735 A A H X S+ 0 0 15 -4,-1.5 4,-2.7 1,-0.2 5,-0.3 0.932 107.0 48.8 -60.9 -48.4 57.0 3.6 22.4 67 736 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.910 113.0 48.4 -60.3 -40.7 53.5 4.9 21.8 68 737 A I H X S+ 0 0 0 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.969 113.1 47.0 -62.9 -53.9 54.7 6.8 18.7 69 738 A Q H < S+ 0 0 39 -4,-2.9 4,-0.5 1,-0.2 -2,-0.2 0.886 114.0 45.8 -57.3 -44.2 56.6 3.8 17.3 70 739 A Y H < S+ 0 0 17 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.850 119.1 41.9 -67.7 -37.3 53.8 1.3 17.8 71 740 A S H X S+ 0 0 5 -4,-1.8 4,-2.5 -5,-0.3 5,-0.2 0.608 89.2 95.6 -85.6 -15.3 51.2 3.7 16.4 72 741 A W H X S+ 0 0 8 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.861 82.3 46.6 -45.5 -55.9 53.3 4.9 13.5 73 742 A M H > S+ 0 0 15 -4,-0.5 4,-2.8 1,-0.2 -1,-0.2 0.929 115.0 46.8 -57.5 -46.5 52.1 2.6 10.7 74 743 A G H > S+ 0 0 4 -4,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.905 111.5 51.2 -63.7 -40.6 48.4 3.1 11.6 75 744 A L H X S+ 0 0 5 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.924 112.1 47.5 -62.4 -41.5 48.9 6.9 11.8 76 745 A M H X S+ 0 0 31 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.927 112.1 49.6 -64.7 -46.0 50.6 6.9 8.4 77 746 A V H X S+ 0 0 5 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.918 112.1 47.3 -59.7 -46.5 47.9 4.7 6.9 78 747 A F H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.913 114.2 45.5 -64.3 -45.3 45.0 6.9 8.2 79 748 A A H X S+ 0 0 17 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.900 112.4 52.7 -68.8 -35.2 46.6 10.2 7.0 80 749 A M H X S+ 0 0 5 -4,-2.7 4,-2.1 -5,-0.2 14,-0.4 0.907 106.3 53.0 -67.2 -37.4 47.4 8.6 3.7 81 750 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.891 110.2 48.6 -62.1 -39.5 43.8 7.5 3.3 82 751 A W H X S+ 0 0 38 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.952 110.5 48.8 -66.5 -50.7 42.6 11.1 3.9 83 752 A R H X S+ 0 0 57 -4,-2.5 4,-2.7 1,-0.2 5,-0.5 0.844 111.4 52.3 -54.0 -40.5 45.1 12.6 1.4 84 753 A S H X S+ 0 0 0 -4,-2.1 6,-2.3 -5,-0.2 4,-1.9 0.934 112.1 45.1 -65.1 -44.8 43.9 10.1 -1.1 85 754 A F H X S+ 0 0 48 -4,-2.1 4,-1.1 4,-0.3 -2,-0.2 0.942 118.8 40.8 -61.5 -55.0 40.3 11.0 -0.6 86 755 A T H < S+ 0 0 73 -4,-3.1 -2,-0.2 2,-0.2 -1,-0.2 0.833 124.1 35.0 -66.8 -38.5 40.9 14.8 -0.6 87 756 A N H < S+ 0 0 89 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.879 136.1 12.2 -85.5 -43.2 43.4 14.9 -3.5 88 757 A V H >< S- 0 0 38 -4,-1.9 3,-2.7 -5,-0.5 4,-0.2 0.033 97.0-108.8-128.0 29.7 42.3 12.2 -5.9 89 758 A N T 3< S- 0 0 127 -4,-1.1 -4,-0.3 1,-0.3 -3,-0.1 0.804 73.5 -67.1 46.5 36.1 38.8 11.1 -4.7 90 759 A S T 3 S+ 0 0 8 -6,-2.3 -1,-0.3 2,-0.2 -5,-0.2 0.630 105.9 125.7 65.0 13.3 40.3 7.8 -3.5 91 760 A R S < S+ 0 0 207 -3,-2.7 2,-0.3 -7,-0.4 -2,-0.1 0.788 79.2 10.2 -74.0 -26.0 41.0 6.8 -7.1 92 761 A M S S- 0 0 58 -8,-0.2 2,-0.7 -4,-0.2 10,-0.2 -0.930 89.6 -94.2-144.1 165.7 44.7 6.1 -6.3 93 762 A L E -A 101 0A 0 8,-2.1 8,-3.0 -2,-0.3 2,-1.3 -0.769 32.4-156.1 -89.7 113.4 46.8 5.9 -3.2 94 763 A Y E +A 100 0A 42 -2,-0.7 6,-0.2 -14,-0.4 -11,-0.1 -0.604 29.4 157.8 -91.8 73.6 48.3 9.3 -2.6 95 764 A F E S- 0 0 22 -2,-1.3 -1,-0.2 4,-1.0 5,-0.2 0.919 76.2 -24.3 -59.7 -46.2 51.4 8.4 -0.5 96 765 A A E > S-A 99 0A 1 3,-1.0 3,-2.1 -3,-0.3 -1,-0.3 -0.965 71.3 -95.6-158.7 165.6 53.0 11.6 -1.5 97 766 A P T 3 S+ 0 0 56 0, 0.0 3,-0.2 0, 0.0 -80,-0.1 0.889 129.6 39.7 -58.9 -32.9 52.7 14.1 -4.4 98 767 A D T 3 S+ 0 0 35 1,-0.2 -78,-0.1 -3,-0.1 -81,-0.1 0.170 115.6 54.8 -98.7 15.9 55.7 12.3 -6.0 99 768 A L E < +A 96 0A 0 -3,-2.1 -4,-1.0 -80,-0.1 -3,-1.0 -0.474 64.7 156.9-147.9 72.6 54.5 8.8 -5.0 100 769 A V E -A 94 0A 29 -3,-0.2 2,-0.7 -6,-0.2 -6,-0.2 -0.860 31.9-142.1-102.1 125.7 51.0 8.1 -6.2 101 770 A F E -A 93 0A 0 -8,-3.0 -8,-2.1 -2,-0.5 2,-0.1 -0.819 18.5-177.5 -95.7 117.6 50.0 4.5 -6.6 102 771 A N > - 0 0 68 -2,-0.7 4,-2.3 -10,-0.2 3,-0.2 -0.346 51.6 -85.5 -92.5-178.0 47.7 3.5 -9.5 103 772 A E H > S+ 0 0 94 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.882 129.1 55.9 -59.2 -39.1 46.6 -0.1 -10.0 104 773 A Y H > S+ 0 0 127 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.911 110.3 43.5 -58.7 -46.5 49.7 -1.0 -11.8 105 774 A R H > S+ 0 0 22 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.881 108.3 58.8 -68.0 -35.4 52.0 0.2 -9.0 106 775 A M H <>S+ 0 0 1 -4,-2.3 5,-0.9 1,-0.2 -1,-0.2 0.892 113.0 40.4 -58.2 -41.5 49.8 -1.5 -6.4 107 776 A H H ><5S+ 0 0 123 -4,-2.0 3,-1.5 1,-0.2 5,-0.3 0.909 113.4 52.4 -73.0 -46.0 50.4 -4.7 -8.2 108 777 A K H 3<5S+ 0 0 59 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.784 102.2 60.4 -60.9 -31.4 54.1 -4.1 -8.9 109 778 A S T 3<5S- 0 0 0 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.617 104.4-131.1 -72.9 -13.4 54.7 -3.3 -5.2 110 779 A R T < 5S+ 0 0 152 -3,-1.5 -3,-0.1 -4,-0.2 -2,-0.1 0.652 87.2 96.6 68.6 16.7 53.5 -6.8 -4.4 111 780 A M >< + 0 0 9 -5,-0.9 4,-2.7 1,-0.1 5,-0.2 -0.173 38.6 136.5-123.5 39.8 51.2 -5.4 -1.7 112 781 A Y H > S+ 0 0 93 -5,-0.3 4,-2.7 1,-0.2 5,-0.2 0.923 71.0 48.7 -53.4 -51.9 48.1 -5.3 -3.8 113 782 A S H > S+ 0 0 79 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.908 112.8 48.4 -58.4 -40.9 45.7 -6.7 -1.1 114 783 A Q H > S+ 0 0 22 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.919 112.1 50.1 -65.7 -40.6 47.0 -4.3 1.5 115 784 A C H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.881 106.6 54.6 -63.8 -39.3 46.6 -1.4 -1.0 116 785 A V H X S+ 0 0 40 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.895 108.5 48.5 -64.4 -34.9 43.1 -2.5 -1.8 117 786 A R H X S+ 0 0 95 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.888 111.5 50.2 -70.2 -35.5 42.2 -2.3 1.9 118 787 A M H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.904 109.2 51.4 -69.5 -37.4 43.8 1.1 2.1 119 788 A R H X S+ 0 0 48 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.896 109.5 50.3 -64.5 -39.7 41.8 2.3 -0.9 120 789 A H H X S+ 0 0 86 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.921 108.5 51.9 -64.8 -42.8 38.7 1.1 0.8 121 790 A L H X S+ 0 0 4 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.923 110.0 49.9 -59.2 -42.6 39.6 3.0 4.0 122 791 A S H >X S+ 0 0 0 -4,-2.3 3,-0.9 1,-0.2 4,-0.7 0.886 107.1 53.7 -63.0 -41.6 40.0 6.1 1.9 123 792 A Q H >X S+ 0 0 54 -4,-2.1 4,-2.5 1,-0.2 3,-1.0 0.860 99.8 63.5 -62.0 -33.7 36.7 5.6 0.2 124 793 A E H 3X S+ 0 0 48 -4,-1.8 4,-2.8 1,-0.3 -1,-0.2 0.796 90.8 64.7 -62.7 -25.9 35.1 5.4 3.6 125 794 A F H <<>S+ 0 0 0 -3,-0.9 5,-2.3 -4,-0.8 -1,-0.3 0.851 111.3 38.0 -64.0 -33.6 36.1 9.0 4.3 126 795 A G H X<5S+ 0 0 27 -3,-1.0 3,-0.8 -4,-0.7 -2,-0.2 0.904 115.3 50.7 -81.8 -46.8 33.8 10.0 1.4 127 796 A W H 3<5S+ 0 0 149 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.901 117.9 40.1 -59.0 -42.5 31.0 7.5 2.1 128 797 A L T 3<5S- 0 0 28 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.485 106.0-129.3 -84.7 -4.9 30.9 8.6 5.8 129 798 A Q T < 5 - 0 0 158 -3,-0.8 -3,-0.2 1,-0.2 2,-0.2 0.922 31.7-162.3 54.7 49.4 31.3 12.3 4.9 130 799 A I < - 0 0 9 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.0 -0.429 9.1-135.3 -65.1 127.7 34.2 12.6 7.4 131 800 A T > - 0 0 52 -2,-0.2 4,-2.5 -3,-0.1 5,-0.2 -0.442 20.0-112.8 -80.3 158.5 34.8 16.3 8.2 132 801 A P H > S+ 0 0 67 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.872 119.8 49.8 -59.5 -31.4 38.3 17.7 8.3 133 802 A Q H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.846 108.4 50.2 -76.0 -36.2 37.9 18.2 12.1 134 803 A E H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.900 110.8 52.5 -64.9 -42.1 36.6 14.7 12.7 135 804 A F H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.917 109.0 48.2 -58.8 -47.5 39.6 13.4 10.8 136 805 A L H X S+ 0 0 16 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.911 113.6 46.8 -63.0 -43.3 42.0 15.5 12.9 137 806 A C H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.931 114.0 47.8 -67.1 -39.0 40.4 14.3 16.2 138 807 A M H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.885 108.7 53.4 -66.1 -42.3 40.4 10.6 15.0 139 808 A K H X S+ 0 0 10 -4,-2.5 4,-0.8 2,-0.2 -1,-0.2 0.927 110.1 48.5 -62.0 -39.7 44.0 10.7 13.9 140 809 A A H >X S+ 0 0 0 -4,-1.9 3,-1.1 1,-0.2 4,-0.6 0.924 108.9 53.1 -64.5 -41.7 45.0 12.0 17.3 141 810 A L H >< S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.3 -1,-0.2 0.864 99.7 65.1 -60.4 -33.9 43.0 9.3 19.0 142 811 A L H >< S+ 0 0 3 -4,-1.9 3,-1.2 1,-0.3 -1,-0.3 0.790 90.4 63.3 -59.2 -31.7 44.9 6.8 16.8 143 812 A L H << S+ 0 0 0 -3,-1.1 3,-0.3 -4,-0.8 -1,-0.3 0.827 105.7 46.3 -61.5 -33.8 48.1 7.6 18.6 144 813 A F T << S+ 0 0 0 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.1 -0.237 91.3 90.5-101.9 41.1 46.6 6.3 21.8 145 814 A S S < S+ 0 0 5 -3,-1.2 100,-2.9 1,-0.2 2,-0.3 0.265 76.8 50.7-123.5 13.7 45.2 3.1 20.3 146 815 A I E +B 244 0B 7 -3,-0.3 -1,-0.2 98,-0.3 -76,-0.1 -0.901 59.7 154.4-156.4 119.8 47.9 0.5 20.6 147 816 A I E -B 243 0B 13 96,-1.9 96,-2.2 -2,-0.3 4,-0.1 -0.947 49.1 -73.3-143.1 164.4 49.9 -0.5 23.7 148 817 A P E > -B 242 0B 16 0, 0.0 3,-2.0 0, 0.0 94,-0.3 -0.325 40.9-126.8 -60.5 133.8 51.8 -3.4 25.4 149 818 A V T 3 S+ 0 0 99 92,-3.7 93,-0.1 1,-0.3 3,-0.1 0.801 112.6 51.3 -52.4 -29.1 49.5 -6.2 26.6 150 819 A D T 3 S- 0 0 139 91,-0.5 -1,-0.3 1,-0.3 92,-0.1 -0.123 117.4-111.1-102.8 36.0 51.2 -5.8 29.9 151 820 A G < - 0 0 23 -3,-2.0 -1,-0.3 -4,-0.1 2,-0.1 0.233 32.1 -80.0 63.2 175.7 50.8 -2.0 30.2 152 821 A L > - 0 0 26 -3,-0.1 3,-0.8 -5,-0.0 4,-0.1 -0.411 47.2 -89.5-103.5-179.6 53.3 0.9 30.0 153 822 A K T 3 S+ 0 0 138 1,-0.3 2,-0.3 -2,-0.1 3,-0.1 0.924 127.6 15.4 -58.0 -46.6 55.7 2.4 32.5 154 823 A N T >> S+ 0 0 53 1,-0.1 4,-1.2 -94,-0.1 3,-0.7 -0.670 74.7 169.1-130.0 77.7 52.9 4.8 33.7 155 824 A Q H <> S+ 0 0 44 -3,-0.8 4,-2.6 -2,-0.3 5,-0.2 0.783 71.0 65.9 -58.3 -32.8 49.7 3.3 32.3 156 825 A K H 3> S+ 0 0 136 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 100.3 48.9 -59.7 -43.5 47.5 5.6 34.3 157 826 A F H <> S+ 0 0 88 -3,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.900 112.5 49.2 -63.7 -41.3 48.7 8.8 32.5 158 827 A F H X S+ 0 0 0 -4,-1.2 4,-3.0 2,-0.2 5,-0.2 0.919 108.9 52.5 -61.9 -47.1 48.1 7.1 29.2 159 828 A D H X S+ 0 0 55 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.886 110.8 47.3 -58.4 -41.5 44.6 6.0 30.3 160 829 A E H X S+ 0 0 104 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.934 111.5 50.6 -67.6 -42.9 43.7 9.5 31.2 161 830 A L H X S+ 0 0 6 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.952 111.9 48.0 -58.6 -50.2 45.1 10.9 27.9 162 831 A R H X S+ 0 0 26 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.925 110.6 50.8 -56.6 -47.3 43.0 8.3 25.9 163 832 A M H X S+ 0 0 96 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.911 109.6 51.5 -58.0 -43.6 39.9 9.1 27.8 164 833 A N H X S+ 0 0 68 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.872 108.9 49.4 -63.8 -36.2 40.3 12.8 27.2 165 834 A Y H X S+ 0 0 4 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.864 108.2 53.9 -71.9 -31.1 40.8 12.3 23.4 166 835 A I H X S+ 0 0 28 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.927 108.6 50.3 -66.1 -41.7 37.6 10.2 23.3 167 836 A K H X S+ 0 0 100 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.860 107.0 54.2 -63.0 -37.4 35.8 13.0 25.0 168 837 A E H X S+ 0 0 49 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.929 106.9 50.2 -64.7 -44.5 37.1 15.5 22.4 169 838 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.898 109.3 54.6 -57.4 -41.0 35.8 13.4 19.5 170 839 A D H X S+ 0 0 53 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.934 107.0 47.9 -57.0 -52.3 32.4 13.3 21.4 171 840 A R H X S+ 0 0 153 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.886 110.2 54.9 -57.8 -38.7 32.2 17.1 21.6 172 841 A I H < S+ 0 0 17 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.866 109.3 44.3 -65.1 -39.1 33.1 17.3 17.9 173 842 A I H < S+ 0 0 2 -4,-2.0 3,-0.4 1,-0.2 4,-0.3 0.846 117.8 46.7 -72.6 -33.6 30.3 15.0 16.8 174 843 A A H < S+ 0 0 52 -4,-2.2 3,-0.2 -5,-0.2 -2,-0.2 0.700 85.5 92.2 -80.4 -22.5 27.9 16.9 19.2 175 844 A C S < S+ 0 0 105 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.804 115.2 0.2 -41.2 -44.4 29.0 20.4 18.1 176 845 A K S S+ 0 0 172 -3,-0.4 2,-1.0 -4,-0.4 -1,-0.3 0.228 106.5 108.9-133.4 12.5 26.3 20.7 15.5 177 846 A R - 0 0 43 -4,-0.3 6,-0.3 -3,-0.2 5,-0.2 -0.475 57.4-153.7-101.6 69.3 24.6 17.3 15.9 178 847 A K + 0 0 149 -2,-1.0 -1,-0.2 1,-0.1 5,-0.0 0.457 59.7 20.2 11.8-118.8 21.2 17.9 17.5 179 848 A N S > S- 0 0 110 1,-0.1 3,-2.2 4,-0.0 -1,-0.1 -0.790 81.7-108.1 -96.1 117.0 19.6 15.1 19.5 180 849 A P T >> S+ 0 0 93 0, 0.0 4,-2.6 0, 0.0 3,-0.6 0.294 109.2 67.5 5.1 -64.2 21.6 12.2 21.1 181 850 A T H 3> S+ 0 0 114 1,-0.3 4,-1.6 2,-0.2 5,-0.1 0.771 103.7 48.2 -46.4 -29.5 20.5 9.3 18.8 182 851 A S H <> S+ 0 0 30 -3,-2.2 4,-2.3 2,-0.2 -1,-0.3 0.867 109.5 51.3 -79.3 -38.0 22.3 11.0 16.0 183 852 A C H <> S+ 0 0 25 -3,-0.6 4,-2.3 -6,-0.3 -2,-0.2 0.878 111.3 49.3 -64.6 -37.4 25.5 11.5 18.1 184 853 A S H X S+ 0 0 78 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.911 109.6 50.3 -67.8 -45.1 25.3 7.8 19.0 185 854 A R H X S+ 0 0 174 -4,-1.6 4,-1.8 -5,-0.3 -2,-0.2 0.916 114.4 45.6 -59.0 -42.3 24.9 6.8 15.4 186 855 A R H X S+ 0 0 17 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.866 110.9 50.4 -71.8 -37.3 27.9 9.0 14.4 187 856 A F H X S+ 0 0 50 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.884 110.1 52.8 -67.6 -35.8 30.2 7.8 17.3 188 857 A Y H X S+ 0 0 125 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.916 109.9 47.8 -64.1 -44.6 29.4 4.2 16.3 189 858 A Q H X S+ 0 0 42 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.945 114.2 45.2 -61.5 -51.7 30.4 4.9 12.6 190 859 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.863 111.3 51.7 -63.4 -40.1 33.7 6.7 13.5 191 860 A T H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 56,-0.3 0.869 110.4 49.7 -65.6 -34.6 34.7 4.1 16.1 192 861 A K H X S+ 0 0 84 -4,-1.6 4,-1.8 -5,-0.2 -2,-0.2 0.917 111.4 49.3 -68.0 -41.8 34.1 1.3 13.5 193 862 A L H X S+ 0 0 3 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.954 111.6 48.9 -62.6 -48.1 36.2 3.3 11.0 194 863 A L H >X S+ 0 0 6 -4,-2.9 3,-1.6 1,-0.2 4,-0.6 0.934 109.3 51.3 -56.5 -48.1 39.0 3.7 13.6 195 864 A D H >< S+ 0 0 19 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.852 100.6 64.8 -57.6 -37.2 39.0 0.0 14.5 196 865 A S H 3X S+ 0 0 33 -4,-1.8 4,-0.8 1,-0.2 -1,-0.3 0.712 90.7 65.8 -62.5 -18.5 39.3 -0.8 10.7 197 866 A V H S+ 0 0 44 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.873 113.3 51.1 -65.8 -31.9 44.0 -4.9 10.8 200 869 A I H X S+ 0 0 6 -4,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.957 109.7 48.1 -67.6 -47.8 45.5 -2.9 7.9 201 870 A A H X S+ 0 0 4 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.878 110.2 54.2 -60.2 -37.7 48.5 -1.7 9.9 202 871 A R H X S+ 0 0 97 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.945 109.3 46.1 -62.6 -47.2 49.0 -5.3 11.1 203 872 A E H X S+ 0 0 64 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.878 113.3 49.8 -61.9 -39.5 49.1 -6.6 7.5 204 873 A L H X S+ 0 0 11 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.899 110.5 50.9 -66.4 -40.2 51.4 -3.8 6.5 205 874 A H H X S+ 0 0 5 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.914 109.5 50.1 -62.0 -44.4 53.6 -4.6 9.5 206 875 A Q H X S+ 0 0 70 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.941 113.2 45.9 -59.5 -45.4 53.8 -8.3 8.5 207 876 A F H X S+ 0 0 34 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.923 113.7 48.6 -65.0 -44.8 54.7 -7.4 4.9 208 877 A T H X S+ 0 0 21 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.910 111.2 50.3 -60.7 -45.4 57.4 -4.9 6.0 209 878 A F H X S+ 0 0 63 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.940 112.2 47.2 -58.4 -49.5 58.9 -7.4 8.5 210 879 A D H X S+ 0 0 85 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.923 112.4 50.1 -59.7 -44.3 59.1 -10.1 5.9 211 880 A L H X S+ 0 0 3 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.898 107.7 52.9 -63.7 -40.3 60.6 -7.7 3.4 212 881 A L H >< S+ 0 0 24 -4,-2.6 3,-0.9 2,-0.2 4,-0.4 0.940 107.4 52.0 -59.8 -46.9 63.3 -6.5 5.9 213 882 A I H 3< S+ 0 0 105 -4,-2.0 3,-0.3 1,-0.3 -1,-0.2 0.910 122.4 30.8 -57.5 -42.5 64.4 -10.1 6.6 214 883 A K H >X S+ 0 0 98 -4,-1.9 3,-1.5 -5,-0.2 4,-0.9 0.335 87.1 114.7 -97.7 7.3 64.8 -10.8 2.9 215 884 A S H XX>S+ 0 0 22 -3,-0.9 5,-1.6 -4,-0.8 3,-0.9 0.840 71.1 56.6 -46.1 -46.3 65.8 -7.2 1.8 216 885 A H H 345S+ 0 0 154 -4,-0.4 3,-0.4 -3,-0.3 -1,-0.3 0.829 106.6 52.3 -57.8 -31.4 69.3 -8.1 0.8 217 886 A M H <45S+ 0 0 76 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.698 113.8 40.1 -78.6 -22.6 67.9 -10.6 -1.7 218 887 A V H <<5S- 0 0 32 -3,-0.9 -1,-0.2 -4,-0.9 -2,-0.2 0.279 106.9-115.4-112.3 9.9 65.5 -8.3 -3.4 219 888 A S T <5 + 0 0 86 -4,-0.6 2,-0.5 -3,-0.4 -3,-0.2 0.797 62.3 151.3 62.4 30.4 67.6 -5.2 -3.6 220 889 A V < - 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