==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/INHIBITOR 19-JUL-13 3WFG . COMPND 2 MOLECULE: MINERALOCORTICOID RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.SOGABE,N.HABUKA . 249 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12625.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 75.5 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 . 8 3.2 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 . 25 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 144 57.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.6 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 1 0 1 0 1 0 0 0 1 0 0 1 0 1 0 0 0 1 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 1 1 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 1 735 A T 0 0 188 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -34.1 -1.5 21.5 5.1 2 736 A P - 0 0 70 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.447 360.0-123.1 -72.8 145.4 -1.5 23.8 8.2 3 737 A S > - 0 0 51 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.351 28.6-104.0 -72.4 159.8 1.9 24.8 9.5 4 738 A P H > S+ 0 0 46 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.902 124.1 54.7 -50.4 -41.0 2.8 24.1 13.2 5 739 A V H > S+ 0 0 28 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.893 106.9 49.1 -61.0 -41.8 2.1 27.9 13.9 6 740 A M H > S+ 0 0 111 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.919 111.7 49.8 -62.8 -41.6 -1.4 27.6 12.5 7 741 A V H X S+ 0 0 35 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.932 106.3 56.2 -63.5 -43.6 -2.0 24.5 14.6 8 742 A L H X S+ 0 0 2 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.883 107.7 48.4 -57.7 -36.7 -0.7 26.3 17.7 9 743 A E H >< S+ 0 0 117 -4,-1.8 3,-0.6 1,-0.2 -1,-0.2 0.934 111.6 50.2 -67.7 -42.3 -3.3 29.1 17.1 10 744 A N H 3< S+ 0 0 138 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.856 115.2 41.6 -64.6 -35.4 -6.1 26.5 16.7 11 745 A I H 3< S+ 0 0 26 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.498 80.2 124.6 -94.9 -4.5 -5.3 24.6 19.8 12 746 A E S << S- 0 0 46 -4,-0.8 -3,-0.0 -3,-0.6 124,-0.0 -0.365 71.1-107.5 -57.4 127.6 -4.6 27.5 22.1 13 747 A P - 0 0 37 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.306 30.4-114.3 -59.5 140.7 -6.9 27.1 25.2 14 748 A E - 0 0 156 1,-0.1 2,-0.1 -3,-0.1 31,-0.1 -0.363 41.6 -92.0 -65.0 151.1 -9.9 29.5 25.5 15 749 A I - 0 0 76 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 -0.452 47.4-156.9 -68.3 135.4 -9.8 31.9 28.4 16 750 A V - 0 0 15 -2,-0.1 2,-0.2 -3,-0.1 26,-0.0 -0.804 12.1-116.1-115.7 159.4 -11.6 30.6 31.5 17 751 A Y - 0 0 151 -2,-0.3 24,-0.1 79,-0.2 79,-0.0 -0.622 10.0-142.4 -91.8 150.8 -13.2 32.2 34.6 18 752 A A - 0 0 8 -2,-0.2 20,-0.1 23,-0.0 3,-0.1 0.617 34.9-121.0 -83.3 -17.8 -11.9 31.7 38.1 19 753 A G - 0 0 53 1,-0.2 2,-0.1 18,-0.1 80,-0.0 0.827 40.4-170.6 71.4 34.0 -15.3 31.6 39.9 20 754 A Y - 0 0 70 1,-0.1 2,-0.7 2,-0.0 -1,-0.2 -0.394 11.7-145.5 -60.7 129.1 -14.3 34.6 42.0 21 755 A D > - 0 0 72 1,-0.1 3,-1.6 -2,-0.1 -1,-0.1 -0.877 13.5-167.9-106.5 105.2 -17.0 35.1 44.7 22 756 A S T 3 S+ 0 0 106 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.548 83.2 70.3 -69.2 -8.4 -17.6 38.8 45.5 23 757 A S T 3 S+ 0 0 87 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.487 91.1 72.9 -84.5 -4.5 -19.6 37.7 48.7 24 758 A K S < S- 0 0 117 -3,-1.6 2,-0.1 1,-0.0 -3,-0.0 -0.848 90.7-103.9-110.7 149.5 -16.4 36.6 50.4 25 759 A P - 0 0 85 0, 0.0 2,-1.8 0, 0.0 5,-0.1 -0.352 29.8-113.3 -70.0 151.3 -13.6 38.7 51.8 26 760 A D + 0 0 44 4,-0.1 2,-0.1 -4,-0.1 -4,-0.0 -0.361 58.7 153.4 -83.7 58.2 -10.3 39.2 50.0 27 761 A T > - 0 0 54 -2,-1.8 4,-2.6 1,-0.1 5,-0.2 -0.443 59.2-111.9 -73.9 160.0 -8.2 37.4 52.6 28 762 A A H > S+ 0 0 22 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.904 119.2 54.5 -60.5 -38.1 -5.0 35.7 51.4 29 763 A E H > S+ 0 0 86 1,-0.2 4,-2.1 2,-0.2 192,-0.4 0.923 111.5 42.9 -65.5 -43.5 -6.6 32.3 52.1 30 764 A N H > S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.917 116.5 47.2 -68.5 -44.4 -9.7 33.1 49.9 31 765 A L H X S+ 0 0 2 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.935 114.7 45.4 -62.8 -48.4 -7.6 34.7 47.1 32 766 A L H X S+ 0 0 12 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.905 112.7 51.0 -64.1 -41.2 -5.0 31.8 47.0 33 767 A S H X S+ 0 0 7 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.918 112.3 47.7 -62.2 -42.0 -7.7 29.1 47.1 34 768 A T H X S+ 0 0 12 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.925 112.3 48.7 -62.0 -46.7 -9.5 30.9 44.2 35 769 A L H X S+ 0 0 21 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.891 109.1 53.7 -60.8 -39.8 -6.3 31.1 42.2 36 770 A N H X S+ 0 0 16 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.893 109.3 47.5 -64.8 -40.0 -5.5 27.5 42.9 37 771 A R H X S+ 0 0 113 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.939 111.8 51.0 -64.1 -44.7 -8.9 26.4 41.5 38 772 A L H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.932 110.6 48.6 -52.8 -50.8 -8.4 28.6 38.5 39 773 A A H X S+ 0 0 8 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.841 107.9 55.2 -62.9 -34.2 -5.0 27.0 37.9 40 774 A G H X S+ 0 0 3 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.933 109.5 46.3 -61.9 -46.0 -6.5 23.6 38.3 41 775 A K H X S+ 0 0 110 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.926 113.7 49.5 -62.6 -42.6 -9.0 24.4 35.5 42 776 A Q H X S+ 0 0 19 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.884 108.2 53.7 -64.4 -39.0 -6.2 25.8 33.4 43 777 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.843 103.0 55.2 -67.6 -34.2 -4.1 22.8 33.9 44 778 A I H X S+ 0 0 91 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.925 110.4 48.2 -61.9 -41.0 -6.8 20.4 32.7 45 779 A Q H X S+ 0 0 35 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.891 107.1 55.8 -62.6 -41.9 -6.8 22.6 29.5 46 780 A V H X S+ 0 0 17 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.919 105.4 51.8 -59.3 -40.9 -3.0 22.3 29.3 47 781 A V H X S+ 0 0 44 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.926 111.4 46.5 -62.2 -42.1 -3.2 18.5 29.3 48 782 A K H X S+ 0 0 135 -4,-1.7 4,-0.9 1,-0.2 -2,-0.2 0.900 112.9 50.5 -66.5 -38.8 -5.7 18.6 26.4 49 783 A W H >< S+ 0 0 10 -4,-2.6 3,-0.8 1,-0.2 4,-0.4 0.916 107.0 53.9 -60.4 -46.8 -3.5 21.1 24.6 50 784 A A H >< S+ 0 0 2 -4,-2.7 3,-1.0 1,-0.2 -1,-0.2 0.849 98.9 63.2 -61.0 -33.2 -0.5 18.9 25.0 51 785 A K H 3< S+ 0 0 134 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.853 114.1 32.9 -60.1 -33.3 -2.3 15.9 23.5 52 786 A V T << S+ 0 0 87 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.216 86.2 124.7-111.6 14.4 -2.6 17.8 20.1 53 787 A L S X> S- 0 0 3 -3,-1.0 3,-1.9 -4,-0.4 4,-0.6 -0.599 75.0-101.0 -75.2 125.2 0.6 19.8 20.3 54 788 A P T 34 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.224 102.0 3.0 -56.0 127.9 2.7 19.1 17.1 55 789 A G T >4 S+ 0 0 29 1,-0.0 3,-1.4 -3,-0.0 4,-0.3 0.031 101.5 102.3 90.9 -23.9 5.5 16.6 17.8 56 790 A F G X4 S+ 0 0 0 -3,-1.9 3,-1.9 1,-0.3 -5,-0.1 0.881 73.1 60.4 -67.9 -33.9 4.6 16.0 21.5 57 791 A K G 3< S+ 0 0 153 -4,-0.6 -1,-0.3 1,-0.3 4,-0.1 0.674 92.9 69.0 -66.6 -15.0 2.9 12.6 20.9 58 792 A N G < S+ 0 0 113 -3,-1.4 -1,-0.3 99,-0.1 -2,-0.2 0.589 85.3 82.6 -82.8 -6.2 6.2 11.3 19.5 59 793 A L S < S- 0 0 5 -3,-1.9 5,-0.1 -4,-0.3 -4,-0.0 -0.681 101.6 -87.9 -87.3 150.6 7.8 11.5 23.0 60 794 A P >> - 0 0 39 0, 0.0 4,-2.1 0, 0.0 3,-0.7 -0.242 37.3-118.3 -50.3 143.2 7.2 8.6 25.3 61 795 A L H 3> S+ 0 0 121 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.886 115.4 56.1 -54.4 -43.5 4.0 9.1 27.3 62 796 A E H 3> S+ 0 0 111 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.880 107.7 49.1 -58.6 -35.8 6.0 9.1 30.6 63 797 A D H <> S+ 0 0 4 -3,-0.7 4,-2.8 2,-0.2 -1,-0.2 0.852 107.4 54.2 -69.7 -38.3 8.1 11.9 29.2 64 798 A Q H X S+ 0 0 28 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.949 111.9 44.5 -58.1 -47.3 5.0 13.9 28.2 65 799 A I H X S+ 0 0 79 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.941 113.4 51.2 -63.0 -49.1 3.7 13.7 31.7 66 800 A T H X S+ 0 0 22 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.929 109.2 50.1 -54.3 -47.3 7.1 14.5 33.2 67 801 A L H X S+ 0 0 0 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.893 109.8 49.6 -66.7 -37.1 7.5 17.6 31.1 68 802 A I H >X S+ 0 0 18 -4,-2.0 4,-1.6 1,-0.2 3,-0.6 0.932 113.5 47.2 -61.0 -46.2 4.0 19.0 32.0 69 803 A Q H 3< S+ 0 0 8 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.788 113.1 48.6 -67.5 -28.8 4.8 18.4 35.7 70 804 A Y H 3< S+ 0 0 12 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.626 123.7 30.4 -83.9 -13.8 8.2 20.1 35.3 71 805 A S H XX S+ 0 0 1 -4,-1.0 4,-2.4 -3,-0.6 3,-0.8 0.451 80.6 109.0-122.6 -4.7 6.9 23.1 33.5 72 806 A W H 3X S+ 0 0 6 -4,-1.6 4,-2.5 1,-0.3 5,-0.2 0.835 83.6 47.2 -51.5 -44.5 3.3 23.8 34.7 73 807 A M H 3> S+ 0 0 25 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.858 112.4 50.8 -68.1 -31.3 4.1 26.9 36.6 74 808 A S H <> S+ 0 0 5 -3,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.908 110.7 49.0 -68.7 -42.0 6.1 28.3 33.7 75 809 A L H X S+ 0 0 6 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.931 114.4 44.7 -63.5 -46.7 3.2 27.6 31.3 76 810 A L H X S+ 0 0 20 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.909 114.6 48.8 -64.7 -43.2 0.6 29.3 33.6 77 811 A S H X S+ 0 0 7 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.878 111.6 48.7 -64.0 -41.0 2.9 32.3 34.3 78 812 A F H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.923 112.4 48.0 -68.1 -41.9 3.7 32.8 30.6 79 813 A A H X S+ 0 0 13 -4,-2.3 4,-2.7 -5,-0.2 5,-0.2 0.879 109.7 54.2 -63.9 -39.1 0.0 32.7 29.7 80 814 A L H X S+ 0 0 11 -4,-2.3 4,-2.5 2,-0.2 14,-0.4 0.925 107.9 49.6 -56.4 -46.9 -0.8 35.1 32.5 81 815 A S H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.928 111.3 49.5 -60.9 -43.7 1.8 37.5 31.1 82 816 A W H X S+ 0 0 24 -4,-2.2 4,-3.2 2,-0.2 5,-0.3 0.943 112.3 46.3 -59.9 -49.9 0.2 37.2 27.7 83 817 A R H X S+ 0 0 26 -4,-2.7 4,-2.7 1,-0.2 5,-0.4 0.899 112.5 51.5 -61.6 -39.5 -3.4 37.8 28.9 84 818 A S H X S+ 0 0 0 -4,-2.5 6,-2.3 -5,-0.2 4,-1.6 0.917 114.5 43.5 -61.6 -44.6 -2.2 40.8 31.0 85 819 A Y H X S+ 0 0 28 -4,-2.5 4,-1.5 4,-0.3 -2,-0.2 0.951 119.0 41.9 -63.2 -52.3 -0.4 42.3 27.9 86 820 A K H < S+ 0 0 131 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.895 124.5 32.7 -67.9 -43.9 -3.2 41.6 25.5 87 821 A H H < S+ 0 0 83 -4,-2.7 -1,-0.2 -5,-0.3 -3,-0.2 0.650 137.2 16.2 -95.9 -16.3 -6.2 42.6 27.7 88 822 A T H >< S- 0 0 22 -4,-1.6 3,-1.2 -5,-0.4 -3,-0.2 0.311 95.5-114.2-133.3 7.2 -4.7 45.4 29.9 89 823 A N T 3< S- 0 0 94 -4,-1.5 -4,-0.3 1,-0.2 -3,-0.1 0.859 78.0 -61.6 51.6 37.4 -1.5 46.5 28.1 90 824 A S T 3 S+ 0 0 2 -6,-2.3 -1,-0.2 2,-0.2 -5,-0.2 0.693 109.4 122.2 62.4 29.0 0.3 45.1 31.2 91 825 A Q S < S+ 0 0 130 -3,-1.2 2,-0.3 -7,-0.4 -2,-0.1 0.760 79.4 17.6 -82.5 -30.2 -1.4 47.5 33.6 92 826 A F S S- 0 0 77 -8,-0.3 2,-0.8 10,-0.1 10,-0.2 -0.849 84.3-103.1-132.9 167.0 -2.8 44.6 35.7 93 827 A L E -A 101 0A 2 8,-2.2 8,-2.8 -2,-0.3 2,-1.4 -0.879 35.4-158.0 -93.8 108.0 -2.3 40.9 36.2 94 828 A Y E +A 100 0A 38 -2,-0.8 6,-0.2 -14,-0.4 -10,-0.1 -0.635 27.1 160.9 -92.6 79.2 -5.2 39.4 34.3 95 829 A F E S- 0 0 18 -2,-1.4 -1,-0.2 4,-1.2 5,-0.2 0.909 75.0 -26.2 -60.9 -41.8 -5.6 35.9 35.8 96 830 A A E > S-A 99 0A 0 3,-1.4 3,-1.9 -3,-0.2 -1,-0.3 -0.952 72.7 -91.4-163.6 164.4 -9.1 35.7 34.4 97 831 A P T 3 S+ 0 0 41 0, 0.0 3,-0.2 0, 0.0 -80,-0.1 0.829 130.9 39.4 -58.3 -28.6 -11.9 38.1 33.4 98 832 A D T 3 S+ 0 0 47 1,-0.2 2,-0.2 -4,-0.0 -81,-0.1 0.186 114.6 57.8-100.9 11.9 -13.3 37.8 37.0 99 833 A L E < +A 96 0A 5 -3,-1.9 -3,-1.4 2,-0.0 -4,-1.2 -0.654 62.0 155.3-146.3 84.4 -9.8 37.8 38.7 100 834 A V E -A 94 0A 56 -6,-0.2 2,-0.5 -2,-0.2 -6,-0.2 -0.954 29.7-145.4-117.6 118.8 -7.7 40.9 37.8 101 835 A F E +A 93 0A 3 -8,-2.8 -8,-2.2 -2,-0.5 2,-0.2 -0.792 19.2 175.6 -94.4 125.4 -5.0 42.0 40.3 102 836 A N > - 0 0 65 -2,-0.5 4,-2.2 -10,-0.2 3,-0.2 -0.446 58.2 -79.3 -98.6-174.7 -4.0 45.5 40.9 103 837 A E H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.882 131.6 56.4 -56.8 -39.3 -1.5 46.4 43.6 104 838 A E H > S+ 0 0 114 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.924 108.7 45.8 -57.7 -46.9 -4.1 46.0 46.4 105 839 A K H > S+ 0 0 31 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.868 107.4 58.8 -65.2 -36.4 -4.8 42.5 45.3 106 840 A M H <>S+ 0 0 12 -4,-2.2 5,-1.2 1,-0.2 4,-0.2 0.932 112.1 40.7 -58.2 -45.0 -1.1 41.7 45.0 107 841 A H H ><5S+ 0 0 113 -4,-2.3 3,-1.6 1,-0.2 5,-0.2 0.919 112.8 53.8 -66.1 -45.4 -0.7 42.7 48.7 108 842 A Q H 3<5S+ 0 0 58 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.822 102.7 58.6 -61.7 -32.8 -4.0 40.9 49.8 109 843 A S T 3<5S- 0 0 1 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.533 107.2-125.1 -70.9 -11.4 -2.8 37.6 48.2 110 844 A A T < 5S+ 0 0 62 -3,-1.6 -3,-0.1 -4,-0.2 -2,-0.1 0.660 92.0 94.3 68.2 22.0 0.3 37.6 50.4 111 845 A M >< + 0 0 24 -5,-1.2 4,-2.8 1,-0.1 5,-0.3 -0.113 37.5 136.7-131.6 34.6 2.4 37.3 47.2 112 846 A Y H > S+ 0 0 50 -5,-0.2 4,-2.4 1,-0.2 5,-0.2 0.930 75.3 42.3 -52.6 -54.1 3.2 41.0 46.4 113 847 A E H > S+ 0 0 161 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.882 114.3 51.7 -66.3 -36.2 6.9 40.5 45.4 114 848 A L H > S+ 0 0 29 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.953 111.5 47.5 -63.6 -45.7 6.2 37.4 43.4 115 849 A C H X S+ 0 0 6 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.878 107.6 56.4 -62.3 -37.7 3.4 39.2 41.5 116 850 A Q H X S+ 0 0 86 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.895 105.2 52.1 -60.6 -40.5 5.8 42.2 40.9 117 851 A G H X S+ 0 0 30 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.907 111.4 46.7 -61.7 -42.6 8.3 39.8 39.3 118 852 A M H X S+ 0 0 5 -4,-1.9 4,-2.0 1,-0.2 3,-0.2 0.894 107.1 56.8 -64.9 -42.6 5.6 38.5 37.0 119 853 A H H X S+ 0 0 44 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.889 101.3 58.4 -56.5 -38.3 4.4 42.0 36.2 120 854 A Q H X S+ 0 0 102 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.898 104.1 50.8 -61.0 -39.9 8.0 42.8 35.0 121 855 A I H X S+ 0 0 13 -4,-1.2 4,-1.6 -3,-0.2 -1,-0.2 0.932 109.2 50.7 -60.1 -45.7 7.7 40.0 32.4 122 856 A S H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.869 107.7 53.9 -64.2 -32.5 4.4 41.4 31.1 123 857 A L H X S+ 0 0 63 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.860 103.3 56.4 -67.7 -33.7 6.1 44.8 30.9 124 858 A Q H X S+ 0 0 68 -4,-1.7 4,-2.6 1,-0.2 -1,-0.2 0.852 100.3 58.6 -64.9 -33.5 8.8 43.2 28.7 125 859 A F H X>S+ 0 0 0 -4,-1.6 5,-1.9 2,-0.2 4,-1.2 0.886 107.5 47.3 -60.0 -39.5 6.1 42.0 26.4 126 860 A V H <5S+ 0 0 41 -4,-1.1 3,-0.4 2,-0.2 -2,-0.2 0.941 111.0 50.4 -66.1 -48.1 5.1 45.7 25.9 127 861 A R H <5S+ 0 0 138 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.907 120.5 36.0 -54.0 -44.5 8.7 46.8 25.4 128 862 A L H <5S- 0 0 9 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.623 98.4-133.2 -82.9 -16.4 9.1 44.0 22.7 129 863 A Q T <5 - 0 0 114 -4,-1.2 -3,-0.2 -3,-0.4 -4,-0.1 0.965 32.8-150.1 47.8 56.4 5.6 44.2 21.2 130 864 A L < - 0 0 4 -5,-1.9 2,-0.2 -6,-0.1 -1,-0.1 -0.263 5.9-134.8 -54.2 136.4 5.6 40.4 21.5 131 865 A T > - 0 0 55 1,-0.1 4,-2.7 -3,-0.1 5,-0.1 -0.605 16.0-116.4 -94.8 160.7 3.5 38.9 18.8 132 866 A F H > S+ 0 0 54 1,-0.2 4,-2.7 -2,-0.2 5,-0.2 0.888 117.1 52.1 -58.9 -39.9 0.9 36.0 19.3 133 867 A E H > S+ 0 0 67 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.911 109.7 48.1 -66.4 -43.8 3.0 33.7 17.1 134 868 A E H > S+ 0 0 6 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.940 112.3 51.7 -57.4 -47.0 6.1 34.4 19.1 135 869 A Y H X S+ 0 0 2 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.922 108.0 49.2 -54.5 -49.3 4.1 33.7 22.2 136 870 A T H X S+ 0 0 2 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.903 115.0 43.4 -64.8 -40.2 2.7 30.4 21.1 137 871 A I H X S+ 0 0 1 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.919 113.0 52.2 -69.1 -44.2 6.2 29.1 20.0 138 872 A M H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.866 104.2 58.0 -60.2 -36.9 7.9 30.4 23.2 139 873 A K H X S+ 0 0 11 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.912 105.5 49.4 -62.5 -37.6 5.2 28.6 25.3 140 874 A V H X S+ 0 0 0 -4,-1.3 4,-1.3 1,-0.2 -1,-0.2 0.912 106.9 55.3 -65.7 -40.4 6.2 25.3 23.8 141 875 A L H < S+ 0 0 4 -4,-2.0 3,-0.4 1,-0.2 -1,-0.2 0.905 105.5 53.5 -60.5 -33.8 9.8 26.1 24.5 142 876 A L H >< S+ 0 0 3 -4,-2.1 3,-1.8 1,-0.2 4,-0.3 0.915 102.9 55.7 -65.3 -39.9 8.8 26.6 28.2 143 877 A L H 3< S+ 0 0 0 -4,-1.9 3,-0.3 1,-0.3 -1,-0.2 0.822 115.4 40.4 -53.5 -31.2 7.1 23.1 28.1 144 878 A L T 3< S+ 0 0 0 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.043 93.4 90.9-107.7 22.6 10.6 21.8 27.0 145 879 A S S < S+ 0 0 9 -3,-1.8 100,-3.2 1,-0.2 2,-0.4 0.532 81.6 46.4-102.1 -11.3 12.7 24.1 29.3 146 880 A T E +B 244 0B 14 -4,-0.3 -1,-0.2 -3,-0.3 -76,-0.1 -0.991 64.8 176.1-138.1 127.6 13.1 21.9 32.5 147 881 A I E -B 243 0B 33 96,-2.5 96,-2.8 -2,-0.4 2,-0.1 -0.840 39.0 -88.6-128.0 158.6 14.1 18.2 32.6 148 882 A P > - 0 0 9 0, 0.0 3,-0.9 0, 0.0 94,-0.2 -0.483 31.6-137.5 -60.6 141.5 14.8 15.5 35.1 149 883 A K T 3 S+ 0 0 145 92,-0.3 93,-0.1 1,-0.2 3,-0.1 0.752 102.6 54.2 -76.6 -19.2 18.5 15.5 36.0 150 884 A D T 3 S- 0 0 127 91,-0.2 -1,-0.2 1,-0.2 91,-0.0 0.305 120.5 -84.9-102.4 12.3 18.5 11.7 35.9 151 885 A G < - 0 0 46 -3,-0.9 -1,-0.2 3,-0.0 2,-0.2 0.323 25.1-105.9 109.4 134.3 17.1 11.4 32.4 152 886 A L - 0 0 27 -4,-0.2 3,-0.4 1,-0.1 -5,-0.0 -0.497 42.5-110.0 -74.1 161.5 14.0 11.4 30.2 153 887 A K S S+ 0 0 143 1,-0.3 2,-0.5 -2,-0.2 -1,-0.1 0.905 111.3 27.8 -60.8 -42.3 13.0 8.0 28.7 154 888 A S > + 0 0 34 1,-0.1 4,-2.0 -94,-0.1 -1,-0.3 -0.849 59.9 174.9-126.1 97.3 14.0 9.3 25.3 155 889 A Q H > S+ 0 0 127 -2,-0.5 4,-2.8 -3,-0.4 5,-0.2 0.916 85.2 54.8 -56.7 -45.7 16.7 11.9 25.1 156 890 A A H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.918 107.8 46.2 -59.7 -45.8 16.7 11.7 21.3 157 891 A A H > S+ 0 0 14 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.921 114.8 48.8 -66.6 -39.1 12.9 12.4 20.9 158 892 A F H X S+ 0 0 9 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.950 111.5 47.7 -61.3 -48.4 13.1 15.3 23.4 159 893 A E H X S+ 0 0 95 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.879 110.6 53.3 -66.2 -34.6 16.1 16.9 21.7 160 894 A E H X S+ 0 0 122 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.953 112.1 43.9 -62.2 -49.8 14.5 16.6 18.3 161 895 A M H X S+ 0 0 6 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.933 115.2 47.7 -62.5 -47.7 11.3 18.3 19.4 162 896 A R H X S+ 0 0 45 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.929 112.3 49.3 -61.4 -45.6 13.1 21.1 21.3 163 897 A T H X S+ 0 0 63 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.919 109.7 53.3 -56.5 -44.0 15.5 21.7 18.3 164 898 A N H X S+ 0 0 81 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.906 111.1 44.5 -60.4 -42.7 12.5 21.8 16.0 165 899 A Y H X S+ 0 0 12 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.862 110.6 53.5 -75.2 -31.9 10.7 24.5 18.1 166 900 A I H X S+ 0 0 38 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.947 111.0 48.5 -60.9 -45.3 13.9 26.6 18.5 167 901 A K H X S+ 0 0 82 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.886 107.5 55.3 -61.1 -40.4 14.2 26.5 14.7 168 902 A E H X S+ 0 0 63 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.936 111.5 43.6 -58.4 -43.6 10.6 27.5 14.3 169 903 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.941 115.0 48.6 -68.4 -45.6 11.2 30.6 16.5 170 904 A R H X S+ 0 0 84 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.921 114.1 46.1 -61.3 -44.7 14.5 31.5 14.8 171 905 A K H X S+ 0 0 103 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.940 113.5 48.9 -64.9 -47.2 13.0 31.2 11.3 172 906 A M H X S+ 0 0 49 -4,-2.3 4,-0.8 -5,-0.3 -2,-0.2 0.930 115.6 41.9 -58.3 -49.0 10.0 33.1 12.2 173 907 A V H >< S+ 0 0 1 -4,-2.5 3,-0.5 1,-0.2 6,-0.2 0.931 117.2 46.2 -64.7 -45.4 11.8 36.0 13.8 174 908 A T H 3< S+ 0 0 43 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.727 115.1 46.4 -75.6 -20.7 14.6 36.2 11.2 175 909 A K H 3< S+ 0 0 167 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.557 85.8 106.8 -94.3 -9.6 12.3 36.1 8.2 176 910 A C X< - 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