==== 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 3WFF . COMPND 2 MOLECULE: MINERALOCORTICOID RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.SOGABE,N.HABUKA . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12926.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 74.0 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 3.1 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 . 10 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 56.6 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 2 1 0 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 1 727 A L 0 0 183 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -16.5 19.0 26.1 26.2 2 728 A S > - 0 0 68 1,-0.1 4,-3.1 4,-0.0 5,-0.2 -0.238 360.0-114.1 -60.5 154.0 18.4 29.0 23.8 3 729 A T H > S+ 0 0 105 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.918 118.2 41.4 -54.8 -48.0 18.6 32.6 25.2 4 730 A I H > S+ 0 0 126 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.947 113.5 53.1 -66.3 -49.8 14.9 33.2 24.6 5 731 A S H > S+ 0 0 60 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.918 110.3 48.8 -50.6 -48.2 13.9 29.8 25.8 6 732 A R H < S+ 0 0 148 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.879 110.4 49.1 -61.4 -42.6 15.9 30.4 29.1 7 733 A A H < S+ 0 0 83 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.765 121.7 34.8 -71.0 -23.5 14.4 33.8 29.8 8 734 A L H < S+ 0 0 137 -4,-1.6 -2,-0.2 -3,-0.4 -1,-0.2 0.533 86.2 117.1-109.3 -10.7 10.8 32.5 29.2 9 735 A T S < S- 0 0 86 -4,-1.6 -3,-0.0 -5,-0.2 -4,-0.0 -0.251 83.1 -78.3 -64.9 144.3 10.9 28.9 30.5 10 736 A P - 0 0 56 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 -0.138 55.7-108.2 -45.1 132.6 8.6 28.2 33.5 11 737 A S > - 0 0 49 -3,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.039 35.3 -96.8 -52.6 163.7 10.2 29.5 36.7 12 738 A P H > S+ 0 0 55 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.902 125.3 50.4 -58.0 -40.6 11.5 27.0 39.2 13 739 A V H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.881 108.6 52.8 -65.4 -36.4 8.3 27.0 41.3 14 740 A M H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.895 108.4 51.4 -63.0 -39.7 6.2 26.4 38.2 15 741 A V H X S+ 0 0 39 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.936 107.8 51.7 -61.9 -47.7 8.4 23.4 37.4 16 742 A L H < S+ 0 0 2 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.896 110.1 50.0 -55.2 -41.2 7.9 22.0 40.9 17 743 A E H >< S+ 0 0 47 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.882 109.0 52.0 -68.8 -35.2 4.1 22.3 40.4 18 744 A N H 3< S+ 0 0 119 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.878 110.5 46.8 -66.7 -38.7 4.2 20.6 37.1 19 745 A I T 3< S+ 0 0 39 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.324 78.2 131.6 -91.2 7.8 6.2 17.5 38.4 20 746 A E < - 0 0 45 -3,-0.8 -3,-0.0 -4,-0.3 34,-0.0 -0.373 67.1-101.6 -60.5 129.9 4.0 17.0 41.5 21 747 A P - 0 0 44 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.106 33.8-110.9 -57.9 154.9 3.0 13.3 41.6 22 748 A E - 0 0 131 1,-0.2 2,-0.1 -3,-0.1 31,-0.0 -0.166 50.7 -68.6 -70.7 173.8 -0.4 12.0 40.5 23 749 A I - 0 0 120 1,-0.0 2,-0.4 81,-0.0 -1,-0.2 -0.411 48.0-155.9 -67.7 137.8 -3.0 10.6 42.9 24 750 A V - 0 0 26 79,-0.1 2,-0.3 -2,-0.1 26,-0.1 -0.984 3.5-147.3-122.1 128.3 -2.2 7.3 44.6 25 751 A Y - 0 0 136 -2,-0.4 24,-0.1 79,-0.1 79,-0.0 -0.644 8.8-145.4 -90.2 146.5 -4.8 4.9 45.9 26 752 A A - 0 0 0 -2,-0.3 -1,-0.1 23,-0.0 23,-0.1 0.815 32.2-127.9 -77.2 -31.5 -4.2 2.7 48.9 27 753 A G - 0 0 41 1,-0.1 2,-0.2 18,-0.0 18,-0.0 0.937 30.5-153.6 76.5 55.3 -6.3 -0.2 47.6 28 754 A Y - 0 0 73 1,-0.1 2,-0.9 2,-0.0 -1,-0.1 -0.470 4.7-139.8 -70.0 128.8 -8.4 -0.4 50.8 29 755 A D > - 0 0 66 -2,-0.2 3,-1.6 1,-0.1 -1,-0.1 -0.801 13.8-169.6 -96.3 102.2 -9.8 -3.9 51.4 30 756 A S T 3 S+ 0 0 106 -2,-0.9 -1,-0.1 1,-0.3 4,-0.1 0.578 81.2 67.8 -63.4 -14.9 -13.3 -3.5 52.7 31 757 A S T 3 S+ 0 0 99 2,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.590 91.6 74.5 -85.7 -10.5 -13.4 -7.3 53.6 32 758 A K S < S- 0 0 81 -3,-1.6 2,-0.0 1,-0.1 0, 0.0 -0.795 86.0-113.8-103.4 144.3 -10.8 -6.8 56.4 33 759 A P - 0 0 85 0, 0.0 2,-1.9 0, 0.0 5,-0.2 -0.313 33.2-103.1 -70.2 158.0 -11.4 -5.1 59.7 34 760 A D + 0 0 39 4,-0.1 2,-0.2 -4,-0.1 -4,-0.0 -0.534 68.7 143.8 -79.9 72.6 -9.8 -1.8 60.7 35 761 A T > - 0 0 51 -2,-1.9 4,-3.2 1,-0.1 5,-0.3 -0.666 66.0-105.4-103.4 168.9 -7.2 -3.4 62.9 36 762 A A H > S+ 0 0 17 -2,-0.2 4,-3.1 1,-0.2 5,-0.4 0.922 120.1 56.7 -60.1 -47.9 -3.6 -2.2 63.3 37 763 A E H > S+ 0 0 74 1,-0.2 4,-1.6 2,-0.2 192,-0.4 0.897 115.9 35.2 -47.3 -51.0 -2.3 -5.2 61.3 38 764 A N H > S+ 0 0 35 2,-0.2 4,-2.2 -5,-0.2 -2,-0.2 0.870 118.5 48.7 -79.8 -40.2 -4.5 -4.2 58.3 39 765 A L H X S+ 0 0 2 -4,-3.2 4,-2.8 2,-0.2 -2,-0.2 0.936 115.6 44.0 -65.1 -45.7 -4.3 -0.4 58.6 40 766 A L H X S+ 0 0 11 -4,-3.1 4,-2.7 -5,-0.3 -2,-0.2 0.891 113.1 51.6 -68.4 -38.6 -0.6 -0.4 58.9 41 767 A S H X S+ 0 0 5 -4,-1.6 4,-2.3 -5,-0.4 -1,-0.2 0.924 112.5 47.1 -61.7 -42.0 -0.2 -3.0 56.1 42 768 A T H X S+ 0 0 10 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.907 111.3 50.0 -65.9 -42.7 -2.3 -0.8 54.0 43 769 A L H X S+ 0 0 15 -4,-2.8 4,-3.2 2,-0.2 -2,-0.2 0.911 111.6 49.4 -59.9 -42.5 -0.4 2.4 54.9 44 770 A N H X S+ 0 0 17 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.920 111.2 48.0 -65.4 -42.4 2.9 0.6 54.1 45 771 A R H X S+ 0 0 68 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.951 114.9 47.0 -60.7 -50.7 1.6 -0.6 50.7 46 772 A L H X S+ 0 0 1 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.930 111.3 50.5 -53.7 -50.7 0.3 2.9 50.0 47 773 A A H X S+ 0 0 9 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.810 105.7 57.0 -62.9 -32.2 3.6 4.4 51.1 48 774 A G H X S+ 0 0 4 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.945 110.8 43.2 -62.1 -46.2 5.6 2.0 48.8 49 775 A K H X S+ 0 0 82 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.865 112.6 52.0 -70.6 -36.0 3.7 3.2 45.8 50 776 A Q H X S+ 0 0 23 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.890 107.1 54.5 -65.0 -36.0 4.0 6.9 46.9 51 777 A M H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.847 102.7 56.0 -68.2 -33.5 7.7 6.4 47.2 52 778 A I H X S+ 0 0 89 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.924 110.3 45.8 -59.4 -43.9 7.9 5.1 43.6 53 779 A Q H X S+ 0 0 30 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.868 109.1 55.7 -67.3 -34.4 6.3 8.4 42.6 54 780 A V H X S+ 0 0 14 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.880 106.8 50.3 -63.6 -37.7 8.7 10.3 44.9 55 781 A V H X S+ 0 0 62 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.924 110.9 47.9 -66.9 -45.2 11.7 8.7 43.1 56 782 A K H X S+ 0 0 105 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.907 113.6 49.8 -57.7 -44.2 10.2 9.7 39.7 57 783 A W H >< S+ 0 0 9 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.941 109.9 48.8 -58.6 -50.3 9.7 13.2 41.1 58 784 A A H >< S+ 0 0 1 -4,-3.0 3,-1.4 1,-0.2 -1,-0.2 0.835 102.2 65.3 -62.9 -32.7 13.2 13.5 42.4 59 785 A K H 3< S+ 0 0 164 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.827 111.8 32.9 -58.7 -35.8 14.5 12.3 39.0 60 786 A V T << S+ 0 0 82 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.102 88.1 122.2-110.0 18.6 13.2 15.4 37.3 61 787 A L S X> S- 0 0 1 -3,-1.4 3,-2.0 -4,-0.1 4,-0.7 -0.739 74.0-110.5 -80.7 118.5 13.7 17.8 40.3 62 788 A P T 34 S+ 0 0 54 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.255 99.2 12.4 -58.1 130.6 16.0 20.6 39.1 63 789 A G T >4 S+ 0 0 18 109,-0.0 3,-0.5 4,-0.0 4,-0.2 -0.039 101.8 95.4 99.3 -28.8 19.5 20.3 40.7 64 790 A F G X4 S+ 0 0 2 -3,-2.0 3,-1.9 1,-0.3 -5,-0.1 0.907 80.1 55.1 -67.4 -44.3 19.0 16.8 42.1 65 791 A K G 3< S+ 0 0 155 -4,-0.7 -1,-0.3 1,-0.3 7,-0.1 0.801 96.2 69.6 -54.0 -31.1 20.6 15.1 39.2 66 792 A N G < S+ 0 0 126 -3,-0.5 -1,-0.3 99,-0.1 -2,-0.2 0.533 86.4 82.8 -68.9 -9.2 23.7 17.3 39.8 67 793 A L S < S- 0 0 7 -3,-1.9 5,-0.0 -4,-0.2 -4,-0.0 -0.691 96.9 -91.6 -89.0 153.3 24.4 15.4 43.1 68 794 A P >> - 0 0 30 0, 0.0 4,-2.3 0, 0.0 3,-0.8 -0.346 37.2-113.4 -58.3 144.0 26.3 12.1 43.1 69 795 A L H 3> S+ 0 0 124 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.879 115.9 52.7 -44.6 -52.7 24.1 9.0 42.8 70 796 A E H 3> S+ 0 0 111 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.852 109.8 48.6 -60.7 -35.7 24.9 7.8 46.4 71 797 A D H <> S+ 0 0 3 -3,-0.8 4,-2.8 2,-0.2 -1,-0.2 0.888 110.2 51.7 -68.1 -41.5 23.9 11.2 47.8 72 798 A Q H X S+ 0 0 42 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.942 113.3 44.7 -57.9 -48.7 20.6 11.2 45.9 73 799 A I H X S+ 0 0 73 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.937 113.2 51.8 -58.4 -49.1 19.9 7.7 47.2 74 800 A T H X S+ 0 0 24 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.878 108.8 50.1 -56.3 -45.7 20.9 8.8 50.7 75 801 A L H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.881 111.0 47.5 -65.5 -40.9 18.7 11.9 50.7 76 802 A I H X S+ 0 0 21 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.910 113.5 48.8 -65.1 -40.1 15.6 10.0 49.6 77 803 A Q H < S+ 0 0 24 -4,-2.2 -2,-0.2 1,-0.2 4,-0.2 0.782 115.0 43.9 -72.8 -30.9 16.2 7.3 52.2 78 804 A Y H < S+ 0 0 10 -4,-1.9 4,-0.2 -5,-0.2 3,-0.2 0.836 122.0 37.1 -78.1 -34.9 16.7 9.8 55.0 79 805 A S H X S+ 0 0 0 -4,-2.1 4,-2.6 72,-0.2 5,-0.2 0.367 81.0 106.9 -99.7 1.4 13.7 12.1 54.1 80 806 A W H X S+ 0 0 4 -4,-0.9 4,-2.6 1,-0.2 5,-0.2 0.914 83.6 44.2 -57.1 -42.8 11.1 9.6 52.9 81 807 A M H > S+ 0 0 27 1,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.875 112.5 52.9 -71.3 -34.8 8.9 9.9 56.0 82 808 A S H > S+ 0 0 3 -4,-0.2 4,-2.4 2,-0.2 5,-0.2 0.926 110.9 47.7 -59.9 -45.3 9.1 13.7 55.9 83 809 A L H X S+ 0 0 3 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.958 114.8 44.7 -64.2 -46.7 8.1 13.8 52.3 84 810 A L H X S+ 0 0 18 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.911 114.9 49.1 -64.0 -39.4 5.1 11.4 52.9 85 811 A S H X S+ 0 0 5 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.909 112.4 46.9 -65.3 -42.6 4.1 13.3 56.0 86 812 A F H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.924 113.5 47.7 -66.9 -43.5 4.2 16.7 54.4 87 813 A A H X S+ 0 0 14 -4,-2.4 4,-2.8 -5,-0.2 5,-0.2 0.898 110.8 53.1 -65.1 -38.5 2.3 15.5 51.4 88 814 A L H X S+ 0 0 12 -4,-2.4 4,-2.7 -5,-0.2 14,-0.4 0.936 108.5 49.4 -57.9 -46.2 -0.2 13.9 53.7 89 815 A S H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.922 111.2 50.1 -63.7 -42.0 -0.7 17.2 55.5 90 816 A W H X S+ 0 0 23 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.941 112.2 45.7 -59.7 -50.5 -1.2 19.0 52.2 91 817 A R H X S+ 0 0 53 -4,-2.8 4,-2.8 1,-0.2 5,-0.4 0.892 112.7 51.6 -60.5 -39.3 -3.8 16.5 51.0 92 818 A S H X S+ 0 0 0 -4,-2.7 6,-2.6 -5,-0.2 4,-1.7 0.905 112.6 46.6 -65.2 -40.6 -5.5 16.7 54.4 93 819 A Y H X S+ 0 0 21 -4,-2.4 4,-1.5 4,-0.3 -2,-0.2 0.965 117.5 41.0 -62.5 -55.0 -5.6 20.4 54.2 94 820 A K H < S+ 0 0 122 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.894 124.1 34.8 -65.2 -43.9 -6.8 20.6 50.6 95 821 A H H < S+ 0 0 110 -4,-2.8 -1,-0.2 -5,-0.2 -3,-0.2 0.805 136.8 13.6 -84.4 -31.3 -9.4 17.8 50.7 96 822 A T H >< S- 0 0 20 -4,-1.7 3,-1.4 -5,-0.4 -3,-0.2 0.243 97.2-110.2-129.6 10.3 -10.8 18.1 54.3 97 823 A N T 3< S- 0 0 91 -4,-1.5 -4,-0.3 1,-0.3 -3,-0.1 0.854 78.5 -62.3 52.6 37.9 -9.6 21.5 55.6 98 824 A S T 3 S+ 0 0 0 -6,-2.6 -1,-0.3 2,-0.1 -5,-0.2 0.696 110.3 121.1 62.9 25.7 -7.3 19.5 57.9 99 825 A Q S < S+ 0 0 119 -3,-1.4 2,-0.2 -7,-0.4 -2,-0.1 0.843 79.0 20.5 -77.9 -37.2 -10.2 17.8 59.7 100 826 A F S S- 0 0 75 -8,-0.3 2,-0.8 10,-0.1 10,-0.2 -0.746 85.4-103.4-126.8 168.9 -9.0 14.3 58.7 101 827 A L E -A 109 0A 1 8,-2.3 8,-2.6 -2,-0.2 2,-1.4 -0.866 32.9-160.6 -96.0 104.6 -5.8 12.7 57.6 102 828 A Y E +A 108 0A 38 -2,-0.8 6,-0.2 -14,-0.4 -10,-0.1 -0.640 23.6 163.0 -89.1 85.5 -6.3 12.1 53.9 103 829 A F E S- 0 0 24 4,-1.6 -1,-0.2 -2,-1.4 5,-0.2 0.879 73.6 -26.4 -68.1 -38.5 -3.8 9.4 53.1 104 830 A A E > S-A 107 0A 0 3,-1.4 3,-1.9 -3,-0.2 -1,-0.3 -0.930 74.7 -89.1-164.5 166.6 -5.5 8.6 49.8 105 831 A P T 3 S+ 0 0 47 0, 0.0 3,-0.2 0, 0.0 -80,-0.1 0.832 130.5 41.6 -59.4 -29.4 -9.0 8.9 48.4 106 832 A D T 3 S+ 0 0 49 1,-0.2 2,-0.2 -4,-0.0 -81,-0.1 0.192 115.0 54.2-100.1 12.9 -9.8 5.4 49.7 107 833 A L E < +A 104 0A 3 -3,-1.9 -4,-1.6 -79,-0.0 -3,-1.4 -0.680 60.0 154.9-150.7 88.0 -8.0 5.9 53.1 108 834 A V E -A 102 0A 52 -6,-0.2 2,-0.6 -2,-0.2 -6,-0.2 -0.978 30.8-144.2-116.9 125.4 -9.0 8.9 55.2 109 835 A F E +A 101 0A 0 -8,-2.6 -8,-2.3 -2,-0.5 2,-0.2 -0.852 18.1 179.7 -98.2 120.9 -8.5 8.7 58.9 110 836 A N > - 0 0 65 -2,-0.6 4,-2.1 -10,-0.2 5,-0.1 -0.343 56.4 -79.6 -89.4-170.5 -10.8 10.2 61.5 111 837 A E H > S+ 0 0 106 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.867 130.9 56.9 -63.5 -38.1 -10.0 9.8 65.2 112 838 A E H > S+ 0 0 119 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.916 109.0 45.3 -58.8 -46.4 -11.4 6.3 65.3 113 839 A K H > S+ 0 0 35 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.879 107.0 59.6 -64.1 -37.0 -8.9 5.2 62.6 114 840 A M H <>S+ 0 0 2 -4,-2.1 5,-1.3 2,-0.2 -2,-0.2 0.928 110.9 41.6 -57.3 -45.1 -6.1 7.0 64.3 115 841 A H H ><5S+ 0 0 107 -4,-2.1 3,-2.2 1,-0.2 5,-0.3 0.954 112.6 53.5 -62.5 -51.8 -6.8 4.8 67.4 116 842 A Q H 3<5S+ 0 0 59 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.833 101.9 59.8 -56.7 -32.8 -7.3 1.6 65.3 117 843 A S T 3<5S- 0 0 0 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.554 107.9-122.5 -75.3 -6.7 -3.9 2.1 63.6 118 844 A A T < 5S+ 0 0 57 -3,-2.2 -3,-0.1 -4,-0.2 -2,-0.1 0.765 94.2 88.4 66.3 25.2 -2.0 2.0 66.9 119 845 A M >< + 0 0 27 -5,-1.3 4,-2.6 -4,-0.1 5,-0.2 -0.161 41.0 141.8-142.2 54.1 -0.5 5.4 66.3 120 846 A Y H > S+ 0 0 57 -5,-0.3 4,-2.7 1,-0.2 5,-0.2 0.941 75.0 44.0 -58.5 -53.4 -3.1 7.7 67.8 121 847 A E H > S+ 0 0 140 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.904 113.7 51.0 -64.9 -39.5 -0.7 10.2 69.2 122 848 A L H > S+ 0 0 30 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 111.6 47.7 -62.3 -43.1 1.5 10.3 66.1 123 849 A C H X S+ 0 0 5 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.892 110.7 52.0 -64.2 -39.4 -1.6 10.9 63.9 124 850 A Q H X S+ 0 0 29 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.916 108.3 50.9 -64.2 -39.3 -2.8 13.6 66.2 125 851 A G H X S+ 0 0 20 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.888 113.1 46.1 -64.2 -40.2 0.6 15.3 66.0 126 852 A M H X S+ 0 0 5 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.898 109.0 54.3 -67.6 -43.4 0.4 15.1 62.2 127 853 A H H X S+ 0 0 28 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.905 106.2 53.9 -54.0 -40.9 -3.1 16.4 62.2 128 854 A Q H X S+ 0 0 120 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.902 105.9 51.6 -66.4 -36.9 -1.8 19.4 64.3 129 855 A I H >X S+ 0 0 16 -4,-1.7 4,-1.0 1,-0.2 3,-0.8 0.953 108.8 51.9 -59.2 -46.7 0.8 20.1 61.6 130 856 A S H 3X S+ 0 0 0 -4,-2.6 4,-0.9 1,-0.3 3,-0.4 0.843 102.4 59.2 -59.8 -32.5 -2.0 20.0 59.1 131 857 A L H 3X S+ 0 0 73 -4,-2.0 4,-2.0 1,-0.2 3,-0.4 0.834 98.2 59.4 -64.5 -32.7 -4.0 22.5 61.2 132 858 A Q H S+ 0 0 0 -4,-1.0 5,-2.1 -3,-0.4 4,-0.9 0.861 106.8 46.0 -61.1 -36.5 -1.6 24.7 57.0 134 860 A V H <5S+ 0 0 36 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.913 111.5 49.6 -70.6 -47.2 -5.1 26.2 57.7 135 861 A R H <5S+ 0 0 123 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.934 120.7 37.0 -56.7 -47.2 -3.8 28.9 60.0 136 862 A L H <5S- 0 0 0 -4,-2.8 51,-0.5 -5,-0.1 -1,-0.2 0.626 99.3-134.6 -78.5 -16.6 -1.2 29.9 57.4 137 863 A Q T <5 - 0 0 96 -4,-0.9 -3,-0.2 -5,-0.2 50,-0.1 0.966 32.3-147.2 50.9 55.6 -3.4 29.3 54.4 138 864 A L < - 0 0 5 -5,-2.1 2,-0.2 -6,-0.1 -1,-0.1 -0.208 8.8-136.0 -56.0 139.3 -0.4 27.6 53.0 139 865 A T > - 0 0 28 1,-0.1 4,-2.8 -3,-0.1 5,-0.2 -0.605 18.1-116.1 -98.5 160.9 -0.2 28.0 49.2 140 866 A F H > S+ 0 0 63 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.869 117.5 55.5 -58.8 -35.0 0.7 25.4 46.6 141 867 A E H > S+ 0 0 65 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.930 110.3 43.1 -64.7 -48.7 3.8 27.5 45.8 142 868 A E H > S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.937 113.2 54.5 -61.2 -46.4 5.0 27.4 49.4 143 869 A Y H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.938 107.9 46.6 -54.4 -54.2 4.1 23.7 49.6 144 870 A T H X S+ 0 0 1 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.896 115.6 45.1 -61.6 -40.2 6.1 22.6 46.6 145 871 A I H X S+ 0 0 1 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.940 112.7 51.3 -70.3 -42.7 9.2 24.5 47.6 146 872 A M H X S+ 0 0 0 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.868 103.5 58.9 -60.3 -36.3 9.0 23.4 51.1 147 873 A K H X S+ 0 0 9 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.917 105.2 50.1 -61.4 -39.8 8.7 19.8 50.0 148 874 A V H X S+ 0 0 0 -4,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.914 107.1 54.2 -63.6 -40.3 12.1 20.2 48.3 149 875 A L H < S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.876 106.1 53.3 -60.8 -35.6 13.6 21.6 51.4 150 876 A L H >< S+ 0 0 1 -4,-2.2 3,-1.9 1,-0.2 4,-0.3 0.922 103.6 54.8 -65.6 -39.6 12.4 18.5 53.2 151 877 A L H 3< S+ 0 0 0 -4,-2.0 3,-0.3 1,-0.3 -1,-0.2 0.873 116.0 41.4 -56.0 -32.7 14.2 16.3 50.7 152 878 A L T 3< S+ 0 0 0 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.083 94.5 85.1-104.7 21.4 17.2 18.3 51.7 153 879 A S S < S+ 0 0 1 -3,-1.9 100,-3.7 1,-0.1 2,-0.4 0.521 81.2 54.4-104.7 -7.9 16.7 18.5 55.5 154 880 A T E +B 252 0B 11 -3,-0.3 -76,-0.2 -4,-0.3 -1,-0.1 -0.988 60.6 158.4-134.0 126.0 18.3 15.3 56.8 155 881 A I E -B 251 0B 2 96,-2.6 96,-3.2 -2,-0.4 5,-0.1 -0.810 45.2 -73.1-135.8 171.4 21.8 14.1 56.1 156 882 A P > - 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