==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-OCT-00 1G0G . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.XU,W.A.BAASE,M.L.QUILLIN,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8566.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 72.2 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 . 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 53.7 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 1 0 1 1 2 0 0 1 1 0 0 0 0 0 0 1 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 77 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 154.0 43.5 -1.9 9.0 2 2 A N > - 0 0 70 156,-0.0 4,-3.0 1,-0.0 5,-0.2 -0.936 360.0 -85.0-152.1 172.2 40.3 -0.8 10.8 3 3 A I H > S+ 0 0 28 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.828 123.4 49.8 -50.2 -41.1 38.1 2.3 11.3 4 4 A F H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.943 113.7 43.6 -67.0 -48.8 40.3 3.6 14.2 5 5 A E H > S+ 0 0 100 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.891 113.3 54.0 -64.3 -38.2 43.5 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.953 112.5 40.9 -61.4 -51.9 41.9 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.4 0.844 108.8 61.0 -67.3 -29.4 40.6 7.9 10.9 8 8 A R H X S+ 0 0 101 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.884 107.7 46.2 -65.8 -30.9 43.9 8.2 12.9 9 9 A I H < S+ 0 0 84 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.932 115.5 44.9 -73.8 -44.2 45.6 8.6 9.6 10 10 A D H < S+ 0 0 20 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.823 125.5 29.0 -70.3 -33.3 43.1 11.0 8.1 11 11 A E H < S- 0 0 46 -4,-2.7 19,-0.4 -5,-0.1 -1,-0.2 0.656 91.8-153.4-100.5 -24.4 42.8 13.3 11.1 12 12 A G < - 0 0 23 -4,-1.5 2,-0.4 -5,-0.4 -1,-0.1 -0.146 26.1 -84.6 73.4-172.5 46.2 13.0 12.8 13 13 A L + 0 0 38 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.990 43.1 173.3-135.8 125.6 46.7 13.5 16.6 14 14 A R E -A 28 0A 150 14,-1.4 14,-2.4 -2,-0.4 4,-0.1 -0.998 18.5-163.2-135.4 127.2 47.2 16.9 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.0 12,-0.2 2,-0.3 0.439 73.9 61.0 -89.1 -2.8 47.3 17.5 21.9 16 16 A K E S-C 57 0B 93 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.918 100.9 -85.6-123.5 151.3 46.8 21.2 21.9 17 17 A I E + 0 0 13 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.242 58.5 169.8 -52.9 138.5 43.8 23.1 20.6 18 18 A Y E -A 26 0A 26 8,-3.1 8,-3.2 -4,-0.1 2,-0.5 -0.886 35.3-103.7-145.7 173.9 44.2 23.7 16.9 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.893 33.4-139.2-105.0 134.1 42.2 25.0 13.9 20 20 A D > - 0 0 49 4,-2.6 3,-2.1 -2,-0.5 -1,-0.1 -0.071 41.5 -80.1 -78.4-172.3 40.9 22.4 11.4 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.720 135.2 48.2 -61.6 -24.0 40.9 22.8 7.6 22 22 A E T 3 S- 0 0 73 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.348 123.5-105.6 -94.2 -0.5 37.7 25.0 7.9 23 23 A G S < S+ 0 0 38 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.580 72.6 141.8 85.9 16.7 39.3 27.1 10.7 24 24 A Y - 0 0 73 1,-0.1 -4,-2.6 9,-0.0 -1,-0.3 -0.747 59.8-101.6 -94.6 145.6 37.3 25.6 13.6 25 25 A Y E +AB 19 34A 36 9,-0.7 8,-2.8 11,-0.4 9,-1.4 -0.379 55.6 158.0 -61.9 127.0 38.8 24.9 17.0 26 26 A T E -AB 18 32A 2 -8,-3.2 -8,-3.1 6,-0.3 2,-0.3 -0.878 19.6-167.5-143.5 169.2 39.5 21.2 17.4 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.0 -2,-0.3 -12,-0.2 -0.981 50.7 4.9-155.8 164.6 41.7 18.9 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.4 -2,-0.3 2,-1.0 -0.393 122.7 -6.1 66.3-130.5 43.0 15.4 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.648 127.2 -53.0-103.4 74.7 42.0 13.2 16.8 30 30 A G T 4 S+ 0 0 15 -2,-1.0 2,-1.0 -19,-0.4 -2,-0.2 0.714 83.3 160.3 70.3 22.4 39.7 15.4 14.8 31 31 A H E < -B 27 0A 32 -4,-2.0 -4,-1.5 1,-0.0 -1,-0.2 -0.649 33.6-141.8 -81.1 102.8 37.4 16.2 17.8 32 32 A L E -B 26 0A 70 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.339 20.6-178.2 -62.1 128.5 35.5 19.4 16.8 33 33 A L E - 0 0 14 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.918 57.5 -27.2 -94.2 -49.5 35.2 21.7 19.8 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.975 33.9-139.2-163.6 153.9 33.2 24.6 18.5 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.571 72.7 113.0 -92.8 -12.1 32.5 26.5 15.4 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.270 72.7-130.7 -63.5 145.4 32.7 29.7 17.3 37 37 A P S S+ 0 0 117 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.695 77.6 100.8 -68.8 -20.7 35.5 32.1 16.6 38 38 A S > - 0 0 46 1,-0.1 4,-1.7 -13,-0.0 5,-0.1 -0.600 58.4-157.2 -82.2 127.3 36.4 32.5 20.2 39 39 A L H > S+ 0 0 61 -2,-0.4 4,-2.8 1,-0.3 5,-0.2 0.792 97.1 55.4 -65.5 -32.4 39.3 30.6 21.8 40 40 A N H > S+ 0 0 116 2,-0.2 4,-3.0 1,-0.2 -1,-0.3 0.927 103.8 51.1 -69.9 -41.6 37.7 30.9 25.2 41 41 A A H > S+ 0 0 36 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.903 112.1 50.1 -60.0 -37.0 34.6 29.3 24.0 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.910 109.6 49.5 -65.8 -43.4 36.8 26.5 22.7 43 43 A K H X S+ 0 0 55 -4,-2.8 4,-2.3 1,-0.2 11,-0.2 0.923 110.0 52.3 -65.0 -37.9 38.6 26.2 26.0 44 44 A S H X S+ 0 0 72 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.921 109.9 47.0 -64.6 -41.4 35.3 26.1 27.8 45 45 A E H X S+ 0 0 64 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.904 110.8 53.5 -68.3 -37.3 34.0 23.3 25.6 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.4 0.949 109.4 46.9 -60.7 -48.7 37.2 21.3 26.0 47 47 A D H X>S+ 0 0 35 -4,-2.3 4,-2.6 1,-0.2 5,-1.1 0.922 111.9 51.0 -60.6 -41.0 37.1 21.5 29.8 48 48 A K H <5S+ 0 0 144 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.878 112.1 47.9 -63.3 -37.3 33.5 20.4 29.8 49 49 A A H <5S+ 0 0 45 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.880 120.5 35.3 -72.9 -35.3 34.3 17.5 27.5 50 50 A I H <5S- 0 0 34 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.680 102.4-126.0 -90.3 -29.7 37.3 16.3 29.5 51 51 A G T <5S+ 0 0 66 -4,-2.6 2,-0.3 -5,-0.4 -3,-0.2 0.834 75.3 71.3 87.9 29.3 36.0 17.1 33.0 52 52 A R S - 0 0 8 -2,-0.9 3,-1.0 -11,-0.2 -1,-0.2 0.761 32.4-142.0 -92.3 -29.2 42.8 21.8 30.9 55 55 A N T 3 S- 0 0 119 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.857 72.6 -60.6 67.8 30.8 44.2 25.0 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.2 2,-0.4 0.539 117.1 101.0 73.1 8.9 43.9 23.9 26.1 57 57 A V B < +C 16 0B 70 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.978 44.8 177.0-130.1 136.5 46.1 20.9 26.5 58 58 A I - 0 0 6 -43,-2.0 2,-0.2 -2,-0.4 -30,-0.1 -0.818 27.1-110.0-128.4 169.7 45.2 17.2 27.0 59 59 A T > - 0 0 65 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.518 32.3-106.6 -95.0 171.8 47.0 14.0 27.3 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.902 121.0 53.1 -62.8 -43.3 47.1 11.1 24.8 61 61 A D H > S+ 0 0 124 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.885 109.6 49.2 -58.3 -41.6 44.8 9.0 26.9 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.922 109.6 51.6 -65.3 -44.2 42.3 11.9 27.0 63 63 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -34,-0.4 0.904 111.0 49.0 -58.1 -42.2 42.5 12.3 23.2 64 64 A E H X S+ 0 0 79 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.835 106.7 54.3 -68.8 -33.5 41.9 8.6 22.7 65 65 A K H X S+ 0 0 135 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.941 109.1 47.8 -66.4 -43.6 38.9 8.6 25.0 66 66 A L H X S+ 0 0 3 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.909 111.4 53.9 -61.2 -38.5 37.3 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-2.0 4,-2.4 -5,-0.2 5,-0.3 0.928 106.4 49.4 -63.8 -45.6 38.1 9.4 19.9 68 68 A N H X S+ 0 0 88 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.932 113.0 47.8 -59.1 -42.7 36.4 6.3 21.1 69 69 A Q H X S+ 0 0 95 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.919 111.3 50.5 -64.9 -40.3 33.3 8.3 22.0 70 70 A D H X S+ 0 0 34 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.871 110.7 47.4 -66.9 -37.1 33.3 10.1 18.6 71 71 A V H X S+ 0 0 6 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.955 112.6 50.4 -69.2 -44.1 33.6 6.8 16.6 72 72 A D H X S+ 0 0 86 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.933 111.0 48.9 -57.7 -46.3 30.8 5.3 18.7 73 73 A A H X S+ 0 0 46 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.901 108.2 53.9 -63.0 -39.0 28.6 8.3 18.1 74 74 A A H X S+ 0 0 10 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.948 111.0 45.8 -60.0 -48.5 29.2 8.3 14.4 75 75 A V H X S+ 0 0 33 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.948 113.7 48.7 -58.5 -47.7 28.2 4.6 14.1 76 76 A R H X S+ 0 0 105 -4,-2.6 4,-1.7 -5,-0.3 -1,-0.2 0.877 108.2 54.7 -64.1 -33.0 25.1 5.2 16.3 77 77 A G H X S+ 0 0 3 -4,-2.4 4,-0.8 -5,-0.2 -1,-0.2 0.921 108.6 48.9 -65.5 -42.0 24.2 8.3 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-1.0 1,-0.2 7,-0.4 0.952 110.7 49.6 -61.9 -47.7 24.3 6.1 11.0 79 79 A L H 3< S+ 0 0 66 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.798 111.8 48.7 -66.0 -26.0 22.1 3.4 12.5 80 80 A R H 3< S+ 0 0 175 -4,-1.7 2,-0.6 -5,-0.2 -1,-0.3 0.547 92.7 94.2 -87.9 -10.0 19.6 5.9 13.7 81 81 A N S+ 0 0 120 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.816 119.9 41.0 -88.0 -33.9 18.7 7.4 5.0 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.5 -6,-0.2 3,-0.3 0.861 101.7 66.7 -83.3 -40.0 21.9 6.1 6.2 85 85 A K H X S+ 0 0 82 -4,-3.1 4,-3.1 -7,-0.4 5,-0.2 0.906 99.1 49.6 -50.6 -50.6 21.0 2.9 7.8 86 86 A P H > S+ 0 0 51 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.890 112.5 49.3 -61.9 -34.5 19.9 1.1 4.8 87 87 A V H X S+ 0 0 2 -4,-0.5 4,-0.8 -3,-0.3 3,-0.5 0.973 111.4 48.0 -65.7 -53.7 23.1 2.0 3.0 88 88 A Y H >< S+ 0 0 33 -4,-2.5 3,-1.4 1,-0.3 -1,-0.2 0.923 109.4 53.7 -50.8 -49.2 25.3 1.0 5.7 89 89 A D H 3< S+ 0 0 76 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.858 106.6 54.1 -61.0 -29.2 23.4 -2.4 6.1 90 90 A S H 3< S+ 0 0 36 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.648 96.2 87.8 -79.6 -13.0 23.9 -3.1 2.4 91 91 A L S << S- 0 0 7 -3,-1.4 31,-0.0 -4,-0.8 2,-0.0 -0.532 73.1-118.1 -94.5 162.7 27.7 -2.6 2.5 92 92 A D > - 0 0 56 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.203 46.3 -88.9 -80.3 173.6 30.7 -4.9 3.1 93 93 A A H > S+ 0 0 82 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.863 123.0 45.8 -55.7 -44.6 33.2 -4.2 6.0 94 94 A V H > S+ 0 0 21 62,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.958 114.1 48.0 -65.4 -47.7 35.6 -1.9 4.2 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.839 107.3 56.3 -64.8 -32.3 32.9 0.2 2.6 96 96 A R H X S+ 0 0 83 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.921 105.8 52.0 -64.3 -39.9 31.1 0.6 6.0 97 97 A A H X S+ 0 0 7 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.906 106.4 54.1 -62.2 -39.4 34.3 2.0 7.4 98 98 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.899 108.8 48.7 -61.3 -38.8 34.4 4.5 4.5 99 99 A L H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.910 109.2 51.8 -70.2 -37.9 30.8 5.7 5.3 100 100 A I H X S+ 0 0 9 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.945 107.4 54.3 -62.2 -42.7 31.7 6.0 9.0 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.3 -2,-0.2 0.935 108.2 48.3 -55.9 -48.7 34.7 8.2 8.0 102 102 A M H X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.902 112.7 48.0 -60.5 -42.6 32.6 10.5 6.0 103 103 A V H X S+ 0 0 9 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.913 109.3 53.6 -66.3 -37.1 30.1 10.8 8.9 104 104 A F H < S+ 0 0 31 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.2 0.930 115.5 41.3 -60.9 -40.1 32.9 11.4 11.4 105 105 A Q H < S+ 0 0 59 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.912 132.5 15.2 -74.4 -47.0 34.1 14.2 9.2 106 106 A M H X S- 0 0 53 -4,-2.9 4,-0.6 -5,-0.2 -3,-0.2 0.470 102.4-110.5-114.5 -2.3 30.9 15.9 8.1 107 107 A G H X - 0 0 31 -4,-2.4 4,-2.4 -5,-0.3 5,-0.2 0.163 34.3 -82.3 85.5 151.9 28.1 14.8 10.3 108 108 A E H > S+ 0 0 58 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.885 127.9 53.3 -60.3 -39.3 25.2 12.7 9.6 109 109 A T H > S+ 0 0 122 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.944 108.3 50.8 -61.7 -46.7 23.2 15.4 8.2 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-0.7 1,-0.2 -2,-0.2 0.932 115.0 41.6 -57.9 -49.7 26.0 16.3 5.8 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-2.6 1,-0.2 -1,-0.2 0.898 105.9 62.0 -67.8 -38.3 26.3 12.8 4.5 112 112 A A H 3< S+ 0 0 7 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.764 95.3 67.0 -58.9 -21.5 22.6 12.1 4.4 113 113 A G T << S+ 0 0 55 -4,-1.0 2,-1.6 -3,-0.7 -1,-0.3 0.558 74.1 86.8 -76.0 -9.3 22.6 14.9 1.9 114 114 A F <> + 0 0 40 -3,-2.6 4,-2.5 1,-0.2 5,-0.3 -0.342 56.1 159.3 -88.1 57.0 24.6 12.9 -0.7 115 115 A T H > + 0 0 82 -2,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.857 65.6 43.4 -49.2 -51.9 21.4 11.5 -2.0 116 116 A N H > S+ 0 0 80 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.889 114.0 50.1 -67.3 -37.4 22.4 10.4 -5.4 117 117 A S H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.896 108.8 53.3 -64.4 -41.6 25.7 8.9 -4.2 118 118 A L H X S+ 0 0 13 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.907 107.8 50.6 -61.0 -42.3 24.0 6.9 -1.5 119 119 A R H X S+ 0 0 124 -4,-1.6 4,-1.8 -5,-0.3 -1,-0.2 0.937 111.1 48.6 -64.4 -41.5 21.6 5.4 -4.0 120 120 A M H <>S+ 0 0 25 -4,-2.1 5,-2.1 2,-0.2 4,-0.4 0.895 110.6 50.5 -66.9 -41.0 24.4 4.4 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.947 108.8 52.6 -61.2 -43.8 26.3 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.888 109.2 49.1 -60.3 -33.5 23.3 0.9 -2.4 123 123 A Q T 3<5S- 0 0 86 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.475 112.6-120.6 -84.3 -1.2 23.0 -0.4 -5.9 124 124 A K T < 5 + 0 0 100 -3,-1.8 2,-1.3 -4,-0.4 -3,-0.2 0.773 62.8 146.2 66.9 31.5 26.6 -1.4 -5.9 125 125 A R >< + 0 0 109 -5,-2.1 4,-2.4 1,-0.2 5,-0.2 -0.692 22.0 174.7 -98.0 76.7 27.5 0.8 -8.9 126 126 A W H > + 0 0 50 -2,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.906 69.0 44.1 -53.3 -56.7 31.0 1.5 -7.6 127 127 A D H > S+ 0 0 105 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 114.9 50.4 -61.2 -40.8 32.6 3.5 -10.3 128 128 A E H > S+ 0 0 108 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.916 110.2 48.9 -65.4 -42.3 29.5 5.6 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.4 4,-3.3 2,-0.2 5,-0.2 0.905 108.2 55.9 -62.2 -39.8 29.3 6.4 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.924 108.3 46.8 -61.8 -41.9 32.9 7.4 -7.1 131 131 A V H X S+ 0 0 94 -4,-2.0 4,-0.6 1,-0.2 3,-0.3 0.938 114.7 47.0 -64.9 -44.1 32.5 9.9 -9.8 132 132 A N H >< S+ 0 0 37 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.886 107.0 56.0 -65.1 -40.3 29.4 11.3 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.3 6,-0.3 1,-0.2 -1,-0.2 0.840 102.7 59.4 -61.7 -27.6 31.1 11.5 -4.8 134 134 A A H 3< S+ 0 0 27 -4,-1.3 2,-1.7 -3,-0.3 -1,-0.2 0.674 84.5 79.2 -74.8 -20.3 33.8 13.6 -6.4 135 135 A K S << S+ 0 0 164 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.561 81.7 96.0 -87.7 72.2 31.4 16.3 -7.6 136 136 A S S > S- 0 0 19 -2,-1.7 4,-2.3 1,-0.1 5,-0.2 -0.999 84.9-115.3-156.7 158.3 31.3 18.0 -4.2 137 137 A R H > S+ 0 0 147 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.919 114.2 63.8 -61.3 -39.7 32.6 20.7 -2.1 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.921 106.6 41.5 -50.0 -48.5 34.0 17.9 0.2 139 139 A Y H 4 S+ 0 0 63 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.901 114.8 51.7 -68.7 -40.6 36.2 16.6 -2.6 140 140 A N H < S+ 0 0 108 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.844 115.2 40.8 -67.5 -31.2 37.2 20.1 -3.7 141 141 A Q H < S+ 0 0 102 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.869 132.6 19.9 -85.1 -37.3 38.2 21.2 -0.2 142 142 A T S X S+ 0 0 22 -4,-2.3 4,-2.9 -5,-0.3 -1,-0.2 -0.541 72.7 160.3-133.6 71.1 40.0 18.0 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.828 69.9 52.9 -61.2 -39.6 40.9 16.2 -2.1 144 144 A N H > S+ 0 0 117 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.953 116.0 39.2 -67.7 -44.4 43.6 13.9 -0.7 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.933 116.1 51.7 -67.2 -47.1 41.4 12.6 2.0 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.916 107.2 54.6 -54.6 -46.1 38.4 12.5 -0.2 147 147 A K H X S+ 0 0 83 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.878 107.4 49.9 -56.3 -40.8 40.4 10.5 -2.7 148 148 A R H X S+ 0 0 69 -4,-1.6 4,-1.5 2,-0.2 12,-0.2 0.933 112.9 45.2 -66.2 -41.6 41.3 7.9 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.926 112.5 51.7 -67.5 -41.4 37.8 7.5 1.1 150 150 A I H X S+ 0 0 15 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.838 105.9 54.6 -63.5 -35.3 36.5 7.3 -2.5 151 151 A T H X S+ 0 0 36 -4,-1.8 4,-3.1 -5,-0.2 6,-0.4 0.868 105.3 53.4 -66.0 -37.1 39.0 4.6 -3.4 152 152 A A H X S+ 0 0 1 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.909 112.5 44.6 -63.8 -39.5 37.8 2.5 -0.5 153 153 A F H < S+ 0 0 2 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.900 116.5 47.3 -70.2 -39.6 34.2 2.9 -1.9 154 154 A R H < S+ 0 0 106 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.937 127.9 20.4 -68.5 -45.5 35.3 2.2 -5.3 155 155 A T H < S- 0 0 48 -4,-3.1 -2,-0.2 2,-0.2 -3,-0.2 0.561 86.3-131.6-101.8 -18.4 37.5 -0.9 -4.6 156 156 A G S < S+ 0 0 18 -4,-2.3 2,-0.3 -5,-0.3 -62,-0.2 0.700 74.4 102.2 71.5 17.7 36.4 -2.3 -1.4 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.3 -5,-0.1 -1,-0.2 -0.820 77.8-124.2-127.3 170.4 40.0 -2.4 -0.2 158 158 A W >> + 0 0 42 -2,-0.3 3,-2.6 1,-0.2 4,-0.6 0.155 69.5 123.8 -94.8 12.1 42.3 -0.4 2.1 159 159 A D G >4 + 0 0 93 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.819 66.3 58.1 -46.6 -39.0 44.9 0.1 -0.7 160 160 A A G 34 S+ 0 0 37 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.680 108.3 47.4 -67.3 -17.4 44.8 3.9 -0.4 161 161 A Y G <4 0 0 20 -3,-2.6 -1,-0.3 -13,-0.1 -2,-0.2 0.485 360.0 360.0-103.1 -2.6 45.8 3.7 3.1 162 162 A K << 0 0 170 -3,-1.4 -2,-0.2 -4,-0.6 -3,-0.1 0.818 360.0 360.0-103.2 360.0 48.6 1.3 2.7