==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 15-OCT-93 145L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR E.BALDWIN,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8644.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 114 70.4 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 . 12 7.4 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 . 2 1.2 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 . 6 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 51.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 2 1 0 2 1 0 0 1 1 1 0 0 0 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 . 1 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 . 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 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 M 0 0 90 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 142.4 43.3 -2.1 8.3 2 2 A N > - 0 0 67 95,-0.0 4,-3.1 92,-0.0 5,-0.2 -0.880 360.0 -85.8-147.8 175.9 40.2 -1.0 10.3 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.836 124.3 51.0 -60.3 -37.7 38.1 2.1 10.8 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.965 113.8 43.4 -65.1 -50.6 40.3 3.4 13.6 5 5 A E H > S+ 0 0 96 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.892 113.6 53.7 -60.2 -43.0 43.4 3.0 11.6 6 6 A M H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.953 112.3 40.4 -58.6 -52.6 41.7 4.5 8.6 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-3.5 2,-0.2 5,-0.4 0.847 109.7 59.5 -68.8 -31.1 40.5 7.7 10.2 8 8 A R H X S+ 0 0 112 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.952 108.4 46.2 -63.0 -39.0 43.7 8.2 12.2 9 9 A I H < S+ 0 0 86 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.946 115.9 45.7 -65.3 -47.8 45.5 8.3 8.9 10 10 A D H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.823 124.3 29.9 -67.4 -34.7 42.9 10.6 7.4 11 11 A E H < S- 0 0 39 -4,-3.5 19,-0.4 -5,-0.1 -1,-0.2 0.707 91.7-152.5-100.8 -19.1 42.6 13.0 10.3 12 12 A G < - 0 0 21 -4,-2.5 2,-0.4 -5,-0.4 18,-0.1 -0.088 26.1 -85.0 71.2 179.7 46.1 12.9 11.9 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.972 42.4 173.9-132.4 118.8 46.7 13.7 15.6 14 14 A R E -A 28 0A 99 14,-1.7 14,-1.8 -2,-0.4 4,-0.1 -0.986 18.2-163.0-122.1 130.6 47.1 17.1 17.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.2 12,-0.2 2,-0.4 0.495 74.7 59.6 -91.2 -0.1 47.4 17.8 20.8 16 16 A K E S-C 57 0B 105 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.952 97.5 -87.8-132.0 145.7 46.6 21.5 20.6 17 17 A I E + 0 0 21 39,-1.6 2,-0.3 -2,-0.4 10,-0.2 -0.195 55.4 166.1 -51.4 136.0 43.7 23.4 19.2 18 18 A Y E -A 26 0A 33 8,-2.9 8,-3.1 6,-0.1 2,-0.4 -0.920 34.9-108.5-148.4 169.0 44.0 24.1 15.6 19 19 A K E -A 25 0A 108 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.869 27.3-142.9-106.4 138.7 42.0 25.3 12.6 20 20 A D > - 0 0 51 4,-1.7 3,-1.9 -2,-0.4 -1,-0.0 -0.164 42.6 -81.6 -83.9-178.5 41.0 23.0 9.8 21 21 A T T 3 S+ 0 0 91 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.715 132.8 52.1 -60.2 -23.7 40.9 24.0 6.1 22 22 A E T 3 S- 0 0 75 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.476 122.5-106.4 -88.8 -7.3 37.5 25.6 6.6 23 23 A G S < S+ 0 0 28 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.568 70.8 143.9 92.2 13.9 38.8 27.7 9.5 24 24 A Y - 0 0 68 1,-0.1 -4,-1.7 9,-0.0 -1,-0.3 -0.661 55.7-111.4 -91.5 140.9 37.1 25.7 12.3 25 25 A Y E +AB 19 34A 31 9,-1.2 8,-2.2 -2,-0.3 9,-1.4 -0.476 49.9 161.9 -69.2 130.2 38.6 25.0 15.7 26 26 A T E -AB 18 32A 5 -8,-3.1 -8,-2.9 6,-0.3 2,-0.3 -0.919 16.6-174.3-142.9 163.3 39.5 21.3 16.1 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.2 -2,-0.3 -12,-0.2 -0.958 50.3 8.3-154.7 167.9 41.7 19.1 18.2 28 28 A G E 4 S-A 14 0A 0 -14,-1.8 -14,-1.7 -2,-0.3 2,-0.8 -0.312 120.9 -10.3 63.7-129.3 42.8 15.5 18.6 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.735 129.0 -46.3-108.5 80.6 41.8 13.2 15.8 30 30 A G T 4 S+ 0 0 17 -2,-0.8 2,-0.9 -19,-0.4 -2,-0.2 0.733 87.0 160.5 67.7 25.2 39.4 15.2 13.8 31 31 A H E < -B 27 0A 34 -4,-2.2 -4,-1.6 -20,-0.1 2,-0.4 -0.639 31.6-145.2 -86.0 107.7 37.4 16.4 16.8 32 32 A L E +B 26 0A 79 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.457 20.2 178.0 -69.6 121.8 35.4 19.5 15.9 33 33 A L E - 0 0 16 -8,-2.2 2,-0.3 -2,-0.4 -7,-0.2 0.933 58.8 -23.8 -87.5 -55.7 35.2 21.8 18.8 34 34 A T E -B 25 0A 26 -9,-1.4 -9,-1.2 2,-0.1 -1,-0.3 -0.991 32.7-139.9-160.1 152.4 33.3 24.7 17.4 35 35 A K S S+ 0 0 146 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.392 75.2 108.6 -91.8 3.4 32.4 26.6 14.3 36 36 A S S S- 0 0 45 2,-0.2 -11,-0.3 1,-0.1 6,-0.1 -0.688 72.8-133.7 -88.4 136.1 32.8 29.9 16.1 37 37 A P S S+ 0 0 114 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.457 77.3 107.6 -65.4 0.8 35.8 32.2 15.3 38 38 A S > - 0 0 51 1,-0.2 4,-2.1 2,-0.1 -2,-0.2 -0.723 53.3-167.0 -88.8 117.0 36.3 32.6 19.1 39 39 A L H > S+ 0 0 66 -2,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.770 92.7 56.8 -68.7 -25.9 39.3 30.8 20.4 40 40 A N H > S+ 0 0 109 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.881 105.4 48.8 -75.3 -32.1 38.0 31.3 23.8 41 41 A A H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.876 110.6 52.6 -69.7 -37.6 34.8 29.6 22.9 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.938 106.8 51.5 -64.4 -41.3 36.8 26.9 21.5 43 43 A K H X S+ 0 0 54 -4,-2.3 4,-2.2 1,-0.2 11,-0.3 0.888 108.9 51.9 -62.4 -34.4 38.8 26.6 24.7 44 44 A S H X S+ 0 0 65 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.859 107.2 51.7 -68.9 -38.2 35.5 26.4 26.7 45 45 A E H X S+ 0 0 67 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.927 109.4 51.2 -63.6 -43.2 34.2 23.6 24.5 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.935 109.5 49.0 -60.2 -49.4 37.4 21.6 25.0 47 47 A D H X>S+ 0 0 36 -4,-2.2 4,-3.0 1,-0.2 5,-1.1 0.896 112.7 48.2 -59.8 -38.1 37.3 21.9 28.8 48 48 A K H <5S+ 0 0 135 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.896 113.6 46.9 -70.4 -39.1 33.7 20.8 28.8 49 49 A A H <5S+ 0 0 46 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.892 121.7 36.1 -69.4 -36.2 34.5 17.9 26.6 50 50 A I H <5S- 0 0 37 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.801 101.3-128.9 -86.9 -33.6 37.5 16.8 28.6 51 51 A G T <5S+ 0 0 65 -4,-3.0 2,-0.3 -5,-0.3 -3,-0.2 0.772 74.6 73.5 90.2 27.4 36.2 17.7 32.0 52 52 A R S - 0 0 5 -2,-1.1 3,-1.6 -11,-0.3 -1,-0.2 0.664 33.1-144.6 -93.8 -22.6 43.0 22.2 29.6 55 55 A N T 3 S- 0 0 124 1,-0.3 3,-0.1 -12,-0.1 -2,-0.1 0.714 74.5 -57.8 65.1 16.7 44.3 25.5 28.4 56 56 A G T 3 S+ 0 0 8 -13,-0.2 -39,-1.6 1,-0.2 2,-0.4 0.552 118.7 96.9 89.3 9.3 43.9 24.3 24.8 57 57 A V B < -C 16 0B 77 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.996 47.0-177.9-134.1 133.5 46.2 21.3 25.1 58 58 A I - 0 0 4 -43,-2.2 2,-0.1 -2,-0.4 -30,-0.1 -0.780 27.5-108.3-122.3 168.9 45.2 17.6 25.8 59 59 A T > - 0 0 64 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.454 33.6-107.9 -88.7 169.5 47.1 14.4 26.3 60 60 A K H > S+ 0 0 119 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.923 121.2 55.6 -61.6 -42.2 47.1 11.5 23.7 61 61 A D H > S+ 0 0 122 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.878 108.1 48.8 -58.3 -35.9 44.9 9.5 26.0 62 62 A E H > S+ 0 0 37 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.911 109.6 51.0 -71.9 -41.2 42.4 12.3 25.9 63 63 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -34,-0.4 0.915 111.3 49.7 -60.1 -41.3 42.6 12.6 22.2 64 64 A E H X S+ 0 0 86 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.856 107.8 53.3 -66.4 -35.4 42.0 8.8 22.0 65 65 A K H X S+ 0 0 128 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.919 109.0 47.4 -68.4 -44.3 39.0 9.1 24.3 66 66 A L H X S+ 0 0 3 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.916 111.7 54.3 -63.2 -33.6 37.4 11.7 22.2 67 67 A F H X S+ 0 0 15 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.914 106.2 48.7 -62.9 -46.1 38.1 9.5 19.1 68 68 A N H X S+ 0 0 93 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.908 113.6 49.4 -60.9 -40.7 36.4 6.4 20.5 69 69 A Q H X S+ 0 0 92 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.888 112.1 47.4 -64.8 -43.9 33.4 8.5 21.4 70 70 A D H X S+ 0 0 34 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.852 111.6 47.9 -70.2 -38.6 33.3 10.0 17.9 71 71 A V H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.934 112.2 51.7 -68.4 -40.5 33.6 6.8 16.1 72 72 A D H X S+ 0 0 79 -4,-2.2 4,-2.5 -5,-0.3 5,-0.3 0.933 108.4 50.0 -58.4 -45.5 30.9 5.3 18.2 73 73 A A H X S+ 0 0 47 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.859 109.3 53.2 -64.0 -33.8 28.6 8.2 17.6 74 74 A A H X S+ 0 0 7 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.949 110.2 44.7 -68.7 -45.1 29.1 7.9 13.9 75 75 A V H X S+ 0 0 39 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.931 115.9 47.1 -61.5 -47.3 28.3 4.2 13.9 76 76 A R H X S+ 0 0 94 -4,-2.5 4,-1.6 -5,-0.2 5,-0.2 0.914 109.6 56.0 -61.8 -40.1 25.2 4.7 16.1 77 77 A G H X S+ 0 0 8 -4,-2.4 4,-1.4 -5,-0.3 3,-0.2 0.903 108.9 46.1 -56.7 -45.3 24.2 7.6 13.9 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-0.7 1,-0.2 7,-0.4 0.983 112.8 50.4 -60.1 -52.8 24.2 5.4 10.8 79 79 A L H 3< S+ 0 0 72 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.667 112.6 44.4 -61.9 -25.0 22.3 2.7 12.5 80 80 A R H 3< S+ 0 0 178 -4,-1.6 2,-0.4 -3,-0.2 -1,-0.3 0.629 93.0 99.0 -95.0 -18.3 19.6 5.0 13.8 81 81 A N S+ 0 0 106 2,-0.1 4,-0.6 3,-0.1 -1,-0.2 0.835 120.8 41.3 -92.0 -35.1 18.1 6.6 5.1 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.8 -6,-0.2 5,-0.2 0.829 100.6 68.2 -81.7 -36.2 21.6 5.4 6.1 85 85 A K H X S+ 0 0 77 -4,-3.0 4,-2.9 -7,-0.4 5,-0.2 0.926 100.5 46.7 -53.1 -50.0 20.8 2.2 7.9 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.878 111.7 52.9 -63.3 -34.2 19.6 0.3 4.8 87 87 A V H >< S+ 0 0 3 -4,-0.6 3,-0.9 2,-0.2 4,-0.4 0.971 111.2 46.3 -62.5 -53.1 22.6 1.5 2.9 88 88 A Y H >< S+ 0 0 35 -4,-2.8 3,-2.0 1,-0.3 -1,-0.2 0.942 108.4 56.0 -53.2 -51.1 24.9 0.2 5.6 89 89 A D H 3< S+ 0 0 81 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.758 104.1 55.5 -54.3 -28.5 23.2 -3.1 5.8 90 90 A S T << S+ 0 0 57 -4,-1.1 -1,-0.3 -3,-0.9 2,-0.2 0.516 95.0 84.5 -85.8 -4.7 23.7 -3.7 2.1 91 91 A L S < S- 0 0 12 -3,-2.0 2,-0.0 -4,-0.4 -3,-0.0 -0.625 74.4-115.2-104.1 166.5 27.4 -3.4 2.0 92 92 A D > - 0 0 65 -2,-0.2 4,-1.6 1,-0.1 5,-0.2 -0.234 47.4 -93.3 -79.1 177.6 30.5 -5.5 2.6 93 93 A A H > S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.791 121.5 50.8 -68.9 -33.1 32.9 -4.6 5.5 94 94 A V H > S+ 0 0 21 62,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.941 111.6 46.8 -70.7 -44.7 35.3 -2.4 3.7 95 95 A R H > S+ 0 0 34 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.856 108.8 56.9 -64.5 -29.2 32.6 -0.3 2.1 96 96 A R H X S+ 0 0 79 -4,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.918 104.6 52.6 -66.1 -39.6 30.9 0.0 5.5 97 97 A A H X S+ 0 0 8 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.944 106.7 51.9 -63.9 -41.4 34.1 1.4 6.9 98 98 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.915 108.8 51.0 -61.3 -40.6 34.2 4.0 4.1 99 99 A L H X S+ 0 0 1 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.905 108.3 52.3 -64.3 -39.5 30.6 5.1 4.9 100 100 A I H X S+ 0 0 8 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.915 106.7 53.3 -61.3 -40.8 31.6 5.5 8.6 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.968 108.8 49.2 -61.4 -44.7 34.5 7.7 7.6 102 102 A M H X S+ 0 0 5 -4,-2.1 4,-3.3 1,-0.2 5,-0.5 0.930 113.5 45.8 -59.7 -45.6 32.2 10.0 5.6 103 103 A V H X S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.910 110.7 53.9 -65.1 -39.8 29.7 10.2 8.5 104 104 A F H < S+ 0 0 29 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.920 118.9 35.2 -56.6 -48.7 32.5 10.9 10.9 105 105 A Q H < S+ 0 0 65 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.965 133.7 22.9 -70.6 -55.8 33.8 13.7 8.8 106 106 A M H < S- 0 0 47 -4,-3.3 4,-0.5 -5,-0.2 -3,-0.2 0.522 105.1-121.5 -91.7 -14.2 30.5 15.2 7.4 107 107 A G X - 0 0 29 -4,-2.4 4,-2.4 -5,-0.5 5,-0.2 0.099 29.0 -77.1 84.9 155.0 28.0 14.1 10.0 108 108 A E H > S+ 0 0 71 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.907 128.3 46.4 -53.6 -56.0 24.9 12.0 9.7 109 109 A T H > S+ 0 0 120 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.903 110.2 56.3 -58.7 -42.4 22.6 14.7 8.3 110 110 A G H >4 S+ 0 0 30 -4,-0.5 3,-0.8 1,-0.2 4,-0.4 0.969 114.0 36.6 -56.6 -53.8 25.2 15.6 5.8 111 111 A V H >< S+ 0 0 2 -4,-2.4 3,-2.0 1,-0.3 -1,-0.2 0.915 110.1 60.8 -66.8 -43.9 25.6 12.3 4.3 112 112 A A H 3< S+ 0 0 14 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.710 99.6 61.6 -58.9 -15.9 21.9 11.4 4.6 113 113 A G T << S+ 0 0 47 -4,-1.0 2,-3.0 -3,-0.8 -1,-0.3 0.668 71.6 93.9 -87.9 -14.2 21.3 14.3 2.3 114 114 A F <> + 0 0 65 -3,-2.0 4,-2.6 -4,-0.4 5,-0.2 -0.351 54.4 171.2 -77.2 68.4 23.2 13.1 -0.7 115 115 A T H > S+ 0 0 69 -2,-3.0 4,-2.0 1,-0.3 -1,-0.2 0.848 71.8 40.8 -43.9 -56.1 20.0 11.7 -2.1 116 116 A N H > S+ 0 0 105 1,-0.2 4,-2.3 -3,-0.2 -1,-0.3 0.881 112.3 56.5 -64.0 -41.0 21.3 10.8 -5.5 117 117 A S H > S+ 0 0 8 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.924 107.0 49.4 -55.4 -44.8 24.5 9.6 -4.1 118 118 A L H X S+ 0 0 8 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.906 107.4 53.8 -62.1 -46.0 22.6 7.1 -1.9 119 119 A R H X S+ 0 0 130 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.907 107.1 51.3 -55.9 -45.9 20.6 5.8 -4.7 120 120 A M H <>S+ 0 0 15 -4,-2.3 5,-2.7 1,-0.2 -1,-0.2 0.947 109.7 49.6 -58.3 -46.9 23.6 5.0 -6.7 121 121 A I H ><5S+ 0 0 3 -4,-2.0 3,-1.4 1,-0.2 -1,-0.2 0.918 110.8 51.1 -57.2 -41.0 25.1 3.2 -3.9 122 122 A Q H 3<5S+ 0 0 90 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.883 110.7 46.9 -65.9 -37.0 21.9 1.3 -3.5 123 123 A Q T 3<5S- 0 0 103 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.306 114.7-120.9 -84.2 4.2 21.8 0.3 -7.1 124 124 A K T < 5 + 0 0 123 -3,-1.4 2,-1.7 -4,-0.2 -3,-0.2 0.807 56.9 155.9 59.1 35.7 25.4 -0.7 -6.8 125 125 A R >< + 0 0 81 -5,-2.7 4,-1.9 1,-0.2 5,-0.2 -0.533 11.9 170.9 -92.4 74.2 26.6 1.8 -9.4 126 126 A W H > + 0 0 46 -2,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.913 67.8 43.9 -51.7 -56.4 30.2 2.1 -8.2 127 127 A D H > S+ 0 0 106 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.934 114.3 48.6 -61.7 -43.9 31.9 4.0 -10.9 128 128 A E H > S+ 0 0 96 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.831 110.4 53.2 -63.7 -36.1 29.2 6.6 -11.4 129 129 A W H X S+ 0 0 1 -4,-1.9 4,-3.7 1,-0.2 5,-0.3 0.967 109.8 48.1 -63.9 -48.3 29.0 7.2 -7.7 130 130 A A H X S+ 0 0 9 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.936 111.7 48.0 -56.4 -50.5 32.6 7.8 -7.6 131 131 A V H < S+ 0 0 90 -4,-2.8 3,-0.2 1,-0.2 -1,-0.2 0.944 114.1 50.0 -56.5 -43.2 32.5 10.2 -10.6 132 132 A N H >< S+ 0 0 59 -4,-2.5 3,-2.2 1,-0.2 4,-0.3 0.931 104.3 53.7 -62.3 -52.2 29.7 11.9 -9.0 133 133 A M H >< S+ 0 0 5 -4,-3.7 3,-2.0 1,-0.3 6,-0.5 0.820 94.2 73.0 -58.6 -26.9 31.2 12.4 -5.5 134 134 A A T 3< S+ 0 0 25 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.592 89.3 62.0 -63.4 -6.2 34.1 14.0 -7.0 135 135 A K T < S+ 0 0 137 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.589 83.3 108.3 -95.1 -8.6 32.0 17.0 -7.7 136 136 A S S <> S- 0 0 23 -3,-2.0 4,-2.0 -4,-0.3 5,-0.2 -0.164 79.6-121.6 -68.3 161.2 31.2 17.7 -4.1 137 137 A R H > S+ 0 0 169 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.930 114.1 62.2 -61.7 -42.8 32.4 20.5 -2.0 138 138 A W H > S+ 0 0 20 1,-0.3 4,-1.8 2,-0.2 8,-0.2 0.906 106.8 41.9 -49.3 -50.2 33.8 17.8 0.2 139 139 A Y H 4 S+ 0 0 64 -6,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.877 115.6 49.4 -68.0 -37.6 36.1 16.5 -2.5 140 140 A N H < S+ 0 0 102 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.810 110.3 52.0 -73.3 -25.9 37.1 20.0 -3.7 141 141 A Q H < S+ 0 0 70 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.893 131.1 9.2 -79.5 -39.3 37.9 21.1 -0.3 142 142 A T S X S+ 0 0 35 -4,-1.8 4,-2.4 -5,-0.2 -1,-0.2 -0.545 72.5 173.4-141.7 71.7 40.2 18.2 0.7 143 143 A P H > S+ 0 0 60 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.755 71.2 53.4 -48.9 -43.5 40.9 16.2 -2.4 144 144 A N H > S+ 0 0 126 2,-0.2 4,-1.7 3,-0.2 5,-0.1 0.950 113.9 40.4 -65.3 -51.3 43.5 13.7 -1.1 145 145 A R H > S+ 0 0 19 -3,-0.2 4,-2.3 2,-0.2 5,-0.3 0.952 117.6 49.9 -62.5 -48.0 41.5 12.4 1.8 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-3.3 1,-0.2 5,-0.3 0.944 107.7 52.9 -56.2 -46.3 38.4 12.4 -0.3 147 147 A K H X S+ 0 0 119 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.878 108.5 52.1 -57.6 -37.4 40.1 10.5 -3.1 148 148 A R H X S+ 0 0 63 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.959 113.5 42.2 -64.5 -48.4 41.1 7.9 -0.5 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.917 113.7 52.0 -64.6 -43.0 37.6 7.4 0.8 150 150 A I H X S+ 0 0 10 -4,-3.3 4,-2.2 -5,-0.3 -1,-0.2 0.901 110.9 47.6 -62.1 -38.5 36.0 7.4 -2.6 151 151 A T H X S+ 0 0 21 -4,-1.8 4,-2.3 -5,-0.3 6,-0.4 0.880 111.1 51.5 -70.8 -36.5 38.4 4.8 -3.9 152 152 A T H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 5,-0.3 0.955 112.7 45.1 -64.8 -46.2 37.8 2.7 -0.8 153 153 A F H < S+ 0 0 1 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.875 114.6 49.8 -63.1 -38.3 34.0 2.9 -1.3 154 154 A R H < S+ 0 0 70 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.908 121.2 28.2 -71.5 -44.2 34.3 2.3 -4.9 155 155 A T H < S- 0 0 49 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.653 89.7-132.1 -95.2 -20.6 36.4 -0.8 -5.0 156 156 A G S < S+ 0 0 16 -4,-2.2 2,-0.3 -5,-0.3 -62,-0.2 0.712 72.6 110.0 74.6 13.8 35.7 -2.3 -1.7 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.820 72.5-132.0-117.3 164.7 39.5 -2.7 -1.1 158 158 A W > + 0 0 59 -2,-0.3 3,-1.7 1,-0.2 4,-0.3 0.151 69.9 120.8 -96.1 17.1 41.9 -0.9 1.4 159 159 A D G > + 0 0 101 1,-0.3 3,-1.8 2,-0.2 -1,-0.2 0.852 65.4 57.5 -50.7 -42.7 44.4 -0.3 -1.5 160 160 A A G 3 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.756 106.7 50.3 -64.2 -20.7 44.3 3.5 -1.1 161 161 A Y G < 0 0 22 -3,-1.7 -1,-0.3 -13,-0.1 -2,-0.2 0.363 360.0 360.0 -98.6 4.9 45.4 3.2 2.4 162 162 A K < 0 0 209 -3,-1.8 -2,-0.2 -4,-0.3 -3,-0.1 0.783 360.0 360.0-109.4 360.0 48.3 1.0 1.6