==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE RECEPTOR 04-JUN-11 2YLO . COMPND 2 MOLECULE: ANDROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.A.LACK,P.AXERIO,P.TAVASSOLI,K.KUCHENBECKER,F.Q.HAN,K.H.CHA . 250 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12351.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 77.2 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 . 9 3.6 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 56.4 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 0 1 1 0 0 2 0 1 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 1 0 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 0 220 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 124.2 -9.4 28.8 -22.5 2 671 A P > - 0 0 74 0, 0.0 4,-1.4 0, 0.0 0, 0.0 -0.731 360.0-172.9 -90.5 112.8 -10.8 25.2 -22.6 3 672 A I H > S+ 0 0 135 -2,-0.7 4,-1.6 2,-0.2 5,-0.1 0.873 81.7 58.6 -71.5 -38.0 -14.4 25.1 -23.8 4 673 A F H > S+ 0 0 31 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.891 108.0 43.3 -62.6 -47.8 -14.7 21.3 -23.1 5 674 A L H > S+ 0 0 31 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.836 107.4 60.8 -62.7 -39.9 -13.9 21.5 -19.3 6 675 A N H X S+ 0 0 91 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.941 108.7 45.2 -49.8 -46.0 -16.0 24.6 -18.9 7 676 A V H X S+ 0 0 44 -4,-1.6 4,-2.6 1,-0.2 5,-0.2 0.939 110.9 50.6 -67.6 -46.5 -18.9 22.5 -20.0 8 677 A L H X S+ 0 0 2 -4,-1.8 4,-0.6 1,-0.3 -1,-0.2 0.797 115.8 43.2 -60.1 -34.2 -18.1 19.5 -17.9 9 678 A E H < S+ 0 0 121 -4,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.750 111.4 54.3 -84.1 -30.6 -17.8 21.7 -14.8 10 679 A A H < S+ 0 0 84 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.925 112.5 41.7 -71.0 -42.2 -20.9 23.8 -15.6 11 680 A I H < S+ 0 0 39 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.602 80.4 126.8 -87.5 -12.0 -23.2 20.7 -15.9 12 681 A E < - 0 0 64 -4,-0.6 -3,-0.0 -5,-0.2 124,-0.0 -0.173 65.9-112.4 -46.1 125.5 -21.9 18.8 -12.9 13 682 A P - 0 0 41 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.275 26.2-128.3 -68.3 151.6 -24.8 17.9 -10.6 14 683 A G - 0 0 61 1,-0.2 2,-0.2 31,-0.0 31,-0.0 0.136 51.2 -48.1 -73.8-163.2 -25.2 19.4 -7.1 15 684 A V - 0 0 109 81,-0.0 2,-0.5 1,-0.0 -1,-0.2 -0.469 51.8-156.4 -68.0 136.2 -25.8 17.6 -3.9 16 685 A V - 0 0 14 -2,-0.2 2,-0.3 -3,-0.1 26,-0.1 -0.985 8.5-144.1-116.8 123.6 -28.5 15.0 -3.9 17 686 A C - 0 0 62 -2,-0.5 24,-0.1 79,-0.1 79,-0.0 -0.636 6.0-143.5 -86.3 143.5 -30.1 14.1 -0.5 18 687 A A - 0 0 0 -2,-0.3 -1,-0.1 2,-0.1 23,-0.1 0.687 28.2-129.6 -77.9 -24.5 -31.2 10.4 0.1 19 688 A G + 0 0 49 1,-0.2 2,-0.1 18,-0.1 80,-0.1 0.533 51.2 160.3 84.1 10.2 -34.3 11.3 2.1 20 689 A H - 0 0 15 78,-0.2 2,-1.4 1,-0.1 -1,-0.2 -0.394 45.6-133.2 -72.0 137.6 -33.2 8.9 4.8 21 690 A D > - 0 0 95 1,-0.2 3,-2.7 -2,-0.1 -1,-0.1 -0.686 20.1-170.8 -87.1 82.2 -34.6 9.1 8.4 22 691 A N T 3 S+ 0 0 78 -2,-1.4 -1,-0.2 1,-0.3 4,-0.1 0.565 77.9 77.0 -53.3 -6.1 -31.3 8.9 10.2 23 692 A N T 3 S+ 0 0 150 2,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.427 77.9 90.6 -86.3 0.0 -33.5 8.6 13.4 24 693 A Q S < S- 0 0 91 -3,-2.7 2,-0.2 1,-0.1 -4,-0.0 -0.589 91.4-100.5 -83.6 151.3 -34.2 4.9 12.5 25 694 A P - 0 0 102 0, 0.0 2,-2.7 0, 0.0 5,-0.1 -0.533 48.2 -96.5 -66.5 147.2 -32.1 2.1 13.7 26 695 A D + 0 0 34 -2,-0.2 2,-0.2 -4,-0.1 -4,-0.0 -0.396 64.4 165.3 -67.5 69.6 -29.7 1.0 11.0 27 696 A S > - 0 0 45 -2,-2.7 4,-2.3 1,-0.1 5,-0.2 -0.537 45.5-120.1 -86.3 157.3 -31.8 -1.9 9.8 28 697 A F H > S+ 0 0 16 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.934 111.9 48.9 -58.3 -54.2 -31.3 -3.7 6.4 29 698 A A H > S+ 0 0 26 1,-0.2 4,-3.0 2,-0.2 192,-0.3 0.892 116.0 45.2 -51.6 -42.8 -34.7 -2.9 4.9 30 699 A A H > S+ 0 0 11 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.831 113.2 46.6 -78.9 -40.1 -34.3 0.8 5.8 31 700 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.911 119.2 43.8 -62.8 -44.5 -30.7 1.2 4.7 32 701 A L H X S+ 0 0 7 -4,-2.7 4,-2.7 -5,-0.2 -2,-0.2 0.933 111.2 50.3 -73.5 -43.9 -31.6 -0.6 1.4 33 702 A S H X S+ 0 0 27 -4,-3.0 4,-1.7 -5,-0.3 -1,-0.2 0.819 113.3 50.1 -59.4 -31.1 -35.0 1.2 0.7 34 703 A S H X S+ 0 0 16 -4,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.934 108.1 50.0 -72.5 -46.9 -33.1 4.4 1.3 35 704 A L H X S+ 0 0 25 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.866 110.1 53.2 -55.2 -43.4 -30.3 3.5 -1.2 36 705 A N H X S+ 0 0 6 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.933 108.8 47.9 -54.5 -48.5 -33.0 2.6 -3.7 37 706 A E H X S+ 0 0 67 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.895 110.3 52.0 -61.9 -44.0 -34.6 6.1 -3.2 38 707 A L H X S+ 0 0 8 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.933 109.5 51.8 -53.0 -49.8 -31.1 7.7 -3.6 39 708 A G H X S+ 0 0 9 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.960 109.5 47.3 -49.6 -60.2 -30.8 5.7 -6.8 40 709 A E H X S+ 0 0 38 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.852 116.2 44.4 -54.6 -43.6 -34.1 6.9 -8.3 41 710 A R H X S+ 0 0 95 -4,-2.2 4,-1.3 1,-0.2 3,-0.3 0.969 111.7 50.7 -64.4 -57.3 -33.4 10.6 -7.4 42 711 A Q H X S+ 0 0 19 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.728 102.0 66.5 -52.4 -23.5 -29.8 10.5 -8.7 43 712 A L H X S+ 0 0 7 -4,-1.5 4,-2.8 -5,-0.2 -1,-0.2 0.983 97.1 51.1 -65.7 -57.4 -31.2 9.0 -11.9 44 713 A V H X S+ 0 0 59 -4,-1.2 4,-2.0 -3,-0.3 -1,-0.2 0.858 111.9 48.5 -40.1 -47.8 -33.1 12.2 -12.8 45 714 A H H X S+ 0 0 70 -4,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.945 109.7 50.7 -67.6 -42.1 -29.9 14.1 -12.3 46 715 A V H X S+ 0 0 13 -4,-2.4 4,-3.5 1,-0.2 5,-0.2 0.892 109.0 53.5 -59.5 -41.5 -27.8 11.8 -14.4 47 716 A V H X S+ 0 0 34 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.959 112.6 41.2 -58.4 -53.7 -30.3 12.0 -17.2 48 717 A K H X S+ 0 0 139 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.870 116.6 50.5 -69.1 -33.9 -30.3 15.8 -17.4 49 718 A W H < S+ 0 0 11 -4,-2.7 3,-0.5 -5,-0.2 -2,-0.2 0.977 113.4 45.2 -61.2 -52.3 -26.5 15.8 -16.9 50 719 A A H >< S+ 0 0 0 -4,-3.5 3,-2.3 1,-0.3 -2,-0.2 0.936 110.9 52.6 -59.3 -53.1 -26.0 13.3 -19.7 51 720 A K H 3< S+ 0 0 70 -4,-2.9 6,-0.3 1,-0.3 -1,-0.3 0.763 108.1 52.6 -53.9 -29.6 -28.5 15.1 -22.1 52 721 A A T 3< S+ 0 0 43 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.199 87.4 115.1 -94.9 21.0 -26.5 18.3 -21.6 53 722 A L S X S- 0 0 9 -3,-2.3 3,-1.5 1,-0.1 4,-0.5 -0.582 80.3 -92.8 -87.4 150.8 -23.2 16.7 -22.5 54 723 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.441 108.4 0.9 -65.0 126.4 -21.2 17.8 -25.6 55 724 A G T >> S+ 0 0 28 -2,-0.2 4,-0.7 3,-0.0 3,-0.6 0.292 99.5 115.3 84.9 -9.4 -22.2 15.6 -28.6 56 725 A F G X4 + 0 0 0 -3,-1.5 3,-1.2 1,-0.3 -5,-0.1 0.903 68.7 51.6 -69.2 -48.1 -24.7 13.6 -26.6 57 726 A R G 34 S+ 0 0 194 -4,-0.5 -1,-0.3 -6,-0.3 7,-0.1 0.678 95.3 80.3 -62.6 -16.3 -28.1 14.5 -28.3 58 727 A N G <4 S+ 0 0 121 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.955 77.8 84.5 -44.4 -55.9 -26.1 13.5 -31.5 59 728 A L S << S- 0 0 3 -3,-1.2 5,-0.1 -4,-0.7 96,-0.1 -0.110 101.6 -87.2 -51.6 150.1 -26.8 9.8 -30.6 60 729 A H > - 0 0 58 94,-0.2 4,-2.0 1,-0.1 3,-0.3 -0.318 42.2-113.5 -56.4 142.0 -30.0 8.3 -31.7 61 730 A V H > S+ 0 0 91 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.845 115.1 45.4 -52.4 -49.3 -32.8 8.9 -29.1 62 731 A D H > S+ 0 0 97 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.858 112.1 53.2 -63.9 -37.9 -33.3 5.2 -28.0 63 732 A D H > S+ 0 0 5 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.829 102.9 59.6 -62.6 -34.2 -29.5 4.8 -27.8 64 733 A Q H X S+ 0 0 15 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.953 111.2 38.5 -60.4 -49.7 -29.5 7.9 -25.6 65 734 A M H X S+ 0 0 82 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.775 114.1 56.4 -69.7 -31.3 -31.8 6.1 -23.0 66 735 A A H >X S+ 0 0 13 -4,-1.9 4,-0.8 2,-0.2 3,-0.6 0.990 106.8 46.0 -65.6 -57.2 -30.1 2.8 -23.5 67 736 A V H 3X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.3 -1,-0.2 0.739 112.1 51.9 -64.2 -28.5 -26.5 3.9 -22.6 68 737 A I H 3X S+ 0 0 4 -4,-1.1 4,-1.8 -5,-0.2 -1,-0.3 0.883 110.9 50.2 -64.0 -42.4 -27.8 5.9 -19.5 69 738 A Q H << S+ 0 0 30 -4,-1.5 -2,-0.2 -3,-0.6 -1,-0.2 0.532 115.0 39.7 -83.7 -10.5 -29.6 2.7 -18.4 70 739 A Y H < S+ 0 0 24 -4,-0.8 4,-0.3 76,-0.2 3,-0.2 0.740 120.8 44.4 -96.8 -36.9 -26.7 0.4 -18.7 71 740 A S H X S+ 0 0 5 -4,-1.6 4,-1.9 -5,-0.2 3,-0.2 0.615 81.7 95.8 -85.7 -17.1 -24.1 2.8 -17.4 72 741 A W H X S+ 0 0 8 -4,-1.8 4,-2.7 1,-0.2 3,-0.4 0.876 82.7 51.3 -46.2 -60.6 -25.8 4.4 -14.3 73 742 A M H > S+ 0 0 21 1,-0.2 4,-2.8 -3,-0.2 5,-0.3 0.918 111.4 49.9 -36.0 -59.4 -24.3 2.1 -11.6 74 743 A G H > S+ 0 0 4 -4,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.891 113.6 45.5 -50.7 -44.9 -20.8 2.8 -12.9 75 744 A L H X S+ 0 0 4 -4,-1.9 4,-2.4 -3,-0.4 5,-0.2 0.962 114.4 45.4 -67.3 -53.7 -21.4 6.5 -12.9 76 745 A M H X S+ 0 0 30 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.880 113.1 50.6 -60.6 -41.6 -23.0 6.8 -9.5 77 746 A V H X S+ 0 0 8 -4,-2.8 4,-2.6 -5,-0.3 -1,-0.2 0.930 111.5 48.2 -59.4 -48.2 -20.3 4.5 -7.8 78 747 A F H X S+ 0 0 0 -4,-1.9 4,-1.6 -5,-0.3 -2,-0.2 0.951 114.7 44.6 -59.1 -53.8 -17.4 6.6 -9.3 79 748 A A H >X S+ 0 0 14 -4,-2.4 4,-3.0 2,-0.2 3,-0.6 0.931 113.0 51.2 -51.6 -54.0 -18.9 10.0 -8.3 80 749 A M H 3X S+ 0 0 5 -4,-2.6 4,-2.1 1,-0.3 14,-0.4 0.882 106.0 55.5 -59.2 -40.1 -19.7 8.6 -4.8 81 750 A G H 3X S+ 0 0 1 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.3 0.862 111.8 45.5 -51.0 -40.7 -16.1 7.4 -4.6 82 751 A W H X S- 0 0 22 -4,-1.0 3,-2.4 -5,-0.4 4,-0.6 -0.107 98.1-114.2-112.8 36.0 -14.5 12.1 4.6 89 758 A N T 34 S- 0 0 98 -4,-0.5 -4,-0.2 1,-0.3 -3,-0.1 0.679 70.0 -68.8 38.8 28.3 -10.9 11.4 3.3 90 759 A S T 34 S+ 0 0 8 -6,-2.2 -1,-0.3 2,-0.1 33,-0.2 0.266 109.5 119.3 82.8 -8.6 -12.2 8.0 2.1 91 760 A R T <4 S+ 0 0 162 -3,-2.4 2,-0.2 -7,-0.2 -2,-0.1 0.800 80.4 14.1 -64.1 -35.0 -12.7 6.7 5.6 92 761 A M S < S- 0 0 68 -4,-0.6 2,-0.7 -8,-0.2 10,-0.2 -0.716 91.5 -92.6-127.6-175.6 -16.5 6.1 5.2 93 762 A L E -A 101 0A 0 8,-2.0 2,-2.4 -2,-0.2 8,-1.8 -0.870 26.5-153.6-111.0 107.7 -18.9 6.1 2.2 94 763 A Y E +A 100 0A 45 -2,-0.7 6,-0.2 -14,-0.4 -11,-0.1 -0.332 30.7 157.1 -78.9 65.7 -20.5 9.4 1.4 95 764 A F E S- 0 0 19 -2,-2.4 -1,-0.2 4,-0.6 5,-0.2 0.926 76.0 -28.8 -56.1 -40.9 -23.7 8.2 -0.3 96 765 A A E > -A 99 0A 0 3,-0.7 3,-3.2 -3,-0.2 -1,-0.2 -0.923 68.7 -98.3-170.9 151.0 -25.4 11.5 0.5 97 766 A P T 3 S+ 0 0 52 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.896 129.1 44.6 -50.6 -42.0 -25.0 14.1 3.3 98 767 A D T 3 S+ 0 0 35 1,-0.2 -78,-0.2 -3,-0.1 -76,-0.1 0.025 117.3 47.7 -85.0 26.0 -28.0 12.5 5.0 99 768 A L E < +A 96 0A 0 -3,-3.2 -3,-0.7 -80,-0.1 -4,-0.6 -0.317 65.2 160.5-164.1 71.6 -26.7 8.9 4.4 100 769 A V E -A 94 0A 30 -3,-0.3 2,-0.6 -6,-0.2 -6,-0.2 -0.738 33.3-131.7 -95.9 143.0 -23.0 8.3 5.2 101 770 A F E -A 93 0A 0 -8,-1.8 -8,-2.0 -2,-0.3 2,-0.2 -0.902 23.3-178.4-104.3 121.4 -21.9 4.6 5.7 102 771 A N > - 0 0 63 -2,-0.6 4,-2.1 -10,-0.2 5,-0.2 -0.516 50.6 -88.9 -92.0 174.2 -19.8 3.7 8.8 103 772 A E H > S+ 0 0 105 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.937 128.7 55.7 -48.3 -45.6 -18.5 0.2 9.4 104 773 A Y H >> S+ 0 0 134 1,-0.3 4,-2.6 2,-0.2 3,-0.7 0.947 107.6 45.9 -64.5 -45.6 -21.6 -0.6 11.2 105 774 A R H 3> S+ 0 0 21 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.822 107.1 61.1 -60.4 -32.8 -23.9 0.4 8.3 106 775 A M H 3< S+ 0 0 1 -4,-2.1 5,-0.4 -3,-0.2 -1,-0.2 0.811 110.5 40.3 -63.3 -34.0 -21.6 -1.6 5.9 107 776 A H H X< S+ 0 0 122 -4,-1.8 3,-1.5 -3,-0.7 5,-0.2 0.912 114.8 51.0 -77.6 -45.3 -22.4 -4.8 7.8 108 777 A K H 3< S+ 0 0 69 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.814 101.7 60.6 -61.4 -37.0 -26.1 -4.0 8.3 109 778 A S T 3< S- 0 0 0 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.1 0.579 104.1-134.1 -58.9 -17.3 -26.6 -3.3 4.5 110 779 A R S < S+ 0 0 152 -3,-1.5 3,-0.2 -5,-0.1 -2,-0.1 0.556 85.6 95.9 64.5 10.7 -25.5 -6.9 4.1 111 780 A M > + 0 0 8 -5,-0.4 4,-1.9 1,-0.1 5,-0.2 -0.295 40.1 141.6-118.8 55.7 -23.2 -5.8 1.3 112 781 A Y H > + 0 0 81 -5,-0.2 4,-2.2 1,-0.2 -1,-0.1 0.887 68.1 49.1 -63.5 -44.3 -20.1 -5.4 3.3 113 782 A S H > S+ 0 0 74 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.840 110.5 51.9 -71.3 -29.0 -17.6 -6.7 0.7 114 783 A Q H > S+ 0 0 30 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.930 108.7 50.7 -68.1 -42.8 -19.0 -4.4 -2.0 115 784 A C H X S+ 0 0 0 -4,-1.9 4,-3.4 1,-0.2 -2,-0.2 0.906 107.0 53.8 -60.3 -42.5 -18.6 -1.4 0.3 116 785 A V H X S+ 0 0 32 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.913 110.9 47.8 -56.0 -39.2 -15.0 -2.4 1.0 117 786 A R H X S+ 0 0 80 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.924 111.6 48.4 -72.0 -44.2 -14.5 -2.4 -2.8 118 787 A M H X S+ 0 0 5 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.917 109.9 53.4 -58.2 -45.9 -16.2 0.9 -3.3 119 788 A R H X S+ 0 0 43 -4,-3.4 4,-2.4 2,-0.2 -2,-0.2 0.922 108.9 49.7 -54.0 -46.5 -14.1 2.3 -0.4 120 789 A H H X S+ 0 0 87 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.912 109.9 48.8 -58.7 -54.2 -10.9 1.1 -2.2 121 790 A L H X S+ 0 0 7 -4,-2.4 4,-1.1 2,-0.2 3,-0.3 0.949 110.0 53.5 -43.7 -59.0 -11.9 2.7 -5.5 122 791 A S H >X S+ 0 0 0 -4,-2.8 3,-0.9 1,-0.2 4,-0.6 0.920 107.3 51.5 -43.7 -50.1 -12.6 5.8 -3.5 123 792 A Q H >X S+ 0 0 48 -4,-2.4 4,-2.4 1,-0.2 3,-1.5 0.882 95.0 69.6 -62.1 -37.6 -9.0 5.6 -2.0 124 793 A E H 3X S+ 0 0 71 -4,-2.3 4,-3.1 1,-0.3 5,-0.4 0.878 89.4 65.2 -48.7 -36.6 -7.4 5.4 -5.5 125 794 A F H S+ 0 0 0 -4,-1.1 5,-1.4 -3,-0.9 4,-0.9 0.894 109.3 37.4 -52.0 -43.9 -8.5 9.0 -6.0 126 795 A G H <<5S+ 0 0 30 -3,-1.5 3,-0.4 -4,-0.6 -2,-0.2 0.942 115.3 53.3 -71.3 -49.7 -6.1 10.0 -3.2 127 796 A W H <5S+ 0 0 165 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.849 117.1 37.3 -56.4 -38.8 -3.4 7.4 -4.2 128 797 A L H <5S- 0 0 29 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.675 104.2-125.8 -87.8 -18.5 -3.2 8.6 -7.8 129 798 A Q T <5 - 0 0 155 -4,-0.9 -3,-0.2 -3,-0.4 -4,-0.1 0.803 33.8-164.1 71.5 35.0 -3.7 12.4 -7.1 130 799 A I < - 0 0 9 -5,-1.4 -1,-0.2 -6,-0.3 -2,-0.0 -0.258 8.5-139.8 -51.3 121.2 -6.7 12.6 -9.4 131 800 A T > - 0 0 40 1,-0.1 4,-2.8 4,-0.0 5,-0.2 -0.442 23.5-109.9 -77.4 160.1 -7.4 16.2 -10.3 132 801 A P H > S+ 0 0 65 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.762 120.5 56.1 -63.3 -21.8 -11.0 17.4 -10.5 133 802 A Q H > S+ 0 0 59 2,-0.2 4,-2.1 1,-0.1 5,-0.2 0.904 108.7 45.0 -74.5 -45.0 -10.5 17.8 -14.3 134 803 A E H > S+ 0 0 3 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.923 111.9 53.8 -59.5 -45.8 -9.4 14.1 -14.6 135 804 A F H X S+ 0 0 4 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.960 110.3 46.7 -53.4 -52.3 -12.3 13.1 -12.4 136 805 A L H X S+ 0 0 17 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.858 113.8 46.7 -62.7 -40.0 -14.8 14.9 -14.6 137 806 A C H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.969 113.5 48.4 -66.6 -45.1 -13.4 13.5 -17.9 138 807 A M H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.876 110.8 51.3 -63.5 -38.1 -13.3 10.0 -16.6 139 808 A K H X S+ 0 0 10 -4,-2.7 4,-0.6 -5,-0.3 -1,-0.2 0.924 111.7 45.3 -69.0 -39.7 -16.8 10.2 -15.2 140 809 A A H >< S+ 0 0 0 -4,-1.9 3,-2.3 1,-0.2 4,-0.5 0.963 111.4 54.8 -68.2 -44.1 -18.2 11.4 -18.6 141 810 A L H >< S+ 0 0 0 -4,-3.0 3,-1.5 1,-0.3 -1,-0.2 0.847 97.7 64.2 -50.5 -41.6 -16.2 8.8 -20.3 142 811 A L H >< S+ 0 0 4 -4,-2.3 3,-1.2 1,-0.2 -1,-0.3 0.763 88.3 69.0 -54.9 -25.0 -17.8 6.2 -18.1 143 812 A L T << S+ 0 0 0 -3,-2.3 3,-0.3 -4,-0.6 -1,-0.2 0.808 104.6 42.5 -66.7 -24.6 -21.1 7.1 -19.8 144 813 A F T < S+ 0 0 0 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.1 -0.279 90.6 94.0-113.0 40.0 -19.8 5.5 -23.0 145 814 A S S < S+ 0 0 4 -3,-1.2 100,-2.4 1,-0.2 2,-0.3 0.257 77.4 51.0-116.6 7.9 -18.2 2.4 -21.3 146 815 A I E +B 244 0B 7 98,-0.3 -75,-0.2 -3,-0.3 -1,-0.2 -0.940 60.6 147.8-155.5 127.4 -21.0 -0.2 -21.6 147 816 A I E -B 243 0B 23 96,-2.3 96,-3.0 -2,-0.3 2,-0.1 -0.972 49.7 -75.3-157.0 159.3 -23.1 -1.4 -24.5 148 817 A P E > -B 242 0B 17 0, 0.0 3,-1.7 0, 0.0 94,-0.3 -0.394 38.6-130.1 -64.3 135.6 -24.9 -4.4 -26.2 149 818 A V T 3 S+ 0 0 102 92,-2.1 93,-0.1 1,-0.3 3,-0.1 0.812 109.8 56.1 -57.0 -31.8 -22.5 -6.9 -27.8 150 819 A D T 3 S- 0 0 145 91,-0.5 -1,-0.3 1,-0.2 92,-0.1 -0.005 117.8-111.6 -92.3 31.6 -24.6 -6.7 -30.9 151 820 A G < - 0 0 23 -3,-1.7 -1,-0.2 -4,-0.1 2,-0.2 0.199 29.8 -77.3 65.5 175.5 -24.2 -2.9 -31.1 152 821 A L > - 0 0 22 -3,-0.1 3,-0.8 -5,-0.1 4,-0.1 -0.528 44.2 -98.9-101.0 171.5 -26.4 0.1 -30.7 153 822 A K T 3 S+ 0 0 153 1,-0.3 2,-0.4 -2,-0.2 3,-0.1 0.929 125.9 21.7 -56.6 -48.9 -29.1 1.7 -33.2 154 823 A N T 3> S+ 0 0 55 1,-0.1 4,-1.8 -94,-0.1 -1,-0.3 -0.761 77.8 161.7-116.5 79.1 -26.5 4.2 -34.3 155 824 A Q H <> S+ 0 0 42 -3,-0.8 4,-2.7 -2,-0.4 5,-0.1 0.776 70.0 58.7 -71.5 -27.9 -23.2 2.6 -33.3 156 825 A K H > S+ 0 0 176 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.922 105.9 46.8 -67.4 -48.4 -21.0 4.8 -35.5 157 826 A F H > S+ 0 0 103 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.982 113.4 52.1 -54.3 -55.1 -22.1 8.0 -33.9 158 827 A F H X S+ 0 0 0 -4,-1.8 4,-3.0 1,-0.2 -2,-0.2 0.901 108.0 49.1 -47.5 -51.1 -21.5 6.2 -30.6 159 828 A D H X S+ 0 0 80 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.934 113.2 47.5 -63.3 -41.7 -17.9 5.1 -31.5 160 829 A E H X S+ 0 0 108 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.949 111.6 50.7 -57.3 -53.2 -17.0 8.6 -32.7 161 830 A L H >X S+ 0 0 11 -4,-3.2 4,-1.8 1,-0.2 3,-0.7 0.966 112.9 45.7 -49.1 -57.1 -18.5 10.1 -29.5 162 831 A R H 3X S+ 0 0 22 -4,-3.0 4,-2.1 1,-0.3 -1,-0.2 0.899 109.1 55.0 -56.1 -44.4 -16.5 7.7 -27.3 163 832 A M H 3X S+ 0 0 104 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.3 0.853 107.5 52.1 -56.0 -36.7 -13.3 8.3 -29.3 164 833 A N H < S+ 0 0 45 -4,-2.3 3,-1.3 1,-0.2 2,-1.2 0.572 87.9 82.5 -81.6 -23.5 -1.0 16.3 -21.4 175 844 A C T 3< S+ 0 0 114 -4,-2.3 -1,-0.2 1,-0.2 -3,-0.1 -0.002 101.3 41.0 -74.9 36.0 -1.5 20.1 -21.6 176 845 A K T 3 S+ 0 0 128 -2,-1.2 -1,-0.2 -3,-0.2 -2,-0.1 0.407 97.6 84.5-156.9 -7.5 0.7 20.6 -18.5 177 846 A R < - 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0 0 6 -5,-1.2 2,-0.4 -9,-0.2 -1,-0.2 -0.871 39.8-145.6 -90.7 124.6 -37.0 -3.6 0.7 221 890 A D - 0 0 112 -2,-0.5 -185,-0.2 -192,-0.3 -184,-0.1 -0.730 8.9-160.3 -92.1 137.3 -38.9 -1.0 -1.5 222 891 A F - 0 0 34 -2,-0.4 -189,-0.1 -10,-0.1 -185,-0.0 -0.984 19.3-129.4-116.5 123.5 -37.9 -0.3 -5.1 223 892 A P >> - 0 0 25 0, 0.0 4,-2.9 0, 0.0 3,-0.5 -0.289 34.8 -96.3 -63.1 153.5 -39.1 3.0 -6.7 224 893 A E H 3> S+ 0 0 82 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.852 121.5 40.1 -42.8 -61.2 -40.8 2.8 -10.1 225 894 A M H 3> S+ 0 0 77 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.850 116.9 50.7 -62.0 -33.9 -37.8 3.6 -12.4 226 895 A M H <> S+ 0 0 9 -3,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.916 110.7 49.6 -72.2 -40.0 -35.4 1.5 -10.3 227 896 A A H X S+ 0 0 29 -4,-2.9 4,-1.9 2,-0.2 5,-0.2 0.974 113.8 45.3 -54.5 -58.9 -37.7 -1.5 -10.4 228 897 A E H X S+ 0 0 124 -4,-2.4 4,-2.2 1,-0.2 5,-0.4 0.925 114.2 46.0 -58.3 -54.7 -38.1 -1.3 -14.1 229 898 A I H X>S+ 0 0 11 -4,-2.4 5,-2.0 1,-0.2 4,-1.8 0.911 111.8 53.0 -55.1 -42.4 -34.4 -0.7 -15.0 230 899 A I H <5S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.856 115.6 38.4 -70.8 -27.7 -33.4 -3.5 -12.6 231 900 A S H <5S+ 0 0 68 -4,-1.9 -1,-0.2 -3,-0.4 -2,-0.2 0.705 128.3 30.3 -91.9 -21.6 -35.7 -6.1 -14.2 232 901 A V H <5S+ 0 0 64 -4,-2.2 4,-0.4 -5,-0.2 -3,-0.2 0.828 131.5 23.8-101.7 -45.1 -35.4 -5.1 -17.9 233 902 A Q T >X5S+ 0 0 27 -4,-1.8 3,-1.0 -5,-0.4 4,-0.9 0.928 114.8 55.3 -97.2 -47.8 -31.9 -3.7 -18.2 234 903 A V H >> S+ 0 0 35 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.817 99.1 58.6 -58.5 -28.6 -30.6 -8.7 -16.6 236 905 A K H <4>S+ 0 0 61 -3,-1.0 6,-2.1 -4,-0.4 5,-1.6 0.787 110.4 43.8 -66.6 -28.8 -29.2 -7.9 -20.1 237 906 A I H X<5S+ 0 0 6 -3,-1.5 3,-0.6 -4,-0.9 -1,-0.2 0.845 113.1 49.8 -80.7 -39.3 -25.9 -7.1 -18.4 238 907 A L H 3<5S+ 0 0 31 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.929 111.6 48.0 -68.1 -44.0 -26.0 -10.1 -16.0 239 908 A S T 3<5S- 0 0 86 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.438 118.6-110.3 -77.7 -2.5 -26.7 -12.6 -18.9 240 909 A G T < 5S+ 0 0 33 -3,-0.6 -3,-0.2 2,-0.3 -91,-0.1 0.549 86.6 117.4 84.0 12.4 -23.9 -11.1 -21.0 241 910 A K S