==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/VIRAL PROTEIN INHIBITOR 04-JAN-13 4INB . COMPND 2 MOLECULE: GAG PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR R.COULOMBE . 146 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8948.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 62.3 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 . 4 2.7 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 0.7 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 . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 47.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 0 0 2 0 0 1 0 1 0 0 0 1 0 0 0 1 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 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 . 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 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 1 A P 0 0 28 0, 0.0 12,-3.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 171.8 27.9 30.4 31.5 2 2 A I E +A 12 0A 32 44,-1.7 2,-0.3 10,-0.2 10,-0.2 -0.783 360.0 160.7 -96.8 137.4 28.8 34.1 31.2 3 3 A V E -A 11 0A 47 8,-2.8 8,-2.9 -2,-0.4 2,-0.4 -0.971 40.7-105.1-148.3 155.5 30.9 35.4 28.3 4 4 A Q E -A 10 0A 129 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.723 34.9-147.2 -88.4 134.6 31.5 38.8 26.8 5 5 A N - 0 0 49 4,-2.1 -1,-0.1 -2,-0.4 5,-0.0 0.111 41.9 -72.1 -80.9-159.3 29.7 39.4 23.5 6 6 A L S S+ 0 0 183 1,-0.1 -1,-0.1 2,-0.1 -2,-0.0 0.348 128.3 46.2 -82.0 5.5 30.9 41.6 20.6 7 7 A Q S S- 0 0 173 2,-0.2 -1,-0.1 0, 0.0 -3,-0.1 0.770 118.3 -93.8-105.7 -66.2 30.4 44.8 22.4 8 8 A G S S+ 0 0 39 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 0.052 79.6 130.6 172.8 -25.2 31.8 44.4 25.9 9 9 A Q - 0 0 129 -5,-0.1 -4,-2.1 1,-0.1 2,-0.9 -0.046 60.7-123.7 -51.9 140.1 28.7 43.3 27.8 10 10 A M E +A 4 0A 90 -6,-0.2 2,-0.3 -8,-0.1 -6,-0.2 -0.809 43.2 177.8 -89.2 105.4 28.8 40.2 30.0 11 11 A V E -A 3 0A 61 -8,-2.9 -8,-2.8 -2,-0.9 2,-0.3 -0.774 29.9-110.1-113.2 157.0 26.0 38.0 28.6 12 12 A H E -A 2 0A 43 -2,-0.3 2,-0.5 -10,-0.2 -10,-0.2 -0.654 25.5-167.6 -86.6 139.3 24.7 34.6 29.4 13 13 A Q - 0 0 118 -12,-3.3 3,-0.1 -2,-0.3 -2,-0.0 -0.968 19.7-132.1-128.6 111.2 25.3 31.7 27.0 14 14 A A - 0 0 70 -2,-0.5 2,-0.2 1,-0.1 37,-0.0 -0.140 31.7 -94.3 -60.1 158.2 23.3 28.5 27.6 15 15 A I - 0 0 32 1,-0.1 -1,-0.1 2,-0.0 5,-0.0 -0.549 46.2-105.0 -75.3 138.5 25.1 25.2 27.6 16 16 A S >> - 0 0 40 -2,-0.2 4,-2.3 1,-0.1 3,-0.6 -0.399 16.4-135.9 -65.5 134.1 25.0 23.4 24.2 17 17 A P H 3> S+ 0 0 104 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.860 107.5 57.2 -59.1 -32.1 22.5 20.5 24.0 18 18 A R H 3> S+ 0 0 204 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.851 106.5 48.8 -68.0 -31.8 25.2 18.5 22.2 19 19 A T H <> S+ 0 0 50 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.931 111.8 49.1 -70.9 -45.6 27.5 19.0 25.2 20 20 A L H X S+ 0 0 24 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.925 111.3 49.2 -58.8 -46.3 24.8 17.9 27.6 21 21 A N H X S+ 0 0 96 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.921 112.7 47.0 -61.2 -44.6 24.1 14.8 25.6 22 22 A A H X S+ 0 0 55 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.894 110.5 54.3 -65.2 -37.0 27.8 13.9 25.4 23 23 A W H X S+ 0 0 12 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.911 104.6 51.7 -64.0 -44.2 28.1 14.5 29.1 24 24 A V H X S+ 0 0 16 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.873 108.2 53.8 -61.6 -34.8 25.3 12.2 30.2 25 25 A K H X S+ 0 0 82 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.892 108.1 50.0 -66.4 -37.6 27.0 9.5 28.1 26 26 A V H X S+ 0 0 42 -4,-1.7 4,-2.2 2,-0.2 3,-0.4 0.971 111.1 46.8 -63.8 -54.2 30.2 10.0 29.9 27 27 A V H < S+ 0 0 35 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.881 110.1 55.3 -55.6 -39.4 28.6 9.7 33.4 28 28 A E H >< S+ 0 0 130 -4,-2.2 3,-0.6 -5,-0.2 -1,-0.2 0.884 113.2 40.8 -62.3 -38.5 26.7 6.6 32.2 29 29 A E H 3< S+ 0 0 162 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.723 124.4 36.8 -81.9 -25.0 30.0 4.9 31.2 30 30 A K T >< S+ 0 0 73 -4,-2.2 3,-2.2 -5,-0.1 -1,-0.2 -0.234 81.2 179.5-122.3 44.0 32.0 6.1 34.2 31 31 A A T < S- 0 0 53 -3,-0.6 -3,-0.1 1,-0.3 -4,-0.1 -0.224 73.8 -1.7 -51.8 121.7 29.3 5.9 36.9 32 32 A F T 3 S+ 0 0 49 1,-0.2 -1,-0.3 -5,-0.1 113,-0.1 0.699 95.4 149.1 68.6 22.8 30.8 7.0 40.3 33 33 A S X - 0 0 25 -3,-2.2 3,-2.0 -6,-0.2 4,-0.5 -0.782 48.8-140.5 -94.0 125.8 34.2 7.5 38.8 34 34 A P T > S+ 0 0 74 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.765 97.7 67.6 -50.6 -34.4 36.5 10.2 40.4 35 35 A E T 3> S+ 0 0 122 1,-0.3 4,-1.0 2,-0.2 5,-0.1 0.740 89.7 65.8 -63.0 -23.4 37.8 11.3 36.9 36 36 A V H <> S+ 0 0 19 -3,-2.0 4,-2.4 -6,-0.2 -1,-0.3 0.840 91.0 65.1 -67.6 -31.6 34.3 12.6 36.1 37 37 A I H <> S+ 0 0 17 -3,-1.2 4,-2.2 -4,-0.5 -1,-0.2 0.908 100.4 45.9 -61.1 -46.1 34.7 15.2 38.9 38 38 A P H > S+ 0 0 79 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.845 114.3 51.9 -66.7 -27.5 37.5 17.2 37.3 39 39 A M H X S+ 0 0 91 -4,-1.0 4,-2.5 2,-0.2 -2,-0.2 0.869 106.2 52.7 -73.4 -37.4 35.6 17.0 34.1 40 40 A F H X S+ 0 0 6 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.942 110.5 48.0 -62.0 -45.6 32.4 18.3 35.7 41 41 A S H < S+ 0 0 41 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.875 111.2 51.9 -62.2 -37.6 34.4 21.3 37.1 42 42 A A H >< S+ 0 0 49 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.936 110.6 45.3 -66.5 -48.0 35.9 21.9 33.6 43 43 A L H 3< S+ 0 0 63 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.755 109.2 57.4 -69.4 -23.3 32.6 22.0 31.7 44 44 A S T >< S+ 0 0 0 -4,-1.6 3,-2.3 -5,-0.2 -1,-0.3 0.206 73.2 142.6 -93.3 18.0 31.0 24.2 34.3 45 45 A E T < S+ 0 0 125 -3,-1.3 3,-0.1 1,-0.3 -3,-0.1 -0.360 80.0 2.0 -58.9 132.2 33.6 27.0 34.0 46 46 A G T 3 S+ 0 0 33 1,-0.2 -44,-1.7 -45,-0.1 -1,-0.3 0.536 99.0 155.5 67.1 6.6 31.8 30.4 34.3 47 47 A A < - 0 0 3 -3,-2.3 -1,-0.2 -46,-0.2 84,-0.1 -0.317 36.5-139.5 -69.6 146.2 28.5 28.6 34.9 48 48 A T > - 0 0 0 -3,-0.1 4,-2.4 79,-0.1 5,-0.2 -0.532 33.8-100.8 -94.8 166.1 25.6 30.2 36.8 49 49 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.898 125.3 56.7 -56.8 -36.9 23.5 28.2 39.3 50 50 A Q H > S+ 0 0 88 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.939 107.8 47.0 -60.0 -44.7 20.9 27.9 36.6 51 51 A D H > S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.908 110.7 52.8 -62.2 -43.6 23.4 26.2 34.2 52 52 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.918 109.4 47.9 -59.7 -43.8 24.6 23.9 37.0 53 53 A N H X S+ 0 0 36 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.836 107.8 55.8 -67.6 -32.3 21.1 22.7 37.7 54 54 A T H X S+ 0 0 60 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.920 110.5 45.8 -65.2 -40.8 20.4 22.1 34.0 55 55 A M H X S+ 0 0 4 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.951 114.8 47.0 -65.2 -48.5 23.5 19.9 34.0 56 56 A L H X S+ 0 0 26 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.921 114.1 46.6 -59.1 -46.3 22.5 18.1 37.1 57 57 A N H < S+ 0 0 124 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.838 111.4 52.3 -65.9 -33.7 18.9 17.6 36.0 58 58 A T H < S+ 0 0 60 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.917 112.2 44.7 -70.6 -40.0 20.0 16.4 32.6 59 59 A V H < S+ 0 0 33 -4,-2.2 2,-0.3 1,-0.2 -2,-0.2 0.919 80.9 167.5 -70.5 -42.5 22.3 13.8 34.0 60 60 A G < + 0 0 30 -4,-2.5 2,-0.3 -5,-0.2 -1,-0.2 -0.498 11.6 174.7 65.2-127.5 19.8 12.5 36.6 61 61 A G - 0 0 56 -2,-0.3 2,-0.4 -4,-0.1 -33,-0.0 -0.867 39.1 -9.1 126.1-161.4 21.2 9.3 38.0 62 62 A H > - 0 0 113 -2,-0.3 4,-2.7 1,-0.1 3,-0.4 -0.633 59.8-127.1 -78.8 129.7 20.3 6.8 40.8 63 63 A Q H > S+ 0 0 168 -2,-0.4 4,-1.2 1,-0.3 -1,-0.1 0.855 110.6 45.9 -37.6 -50.8 17.4 8.0 43.1 64 64 A A H > S+ 0 0 45 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.873 111.9 48.5 -66.5 -43.3 19.6 7.3 46.1 65 65 A A H > S+ 0 0 5 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.870 109.2 53.8 -65.7 -36.8 22.8 9.0 44.8 66 66 A M H X S+ 0 0 65 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.837 105.5 56.8 -64.6 -31.6 20.8 12.1 43.8 67 67 A Q H X S+ 0 0 102 -4,-1.2 4,-3.4 -5,-0.3 5,-0.2 0.939 105.8 46.6 -65.3 -49.1 19.5 12.1 47.4 68 68 A M H X S+ 0 0 38 -4,-1.7 4,-2.1 78,-0.4 -1,-0.2 0.862 113.6 51.5 -62.3 -34.9 23.0 12.3 48.9 69 69 A L H X S+ 0 0 23 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.965 113.4 42.4 -67.0 -50.7 23.8 15.0 46.4 70 70 A K H X S+ 0 0 110 -4,-2.9 4,-3.1 1,-0.2 5,-0.2 0.924 114.7 50.9 -61.4 -45.2 20.7 17.1 47.3 71 71 A E H X S+ 0 0 72 -4,-3.4 4,-2.6 1,-0.2 -1,-0.2 0.892 110.8 49.6 -60.5 -38.8 21.2 16.5 51.0 72 72 A T H X S+ 0 0 3 -4,-2.1 4,-2.6 -5,-0.2 5,-0.2 0.942 112.3 46.9 -65.0 -47.4 24.8 17.6 50.7 73 73 A I H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.938 113.8 48.7 -59.3 -46.3 23.8 20.8 48.8 74 74 A N H X S+ 0 0 82 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.901 111.1 50.5 -60.4 -42.4 21.0 21.5 51.4 75 75 A E H X S+ 0 0 113 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.909 112.8 45.4 -63.1 -42.3 23.5 21.0 54.2 76 76 A E H X S+ 0 0 52 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.849 111.2 53.2 -71.0 -33.9 26.0 23.3 52.7 77 77 A A H X S+ 0 0 10 -4,-2.5 4,-1.8 -5,-0.2 24,-0.4 0.901 109.3 48.3 -67.4 -39.5 23.3 25.9 51.9 78 78 A A H X S+ 0 0 58 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.844 110.0 53.4 -69.2 -30.4 22.1 25.9 55.5 79 79 A E H X S+ 0 0 68 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.834 106.0 52.8 -71.9 -32.3 25.8 26.2 56.6 80 80 A W H X S+ 0 0 42 -4,-1.7 4,-3.1 2,-0.2 -2,-0.2 0.900 110.1 47.8 -68.7 -40.6 26.1 29.3 54.4 81 81 A D H < S+ 0 0 33 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.872 107.6 55.8 -67.4 -36.9 23.0 30.9 56.0 82 82 A R H < S+ 0 0 181 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.871 120.2 31.4 -63.2 -35.7 24.4 30.1 59.5 83 83 A L H < S+ 0 0 91 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.742 128.7 36.9 -94.4 -26.8 27.6 32.0 58.6 84 84 A H S < S- 0 0 83 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 -0.493 77.1-172.1-125.9 63.7 26.2 34.6 56.2 85 85 A P - 0 0 96 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.245 11.6-146.5 -58.0 141.2 22.8 35.7 57.6 86 86 A V - 0 0 42 -5,-0.0 2,-0.4 12,-0.0 -2,-0.0 -0.914 14.0-118.8-114.1 138.0 20.8 37.9 55.2 87 87 A H - 0 0 179 -2,-0.4 11,-0.2 1,-0.0 2,-0.1 -0.588 24.4-155.3 -78.3 129.5 18.4 40.7 56.4 88 88 A A + 0 0 105 -2,-0.4 -1,-0.0 3,-0.0 0, 0.0 -0.377 50.4 60.5 -90.9 176.4 14.8 40.3 55.4 89 89 A G S S+ 0 0 50 -2,-0.1 2,-0.0 2,-0.0 -2,-0.0 -0.670 83.7 17.8 109.4-164.7 12.5 43.3 55.1 90 90 A P + 0 0 145 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.224 55.5 160.7 -54.6 124.2 12.4 46.6 53.2 91 91 A I - 0 0 84 -2,-0.0 3,-0.1 6,-0.0 6,-0.1 -0.981 38.4-114.2-146.7 132.9 14.4 46.9 50.0 92 92 A A > - 0 0 54 -2,-0.3 3,-2.4 1,-0.1 2,-0.0 -0.279 47.8 -81.5 -67.0 153.5 13.9 49.5 47.2 93 93 A P T 3 S+ 0 0 137 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.313 118.9 13.4 -56.6 130.7 12.9 48.2 43.7 94 94 A G T 3 S+ 0 0 89 1,-0.3 2,-0.2 -3,-0.1 -2,-0.1 0.441 91.5 143.7 82.9 -1.6 15.9 47.0 41.8 95 95 A Q < - 0 0 107 -3,-2.4 2,-0.5 1,-0.1 -1,-0.3 -0.505 55.0-116.5 -73.0 139.2 18.1 47.0 44.9 96 96 A M - 0 0 73 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.651 30.0-156.8 -79.6 125.6 20.6 44.1 45.1 97 97 A R - 0 0 73 -2,-0.5 -6,-0.0 -6,-0.1 -11,-0.0 -0.697 24.1-104.3-100.0 153.6 19.9 41.8 47.9 98 98 A E - 0 0 111 -2,-0.3 2,-0.2 -11,-0.2 5,-0.1 -0.562 43.1-110.4 -75.1 138.3 22.6 39.5 49.5 99 99 A P - 0 0 5 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.471 27.4-155.8 -74.6 138.7 22.2 35.8 48.4 100 100 A R >> - 0 0 105 -2,-0.2 4,-1.9 1,-0.0 3,-0.9 -0.493 40.9 -89.6 -99.1 175.5 21.1 33.2 50.8 101 101 A G H 3> S+ 0 0 0 -24,-0.4 4,-1.7 1,-0.3 6,-0.2 0.904 128.4 53.1 -53.4 -45.2 21.9 29.5 50.4 102 102 A S H 34>S+ 0 0 33 1,-0.2 5,-1.6 2,-0.2 6,-1.6 0.757 107.7 52.3 -63.3 -26.2 18.7 28.8 48.4 103 103 A D H X45S+ 0 0 3 -3,-0.9 3,-1.3 5,-0.2 -1,-0.2 0.888 107.2 51.2 -75.2 -41.0 19.7 31.7 46.0 104 104 A I H 3<5S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.3 26,-0.2 0.836 108.7 52.4 -64.4 -32.2 23.2 30.2 45.5 105 105 A A T 3<5S- 0 0 7 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.449 115.5-119.4 -83.0 -1.6 21.5 26.9 44.7 106 106 A G T < 5S+ 0 0 18 -3,-1.3 -3,-0.2 -5,-0.2 -2,-0.1 0.484 83.5 115.5 77.0 4.4 19.3 28.6 42.1 107 107 A T S - 0 0 73 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.519 30.7-108.2 -94.0 167.3 16.6 34.1 38.8 111 111 A L H > S+ 0 0 27 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.897 121.9 54.7 -58.0 -39.5 19.2 33.9 36.1 112 112 A Q H > S+ 0 0 131 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.872 107.4 47.1 -64.2 -39.3 19.3 37.7 36.2 113 113 A E H > S+ 0 0 65 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.857 111.5 52.2 -71.6 -33.1 20.0 37.9 39.9 114 114 A Q H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 12,-0.2 0.933 110.5 46.9 -67.3 -44.9 22.7 35.2 39.6 115 115 A I H X S+ 0 0 21 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.896 109.9 56.2 -62.9 -38.6 24.4 37.1 36.8 116 116 A G H < S+ 0 0 30 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.919 109.4 43.3 -60.1 -46.4 24.1 40.3 38.9 117 117 A W H >< S+ 0 0 4 -4,-2.1 7,-2.9 1,-0.2 3,-0.8 0.895 115.6 50.4 -66.3 -37.7 25.9 38.8 41.9 118 118 A M H 3< S+ 0 0 37 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.714 115.1 40.6 -73.3 -24.3 28.6 37.3 39.6 119 119 A T T 3< S+ 0 0 70 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.173 95.2 108.8-109.8 13.7 29.3 40.5 37.7 120 120 A H S < S- 0 0 75 -3,-0.8 -3,-0.1 -4,-0.2 -4,-0.0 -0.361 75.6 -98.4 -84.8 167.3 29.2 42.7 40.7 121 121 A N S S+ 0 0 140 1,-0.5 -2,-0.0 -2,-0.1 -3,-0.0 -0.951 121.3 24.7-137.2 110.7 32.2 44.4 42.4 122 122 A P S S- 0 0 96 0, 0.0 -1,-0.5 0, 0.0 -2,-0.1 0.486 112.6-137.5 -71.2 140.3 33.2 42.8 44.7 123 123 A P - 0 0 71 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.290 10.8-145.0 -70.8 150.7 31.6 39.8 43.0 124 124 A I - 0 0 36 -7,-2.9 2,-2.8 -10,-0.1 3,-0.2 -0.916 19.5-150.5-112.1 93.6 29.6 37.2 44.9 125 125 A P > + 0 0 56 0, 0.0 4,-2.5 0, 0.0 3,-0.2 -0.340 30.8 163.1 -68.3 66.8 30.7 34.1 42.8 126 126 A V H > S+ 0 0 0 -2,-2.8 4,-2.1 -12,-0.2 5,-0.2 0.786 73.4 55.5 -58.5 -29.9 27.4 32.2 43.4 127 127 A G H > S+ 0 0 0 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.938 110.8 43.7 -68.5 -44.3 28.3 29.9 40.5 128 128 A E H > S+ 0 0 79 -3,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.891 113.9 50.4 -66.5 -41.5 31.6 29.0 42.0 129 129 A I H X S+ 0 0 8 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.937 112.8 45.5 -62.4 -48.1 30.2 28.5 45.5 130 130 A Y H X S+ 0 0 10 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.900 109.1 56.3 -63.7 -40.1 27.4 26.3 44.3 131 131 A K H X S+ 0 0 6 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.891 105.4 52.1 -59.9 -38.9 29.8 24.3 42.1 132 132 A R H X S+ 0 0 140 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.897 108.2 50.8 -64.1 -40.9 31.9 23.6 45.2 133 133 A W H X S+ 0 0 16 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.926 112.1 47.6 -62.0 -44.4 28.9 22.3 47.1 134 134 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.945 111.2 49.7 -61.7 -48.3 28.0 20.0 44.1 135 135 A I H X S+ 0 0 33 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.820 108.0 54.6 -62.0 -31.2 31.6 18.7 43.9 136 136 A L H X S+ 0 0 65 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.947 111.1 45.5 -65.5 -48.2 31.6 18.0 47.6 137 137 A G H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.881 111.1 52.1 -62.4 -38.8 28.4 15.9 47.1 138 138 A L H X S+ 0 0 32 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.898 108.2 51.4 -64.8 -38.8 29.9 14.2 44.1 139 139 A N H X S+ 0 0 79 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.753 109.6 51.8 -68.0 -24.3 33.0 13.3 46.2 140 140 A K H < S+ 0 0 43 -4,-1.2 6,-0.2 2,-0.2 -2,-0.2 0.873 108.6 50.0 -76.8 -42.2 30.6 11.9 48.8 141 141 A I H >X>S+ 0 0 15 -4,-2.2 4,-3.3 1,-0.2 3,-2.3 0.933 105.7 54.9 -61.8 -49.3 28.8 9.8 46.2 142 142 A V H 3<5S+ 0 0 28 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.782 105.8 56.1 -54.9 -29.6 32.0 8.2 44.8 143 143 A R T 3<5S+ 0 0 138 -4,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.278 121.1 23.8 -90.3 11.3 32.9 7.2 48.3 144 144 A M T <45S- 0 0 102 -3,-2.3 -2,-0.2 -112,-0.0 -3,-0.1 0.461 90.2-133.0-139.1 -28.2 29.7 5.2 48.9 145 145 A Y T <5 0 0 158 -4,-3.3 -3,-0.2 -5,-0.2 -80,-0.1 0.579 360.0 360.0 72.0 17.8 28.6 4.3 45.4 146 146 A S < 0 0 61 -5,-0.6 -78,-0.4 -6,-0.2 -1,-0.2 0.173 360.0 360.0-168.4 360.0 25.2 5.5 46.6