==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 30-JUN-11 3SO8 . COMPND 2 MOLECULE: ANKYRIN REPEAT FAMILY A PROTEIN 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.XU,A BOCHKAREV,C.B.BIAN,J.MIN,STRUCTURAL GENOMICS CONSORTI . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8522.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 68.5 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 . 0 0.0 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 . 4 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 41.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 4.9 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 0 0 4 1 3 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 8 A N 0 0 144 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 66.4 46.7 12.2 34.7 2 9 A S + 0 0 109 2,-0.0 2,-0.1 0, 0.0 0, 0.0 0.248 360.0 119.3 -97.8 1.7 44.7 15.4 35.2 3 10 A L - 0 0 68 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.451 61.9-112.3 -78.4 146.2 42.8 16.1 31.9 4 11 A S > - 0 0 56 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.244 25.4-114.5 -68.8 157.8 39.0 16.2 31.6 5 12 A V H > S+ 0 0 12 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.877 120.1 59.4 -55.3 -36.1 37.0 13.5 29.7 6 13 A H H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.900 107.8 42.4 -57.8 -46.5 36.2 16.4 27.3 7 14 A Q H > S+ 0 0 14 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.882 111.7 54.7 -72.8 -35.0 39.9 17.1 26.5 8 15 A L H X>S+ 0 0 0 -4,-2.3 5,-2.2 1,-0.2 4,-0.7 0.916 110.9 46.6 -62.4 -41.1 40.6 13.3 26.3 9 16 A A H ><5S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.911 111.5 50.4 -66.7 -42.0 37.8 13.1 23.6 10 17 A A H 3<5S+ 0 0 7 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.862 113.2 47.1 -62.7 -33.3 39.1 16.1 21.7 11 18 A Q H 3<5S- 0 0 107 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.561 107.6-123.1 -88.9 -6.6 42.6 14.6 21.7 12 19 A G T <<5 + 0 0 21 -3,-0.8 2,-1.9 -4,-0.7 -3,-0.2 0.809 50.0 162.5 63.8 34.0 41.6 11.1 20.5 13 20 A E >< + 0 0 81 -5,-2.2 4,-2.5 1,-0.2 5,-0.3 -0.590 13.0 177.8 -82.2 79.7 43.2 9.6 23.6 14 21 A M H > + 0 0 66 -2,-1.9 4,-2.9 1,-0.2 5,-0.2 0.888 68.7 45.4 -61.6 -46.9 41.2 6.4 23.2 15 22 A L H > S+ 0 0 126 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.944 116.7 44.8 -64.5 -48.9 42.5 4.2 25.9 16 23 A Y H > S+ 0 0 107 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.886 115.5 49.1 -61.8 -41.3 42.3 7.0 28.7 17 24 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.948 111.2 48.8 -58.6 -51.1 38.9 8.0 27.4 18 25 A A H X S+ 0 0 30 -4,-2.9 4,-1.7 -5,-0.3 -2,-0.2 0.924 111.2 50.2 -59.0 -43.9 37.7 4.4 27.5 19 26 A T H X S+ 0 0 71 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.948 111.1 48.7 -55.9 -51.5 39.0 3.9 31.0 20 27 A R H X S+ 0 0 76 -4,-2.4 4,-1.7 1,-0.2 6,-0.3 0.901 111.4 49.0 -56.0 -43.7 37.3 7.1 32.3 21 28 A I H < S+ 0 0 20 -4,-2.3 6,-0.3 1,-0.2 -1,-0.2 0.806 112.1 49.0 -70.7 -32.0 33.9 6.2 30.7 22 29 A E H < S+ 0 0 166 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.881 110.0 51.0 -72.3 -43.2 34.0 2.7 32.2 23 30 A Q H < S+ 0 0 109 -4,-2.0 2,-0.3 -5,-0.2 -2,-0.2 0.846 122.4 11.5 -64.2 -44.1 34.9 3.8 35.8 24 31 A E S < S- 0 0 48 -4,-1.7 2,-1.8 0, 0.0 3,-0.3 -0.920 81.8-102.4-140.6 162.3 32.1 6.4 36.2 25 32 A N S S+ 0 0 155 -2,-0.3 3,-0.2 1,-0.2 -4,-0.1 -0.424 76.4 122.5 -88.3 64.5 29.0 7.5 34.4 26 33 A V > + 0 0 30 -2,-1.8 3,-1.2 -6,-0.3 -1,-0.2 0.299 29.8 105.3-110.7 3.4 30.6 10.6 32.8 27 34 A I T 3 S+ 0 0 16 -3,-0.3 11,-0.4 -6,-0.3 -1,-0.1 0.842 95.2 31.4 -55.5 -35.0 30.0 9.9 29.1 28 35 A N T 3 S+ 0 0 51 -3,-0.2 -1,-0.3 8,-0.1 -2,-0.1 0.286 88.6 130.8-105.5 7.7 27.2 12.6 29.1 29 36 A H < - 0 0 113 -3,-1.2 2,-0.3 1,-0.1 -3,-0.1 -0.346 51.1-133.5 -68.4 137.1 28.6 15.0 31.7 30 37 A T - 0 0 80 6,-0.1 6,-0.2 -2,-0.1 5,-0.1 -0.671 9.6-130.4 -96.8 146.1 28.7 18.6 30.7 31 38 A D > - 0 0 27 4,-2.4 3,-2.4 -2,-0.3 -1,-0.1 -0.182 47.2 -78.9 -78.3 177.9 31.6 21.0 31.1 32 39 A E T 3 S+ 0 0 88 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.846 134.4 47.9 -53.2 -30.6 31.3 24.5 32.7 33 40 A E T 3 S- 0 0 108 2,-0.1 32,-1.2 1,-0.0 -1,-0.3 0.347 123.4-101.4 -92.1 7.4 29.8 25.8 29.3 34 41 A G S < S+ 0 0 7 -3,-2.4 2,-0.2 1,-0.3 -2,-0.1 0.406 75.3 139.5 95.0 0.3 27.3 23.0 28.9 35 42 A F - 0 0 39 29,-0.1 -4,-2.4 -5,-0.1 -1,-0.3 -0.498 39.8-145.1 -85.2 143.9 29.3 20.9 26.3 36 43 A T > - 0 0 2 -6,-0.2 4,-2.2 -2,-0.2 5,-0.2 -0.506 31.5-103.5 -99.3 167.8 29.5 17.1 26.4 37 44 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.873 123.2 57.4 -59.6 -37.0 32.5 14.9 25.4 38 45 A L H > S+ 0 0 1 -11,-0.4 4,-3.1 2,-0.2 5,-0.2 0.916 105.4 49.5 -58.3 -43.9 30.7 14.1 22.1 39 46 A M H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.906 110.6 51.1 -60.7 -43.4 30.5 17.9 21.3 40 47 A W H X S+ 0 0 75 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.910 113.3 44.5 -59.6 -43.7 34.2 18.2 22.0 41 48 A A H <>S+ 0 0 0 -4,-2.3 5,-2.8 2,-0.2 -2,-0.2 0.924 114.3 49.0 -70.6 -43.0 35.0 15.3 19.7 42 49 A A H ><5S+ 0 0 0 -4,-3.1 3,-1.6 1,-0.2 -2,-0.2 0.928 110.7 49.3 -60.5 -44.8 32.7 16.5 17.0 43 50 A A H 3<5S+ 0 0 31 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.790 113.3 48.4 -69.3 -27.0 34.1 20.1 17.0 44 51 A H T 3<5S- 0 0 98 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.288 112.0-119.9 -88.4 5.4 37.6 18.6 16.9 45 52 A G T < 5 + 0 0 21 -3,-1.6 2,-1.6 -4,-0.2 -3,-0.2 0.808 53.4 160.6 62.5 30.4 36.8 16.3 13.9 46 53 A Q >< + 0 0 58 -5,-2.8 4,-2.6 1,-0.2 -1,-0.2 -0.609 11.3 176.5 -88.4 86.5 37.7 13.1 15.9 47 54 A I H > S+ 0 0 75 -2,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.897 75.6 47.9 -63.0 -45.3 35.9 10.6 13.9 48 55 A A H > S+ 0 0 57 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.886 112.0 51.5 -61.7 -38.5 37.0 7.5 15.8 49 56 A V H > S+ 0 0 0 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.938 108.7 50.9 -63.9 -45.1 36.1 9.2 19.2 50 57 A V H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.948 110.3 48.9 -57.1 -52.3 32.6 10.0 17.9 51 58 A E H X S+ 0 0 103 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.921 114.2 46.2 -51.2 -49.1 32.0 6.5 16.8 52 59 A F H X S+ 0 0 38 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.955 112.2 49.3 -62.5 -50.1 33.2 5.1 20.2 53 60 A L H <>S+ 0 0 0 -4,-3.4 5,-2.5 1,-0.2 3,-0.5 0.921 111.9 49.6 -58.0 -43.8 31.2 7.6 22.3 54 61 A L H ><5S+ 0 0 35 -4,-2.9 3,-1.5 -5,-0.3 -1,-0.2 0.936 108.5 52.2 -61.0 -44.0 28.1 6.8 20.3 55 62 A Q H 3<5S+ 0 0 135 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.708 111.5 49.7 -61.6 -23.9 28.6 3.0 20.7 56 63 A N T 3<5S- 0 0 78 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.139 128.9 -84.6-106.5 17.9 28.8 3.6 24.4 57 64 A G T < 5 + 0 0 46 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.665 63.4 161.3 94.4 20.3 25.8 5.7 25.1 58 65 A A < - 0 0 7 -5,-2.5 -1,-0.3 -6,-0.2 -30,-0.1 -0.572 43.4-125.2 -65.8 129.2 26.7 9.2 24.4 59 66 A D > - 0 0 63 -2,-0.3 3,-0.8 1,-0.1 -21,-0.1 -0.736 20.7-165.6 -79.0 112.4 23.4 11.1 23.9 60 67 A P T 3 S+ 0 0 24 0, 0.0 10,-0.5 0, 0.0 11,-0.4 0.603 85.1 55.3 -79.0 -4.8 23.8 12.8 20.4 61 68 A Q T 3 S+ 0 0 92 8,-0.1 2,-0.1 9,-0.1 -2,-0.0 0.425 73.6 117.9-108.5 -0.7 20.7 15.1 21.1 62 69 A L < - 0 0 53 -3,-0.8 8,-0.4 1,-0.0 2,-0.3 -0.426 57.0-145.5 -66.4 135.5 22.0 16.6 24.3 63 70 A L - 0 0 41 6,-0.1 6,-0.2 1,-0.1 5,-0.1 -0.871 4.5-119.1-112.4 156.3 22.3 20.3 23.7 64 71 A G > - 0 0 8 4,-2.7 3,-2.1 -2,-0.3 -30,-0.2 0.013 47.4 -81.8 -76.4-174.9 24.8 22.9 25.0 65 72 A K T 3 S+ 0 0 140 -32,-1.2 -31,-0.1 1,-0.3 -1,-0.1 0.771 135.1 40.0 -64.4 -29.1 23.9 25.9 27.1 66 73 A G T 3 S- 0 0 15 33,-0.0 32,-2.5 31,-0.0 33,-0.5 0.027 127.8 -96.8-102.4 24.5 22.8 27.9 24.0 67 74 A R < + 0 0 67 -3,-2.1 -2,-0.1 1,-0.2 2,-0.1 0.629 70.0 160.9 67.6 19.6 21.2 24.8 22.5 68 75 A E - 0 0 52 -5,-0.1 -4,-2.7 29,-0.1 2,-0.3 -0.394 23.7-152.7 -63.2 141.1 24.3 23.9 20.3 69 76 A S > - 0 0 6 -6,-0.2 4,-2.2 26,-0.1 5,-0.2 -0.813 28.2-118.1-116.1 160.1 24.3 20.4 19.1 70 77 A A H > S+ 0 0 2 -10,-0.5 4,-2.4 -8,-0.4 5,-0.2 0.879 119.2 54.8 -57.8 -38.4 27.1 17.9 18.2 71 78 A L H > S+ 0 0 2 -11,-0.4 4,-3.1 2,-0.2 5,-0.2 0.946 106.8 46.7 -60.1 -52.5 25.5 18.0 14.7 72 79 A S H > S+ 0 0 7 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.901 112.3 51.6 -59.1 -37.5 25.6 21.8 14.3 73 80 A L H X S+ 0 0 39 -4,-2.2 4,-0.9 2,-0.2 -2,-0.2 0.944 113.5 43.9 -64.9 -43.7 29.3 21.8 15.5 74 81 A A H ><>S+ 0 0 0 -4,-2.4 5,-2.5 -5,-0.2 3,-0.6 0.916 113.8 51.0 -67.4 -41.4 30.2 19.1 12.9 75 82 A C H ><5S+ 0 0 0 -4,-3.1 3,-1.1 1,-0.2 -1,-0.2 0.890 104.0 58.3 -59.8 -39.4 28.2 20.8 10.2 76 83 A S H 3<5S+ 0 0 45 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.772 114.0 37.0 -68.3 -22.8 29.9 24.1 10.8 77 84 A K T <<5S- 0 0 116 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.350 110.8-117.4-103.7 -4.9 33.4 22.5 10.1 78 85 A G T < 5 + 0 0 21 -3,-1.1 2,-1.7 -4,-0.5 -3,-0.2 0.796 53.7 160.8 69.4 30.6 32.2 20.3 7.3 79 86 A Y >< + 0 0 78 -5,-2.5 4,-2.6 1,-0.2 3,-0.4 -0.568 10.0 173.3 -80.2 80.9 33.1 17.1 9.2 80 87 A T H > + 0 0 32 -2,-1.7 4,-2.4 1,-0.3 -1,-0.2 0.772 68.4 56.9 -77.1 -26.3 30.9 14.9 7.0 81 88 A D H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.913 113.9 43.1 -62.2 -40.4 31.8 11.5 8.3 82 89 A I H > S+ 0 0 0 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.914 110.5 54.0 -70.0 -43.9 30.8 12.7 11.7 83 90 A V H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.946 109.7 50.8 -55.5 -44.7 27.7 14.4 10.4 84 91 A K H X S+ 0 0 110 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.944 108.8 49.4 -55.7 -48.9 26.7 11.0 8.8 85 92 A M H X S+ 0 0 39 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.922 114.1 46.4 -61.8 -42.3 27.2 9.0 12.0 86 93 A L H ><>S+ 0 0 0 -4,-2.6 5,-1.2 2,-0.2 3,-1.0 0.915 110.9 50.1 -63.7 -47.5 25.1 11.5 13.9 87 94 A L H ><5S+ 0 0 18 -4,-3.2 3,-2.1 1,-0.2 -2,-0.2 0.911 104.3 60.9 -54.8 -41.2 22.3 11.6 11.2 88 95 A D H 3<5S+ 0 0 116 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.728 97.2 60.1 -60.4 -22.0 22.3 7.8 11.4 89 96 A C T <<5S- 0 0 65 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.492 117.2-114.3 -80.4 -5.6 21.4 8.2 15.2 90 97 A G T < 5 + 0 0 55 -3,-2.1 -3,-0.2 -4,-0.3 -2,-0.1 0.744 52.5 171.8 78.2 26.7 18.2 10.0 14.2 91 98 A V < - 0 0 14 -5,-1.2 2,-0.8 1,-0.1 -1,-0.1 -0.179 48.6 -89.3 -60.3 158.5 19.1 13.4 15.6 92 99 A D > - 0 0 75 1,-0.2 3,-1.1 2,-0.1 -1,-0.1 -0.634 37.4-165.0 -70.1 110.1 16.8 16.4 14.9 93 100 A V T 3 S+ 0 0 14 -2,-0.8 11,-0.4 1,-0.2 -1,-0.2 0.618 86.2 54.6 -72.8 -14.7 18.4 17.7 11.6 94 101 A N T 3 S+ 0 0 43 8,-0.1 -1,-0.2 9,-0.1 2,-0.1 0.027 71.5 155.9-103.2 20.7 16.3 21.0 12.1 95 102 A E < - 0 0 33 -3,-1.1 2,-0.5 1,-0.1 -26,-0.1 -0.292 31.1-152.7 -49.4 112.0 17.6 21.8 15.7 96 103 A Y - 0 0 53 6,-0.1 6,-0.2 -2,-0.1 5,-0.1 -0.843 16.3-159.4 -89.7 126.5 17.1 25.7 16.0 97 104 A D > - 0 0 17 4,-3.0 3,-0.7 -2,-0.5 -30,-0.2 -0.344 28.1-106.3-100.5-176.3 19.6 27.2 18.5 98 105 A W T 3 S+ 0 0 188 -32,-2.5 -31,-0.1 1,-0.3 -1,-0.0 0.514 118.0 59.3 -92.6 -10.8 19.9 30.5 20.7 99 106 A N T 3 S- 0 0 91 -33,-0.5 -1,-0.3 2,-0.1 -32,-0.1 0.112 126.2-106.4 -88.7 20.2 22.6 32.1 18.6 100 107 A G S < S+ 0 0 43 -3,-0.7 -2,-0.1 1,-0.2 31,-0.0 0.184 75.2 133.3 81.0 -11.9 19.8 31.7 15.8 101 108 A G - 0 0 7 -5,-0.1 -4,-3.0 29,-0.1 -1,-0.2 -0.171 39.3-164.0 -79.5 158.2 21.4 28.7 13.8 102 109 A T > - 0 0 11 -6,-0.2 4,-2.1 26,-0.1 5,-0.2 -0.900 42.2-106.1-121.7 159.1 20.3 25.3 12.3 103 110 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.913 123.0 52.8 -53.6 -40.3 22.7 22.6 11.2 104 111 A L H > S+ 0 0 1 -11,-0.4 4,-2.6 1,-0.2 5,-0.2 0.921 105.1 52.8 -62.6 -44.4 22.0 23.6 7.6 105 112 A L H > S+ 0 0 21 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.886 111.0 47.6 -57.1 -42.1 22.7 27.3 8.1 106 113 A Y H X S+ 0 0 62 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.889 110.0 51.0 -63.0 -40.6 26.2 26.4 9.6 107 114 A A H <>S+ 0 0 0 -4,-2.0 5,-2.7 -5,-0.2 3,-0.3 0.910 114.1 47.2 -63.8 -41.6 27.0 24.0 6.7 108 115 A V H ><5S+ 0 0 0 -4,-2.6 3,-2.2 -5,-0.2 -2,-0.2 0.954 106.5 55.7 -63.9 -47.3 26.0 26.9 4.4 109 116 A H H 3<5S+ 0 0 114 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.755 112.7 43.3 -59.0 -23.4 28.0 29.6 6.3 110 117 A G T 3<5S- 0 0 30 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.365 110.8-120.9-100.8 5.5 31.1 27.4 5.8 111 118 A N T < 5 + 0 0 72 -3,-2.2 2,-1.3 -4,-0.2 -3,-0.2 0.910 53.2 161.5 53.3 45.5 30.4 26.6 2.1 112 119 A H >< + 0 0 49 -5,-2.7 4,-2.6 1,-0.2 -1,-0.2 -0.651 10.1 174.6 -95.7 81.4 30.3 22.8 3.0 113 120 A V H > S+ 0 0 30 -2,-1.3 4,-3.1 1,-0.2 5,-0.2 0.870 75.2 50.9 -60.9 -45.0 28.4 21.6 -0.1 114 121 A K H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.891 112.6 49.1 -58.9 -43.3 28.7 17.9 0.6 115 122 A C H > S+ 0 0 0 2,-0.2 4,-2.7 -3,-0.2 -2,-0.2 0.915 109.3 50.9 -58.0 -49.6 27.4 18.6 4.1 116 123 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.946 111.5 48.6 -55.1 -48.7 24.5 20.7 2.7 117 124 A K H X S+ 0 0 88 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.941 111.6 49.8 -56.5 -47.4 23.5 17.8 0.3 118 125 A M H X S+ 0 0 29 -4,-2.4 4,-0.9 -5,-0.2 -1,-0.2 0.915 111.4 48.5 -60.0 -43.1 23.7 15.3 3.1 119 126 A L H ><>S+ 0 0 0 -4,-2.7 5,-2.3 2,-0.2 3,-1.1 0.950 111.5 47.8 -62.9 -51.3 21.5 17.4 5.4 120 127 A L H ><5S+ 0 0 14 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.908 108.6 56.7 -53.0 -41.5 18.8 18.1 2.7 121 128 A E H 3<5S+ 0 0 158 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.742 108.4 48.0 -64.9 -23.4 18.8 14.3 2.0 122 129 A S T <<5S- 0 0 61 -3,-1.1 -1,-0.3 -4,-0.9 -29,-0.2 0.152 132.3 -85.3-101.4 12.1 18.0 13.7 5.7 123 130 A G T < 5 + 0 0 48 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.552 68.0 159.6 103.0 6.8 15.1 16.2 5.9 124 131 A A < - 0 0 1 -5,-2.3 -1,-0.3 -6,-0.1 -30,-0.1 -0.440 36.3-135.8 -64.8 140.5 16.8 19.5 6.6 125 132 A D > - 0 0 62 1,-0.1 3,-1.1 -2,-0.1 11,-0.2 -0.864 14.4-166.6-103.2 108.8 14.5 22.4 5.7 126 133 A P T 3 S+ 0 0 0 0, 0.0 10,-1.1 0, 0.0 11,-0.9 0.577 83.3 59.1 -71.1 -9.5 16.4 25.2 3.8 127 134 A T T 3 + 0 0 56 8,-0.2 2,-0.1 9,-0.1 -2,-0.0 0.362 68.8 123.4-109.1 11.7 13.5 27.7 4.2 128 135 A I < - 0 0 56 -3,-1.1 8,-0.4 1,-0.1 2,-0.3 -0.478 57.1-137.8 -61.4 135.8 13.4 27.8 7.9 129 136 A E - 0 0 123 6,-0.1 6,-0.2 -2,-0.1 2,-0.1 -0.745 3.5-129.8-105.8 150.0 13.9 31.4 8.9 130 137 A T > - 0 0 36 4,-2.5 3,-1.9 -2,-0.3 -1,-0.1 -0.281 46.3 -89.5 -74.4 176.7 15.9 33.2 11.6 131 138 A D T 3 S+ 0 0 175 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.859 130.8 54.5 -61.2 -30.1 14.3 35.8 13.8 132 139 A S T 3 S- 0 0 97 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.464 122.3-107.4 -87.4 4.0 15.3 38.5 11.2 133 140 A G S < S+ 0 0 32 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.572 74.2 127.1 92.0 11.0 13.5 36.5 8.5 134 141 A Y - 0 0 107 4,-0.0 -4,-2.5 3,-0.0 -1,-0.3 -0.718 37.3-159.2-100.1 154.1 16.3 35.0 6.4 135 142 A N > - 0 0 23 -2,-0.3 4,-2.0 -6,-0.2 -8,-0.2 -0.584 39.6 -85.7-118.6 178.4 16.8 31.4 5.4 136 143 A S H > S+ 0 0 5 -10,-1.1 4,-2.1 -8,-0.4 -9,-0.1 0.798 127.0 51.6 -53.5 -41.4 19.7 29.1 4.2 137 144 A M H > S+ 0 0 34 -11,-0.9 4,-2.6 2,-0.2 5,-0.2 0.944 108.5 51.8 -63.5 -47.0 19.1 30.1 0.5 138 145 A D H > S+ 0 0 72 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.902 110.4 48.8 -54.7 -43.3 19.2 33.8 1.5 139 146 A L H X S+ 0 0 29 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.941 110.9 48.8 -63.4 -46.0 22.5 33.2 3.3 140 147 A A H X>S+ 0 0 0 -4,-2.1 5,-2.4 2,-0.2 4,-1.1 0.860 112.0 50.1 -60.8 -36.9 24.1 31.3 0.3 141 148 A V H <5S+ 0 0 79 -4,-2.6 3,-0.4 3,-0.2 -1,-0.2 0.938 111.1 48.4 -71.3 -44.7 23.0 34.1 -2.0 142 149 A A H <5S+ 0 0 82 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.862 115.1 42.8 -65.9 -37.5 24.4 36.8 0.1 143 150 A L H <5S- 0 0 72 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.644 109.4-125.6 -77.6 -18.6 27.8 35.0 0.6 144 151 A G T <5 + 0 0 13 -4,-1.1 2,-1.6 -3,-0.4 -3,-0.2 0.790 50.2 160.8 76.3 30.0 27.7 34.1 -3.2 145 152 A Y >< + 0 0 60 -5,-2.4 4,-2.2 1,-0.2 -1,-0.2 -0.645 13.1 179.3 -80.9 85.5 28.2 30.4 -2.6 146 153 A R H > S+ 0 0 180 -2,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.838 72.7 50.9 -68.0 -37.9 26.9 29.4 -6.0 147 154 A S H > S+ 0 0 83 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.897 112.3 49.1 -62.5 -42.9 27.3 25.5 -5.8 148 155 A V H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.925 110.0 51.5 -55.7 -47.9 25.4 25.6 -2.5 149 156 A Q H X S+ 0 0 34 -4,-2.2 4,-3.3 1,-0.2 -2,-0.2 0.927 108.9 51.4 -58.2 -44.4 22.7 27.8 -4.1 150 157 A Q H X S+ 0 0 65 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.894 110.2 48.7 -60.3 -42.2 22.4 25.3 -6.9 151 158 A V H X S+ 0 0 22 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.945 114.7 44.7 -64.0 -46.8 21.9 22.4 -4.4 152 159 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.919 111.7 52.9 -64.8 -41.5 19.3 24.2 -2.5 153 160 A E H X S+ 0 0 107 -4,-3.3 4,-2.1 -5,-0.2 -2,-0.2 0.905 105.9 53.6 -68.1 -32.3 17.5 25.3 -5.6 154 161 A S H X S+ 0 0 68 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.856 109.3 49.9 -59.4 -41.8 17.3 21.8 -6.9 155 162 A H H X S+ 0 0 48 -4,-1.5 4,-1.1 2,-0.2 -2,-0.2 0.899 110.2 48.4 -62.9 -44.7 15.7 20.8 -3.6 156 163 A L H X S+ 0 0 52 -4,-2.3 4,-0.7 1,-0.2 -2,-0.2 0.854 106.2 58.2 -68.0 -34.0 13.1 23.5 -3.8 157 164 A L H >< S+ 0 0 125 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.903 103.6 53.0 -55.1 -45.0 12.3 22.6 -7.4 158 165 A K H >< S+ 0 0 117 -4,-1.5 3,-1.2 1,-0.2 -1,-0.2 0.815 100.8 61.7 -62.0 -31.1 11.4 19.1 -6.1 159 166 A L H 3< S+ 0 0 100 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.698 81.8 82.6 -68.7 -21.7 9.0 20.8 -3.6 160 167 A L T << S+ 0 0 133 -3,-1.0 2,-0.4 -4,-0.7 -1,-0.2 0.579 70.8 89.5 -60.7 -14.3 7.0 22.2 -6.6 161 168 A Q < 0 0 89 -3,-1.2 -1,-0.2 1,-0.4 -4,-0.0 -0.902 360.0 360.0-112.1 102.2 5.2 18.8 -6.7 162 169 A N 0 0 183 -2,-0.4 -1,-0.4 0, 0.0 -2,-0.1 -0.170 360.0 360.0 57.6 360.0 3.0 19.7 -4.7