==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-JUL-99 1QUO . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.WRAY,W.A.BAASE,J.D.LINDSTROM,A.R.POTEETE,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8687.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 71.6 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 . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 52.5 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 2 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 . 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 80 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 154.8 43.4 -2.0 9.2 2 2 A N > - 0 0 68 156,-0.0 4,-2.7 95,-0.0 5,-0.2 -0.940 360.0 -84.7-158.5 175.6 40.2 -0.8 10.8 3 3 A I H > S+ 0 0 24 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.839 123.2 53.8 -61.3 -43.5 38.2 2.4 11.3 4 4 A F H > S+ 0 0 77 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.963 113.0 40.2 -58.9 -55.1 40.2 3.6 14.2 5 5 A E H > S+ 0 0 98 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.857 115.3 55.1 -60.3 -36.5 43.5 3.3 12.4 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.949 111.0 41.3 -63.5 -51.7 42.0 4.7 9.3 7 7 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 -5,-0.2 5,-0.4 0.821 108.3 60.6 -66.9 -26.2 40.7 7.8 10.9 8 8 A R H X S+ 0 0 101 -4,-1.9 4,-1.3 -5,-0.3 -1,-0.2 0.876 107.3 48.1 -68.9 -29.0 43.8 8.3 12.9 9 9 A I H < S+ 0 0 88 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.915 115.3 43.4 -73.0 -45.7 45.6 8.5 9.6 10 10 A D H < S+ 0 0 21 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.824 124.8 30.9 -69.8 -33.3 43.2 11.0 8.1 11 11 A E H < S- 0 0 45 -4,-2.5 19,-0.3 -5,-0.2 -1,-0.2 0.661 92.6-153.0-100.7 -21.1 42.7 13.3 11.1 12 12 A G < - 0 0 24 -4,-1.3 2,-0.4 -5,-0.4 -1,-0.2 -0.178 24.3 -84.9 70.7-170.9 46.1 13.0 12.7 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.943 42.7 172.4-141.5 120.9 46.7 13.6 16.5 14 14 A R E -A 28 0A 130 14,-1.7 14,-2.6 -2,-0.4 4,-0.1 -0.999 19.0-163.6-132.4 127.7 47.2 17.0 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-1.9 12,-0.2 2,-0.3 0.439 74.5 59.8 -90.7 0.2 47.3 17.6 22.0 16 16 A K E S-C 57 0B 84 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.928 101.8 -85.1-125.3 149.1 46.8 21.4 21.9 17 17 A I E + 0 0 17 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.296 58.6 171.2 -51.5 137.5 43.8 23.2 20.5 18 18 A Y E -A 26 0A 28 8,-2.9 8,-3.0 -4,-0.1 2,-0.5 -0.844 35.0-103.6-141.0 174.5 44.2 23.8 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.858 33.4-140.3-103.2 134.6 42.3 25.0 13.8 20 20 A D > - 0 0 50 4,-2.7 3,-1.8 -2,-0.5 -1,-0.1 -0.071 40.8 -81.1 -79.2-170.0 40.9 22.5 11.3 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.741 135.3 49.7 -66.4 -23.4 40.9 22.9 7.5 22 22 A E T 3 S- 0 0 79 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.437 123.3-107.1 -92.0 -1.6 37.7 24.9 7.8 23 23 A G S < S+ 0 0 32 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.567 72.8 141.8 84.3 15.6 39.4 27.1 10.6 24 24 A Y - 0 0 69 1,-0.1 -4,-2.7 9,-0.0 2,-0.3 -0.724 60.4 -98.0 -92.0 149.9 37.3 25.7 13.5 25 25 A Y E +AB 19 34A 33 9,-0.7 8,-3.1 11,-0.5 9,-1.6 -0.447 56.1 159.4 -65.7 121.8 38.6 24.9 16.9 26 26 A T E -AB 18 32A 4 -8,-3.0 -8,-2.9 -2,-0.3 2,-0.3 -0.869 18.6-170.4-136.3 165.8 39.5 21.3 17.3 27 27 A I E > + B 0 31A 0 4,-1.8 4,-1.9 -2,-0.3 2,-0.2 -0.969 51.1 2.4-153.0 166.6 41.6 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.7 -2,-0.3 2,-0.8 -0.381 122.7 -6.2 66.4-124.7 42.9 15.4 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -2,-0.2 -17,-0.1 -0.619 128.3 -51.6-107.3 75.6 42.0 13.2 16.8 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.2 -19,-0.3 -2,-0.2 0.710 84.5 159.9 71.0 20.6 39.6 15.4 14.8 31 31 A H E < -B 27 0A 31 -4,-1.9 -4,-1.8 -20,-0.1 -1,-0.2 -0.621 32.1-145.6 -80.1 104.8 37.5 16.3 17.8 32 32 A L E -B 26 0A 71 -2,-1.2 -6,-0.3 -6,-0.2 3,-0.1 -0.344 18.5-178.1 -69.5 126.6 35.6 19.5 16.8 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.917 58.4 -23.1 -91.1 -49.1 35.1 21.7 19.8 34 34 A T E -B 25 0A 28 -9,-1.6 -9,-0.7 2,-0.1 -1,-0.4 -0.974 35.1-139.0-158.9 158.7 33.2 24.6 18.4 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.376 74.5 109.5 -97.1 -5.8 32.4 26.6 15.2 36 36 A S S S- 0 0 37 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.501 74.3-132.2 -74.2 147.8 32.7 29.8 17.1 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.452 76.7 106.6 -76.0 -4.9 35.6 32.1 16.4 38 38 A S > - 0 0 44 1,-0.1 4,-2.2 -13,-0.0 3,-0.2 -0.713 55.3-161.9 -88.7 114.1 36.2 32.4 20.2 39 39 A L H > S+ 0 0 69 -2,-0.6 4,-2.2 1,-0.2 -1,-0.1 0.791 94.8 54.2 -61.3 -27.3 39.1 30.6 21.6 40 40 A N H > S+ 0 0 119 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.891 104.2 53.4 -74.7 -36.6 37.6 31.0 25.1 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.930 110.3 49.5 -60.2 -41.8 34.5 29.4 23.8 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.889 110.5 48.0 -61.6 -44.1 36.7 26.6 22.6 43 43 A K H X S+ 0 0 53 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.928 110.4 53.5 -67.6 -35.5 38.5 26.3 25.9 44 44 A S H X S+ 0 0 71 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.955 110.7 45.4 -60.8 -49.4 35.2 26.3 27.7 45 45 A E H X S+ 0 0 69 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.928 111.1 54.3 -66.6 -39.8 33.9 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 5,-0.4 0.956 107.4 47.9 -58.8 -46.3 37.1 21.5 25.9 47 47 A D H X>S+ 0 0 33 -4,-2.4 4,-2.1 1,-0.3 5,-1.5 0.914 112.0 51.1 -61.1 -39.1 37.0 21.6 29.8 48 48 A K H <5S+ 0 0 142 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.827 110.0 49.2 -63.7 -37.8 33.5 20.5 29.7 49 49 A A H <5S+ 0 0 46 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.916 120.3 36.8 -69.5 -40.4 34.3 17.6 27.4 50 50 A I H <5S- 0 0 33 -4,-2.4 -2,-0.2 2,-0.3 -1,-0.2 0.648 102.7-126.6 -89.4 -20.4 37.2 16.4 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.1 2,-0.3 -5,-0.4 -3,-0.2 0.810 76.3 73.9 79.7 22.4 35.8 17.2 32.8 52 52 A R S - 0 0 8 -2,-1.0 3,-1.2 -11,-0.2 -1,-0.2 0.718 33.3-143.7 -94.0 -29.1 42.7 21.8 30.8 55 55 A N T 3 S- 0 0 115 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.848 71.9 -58.7 66.5 31.6 44.0 25.1 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.2 2,-0.4 0.511 118.1 97.0 77.1 4.5 43.9 24.0 26.0 57 57 A V B < +C 16 0B 68 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.977 45.9 176.1-127.0 140.7 46.1 21.0 26.4 58 58 A I - 0 0 5 -43,-1.9 2,-0.2 -2,-0.4 -30,-0.1 -0.885 27.7-108.4-135.4 165.7 45.1 17.3 27.0 59 59 A T > - 0 0 63 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.496 32.5-106.0 -90.7 172.4 46.9 14.0 27.2 60 60 A K H > S+ 0 0 109 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.878 121.1 54.1 -60.7 -43.0 47.1 11.2 24.7 61 61 A D H > S+ 0 0 123 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.933 107.8 49.9 -58.6 -46.8 44.8 9.1 26.9 62 62 A E H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.914 110.1 50.6 -59.4 -46.8 42.2 12.0 26.9 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -34,-0.4 0.911 110.3 50.1 -58.3 -43.9 42.4 12.3 23.1 64 64 A E H X S+ 0 0 67 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.809 107.7 53.0 -65.5 -31.9 41.8 8.7 22.7 65 65 A K H X S+ 0 0 139 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.943 108.7 48.8 -71.7 -40.9 39.0 8.7 24.9 66 66 A L H X S+ 0 0 5 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.915 110.6 54.4 -57.2 -40.2 37.4 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.923 105.5 49.8 -63.7 -45.4 38.1 9.5 19.8 68 68 A N H X S+ 0 0 90 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.951 112.1 48.9 -58.3 -42.7 36.3 6.4 21.0 69 69 A Q H X S+ 0 0 98 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.947 111.1 49.9 -64.8 -41.5 33.3 8.4 21.9 70 70 A D H X S+ 0 0 37 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.810 109.7 49.0 -65.2 -35.5 33.3 10.0 18.6 71 71 A V H X S+ 0 0 7 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.934 112.6 50.5 -69.4 -45.8 33.6 6.8 16.6 72 72 A D H X S+ 0 0 87 -4,-2.6 4,-2.8 -5,-0.3 5,-0.3 0.946 109.2 49.1 -53.8 -47.0 30.8 5.3 18.6 73 73 A A H X S+ 0 0 53 -4,-2.4 4,-3.1 -5,-0.3 -1,-0.2 0.867 108.9 54.0 -62.5 -37.2 28.6 8.3 18.1 74 74 A A H X S+ 0 0 9 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.988 110.6 45.0 -63.4 -49.1 29.2 8.3 14.3 75 75 A V H X S+ 0 0 36 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.942 116.1 46.6 -55.9 -50.4 28.2 4.6 13.9 76 76 A R H X S+ 0 0 104 -4,-2.8 4,-1.9 -5,-0.3 -1,-0.2 0.923 108.8 55.0 -64.3 -38.4 25.2 5.1 16.1 77 77 A G H < S+ 0 0 12 -4,-3.1 4,-0.3 -5,-0.3 -1,-0.2 0.921 108.8 49.5 -57.1 -44.4 24.3 8.2 14.2 78 78 A I H >< S+ 0 0 2 -4,-2.6 3,-2.0 -5,-0.2 7,-0.5 0.959 108.9 51.1 -56.6 -51.2 24.3 6.2 11.0 79 79 A L H 3< S+ 0 0 69 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.783 110.1 51.2 -64.6 -21.3 22.1 3.5 12.5 80 80 A R T 3< S+ 0 0 193 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.3 0.411 91.2 89.5 -93.9 -0.1 19.6 6.0 13.6 81 81 A N <> - 0 0 33 -3,-2.0 4,-2.6 -4,-0.3 -4,-0.0 -0.838 65.6-148.8-102.1 133.7 19.3 7.9 10.2 82 82 A A T 4 S+ 0 0 79 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.788 97.3 47.5 -70.3 -22.7 16.7 6.6 7.9 83 83 A K T > S+ 0 0 122 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.853 119.2 38.6 -85.4 -30.3 18.5 7.5 4.8 84 84 A L H >> S+ 0 0 9 -6,-0.2 4,-2.9 -7,-0.1 3,-0.6 0.896 99.6 68.4 -89.4 -38.1 21.8 6.1 6.0 85 85 A K H 3X S+ 0 0 93 -4,-2.6 4,-2.8 -7,-0.5 5,-0.2 0.905 99.6 49.4 -48.7 -50.0 21.0 2.9 7.7 86 86 A P H 3> S+ 0 0 57 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.892 113.1 48.4 -61.7 -34.0 19.8 1.0 4.7 87 87 A V H XX S+ 0 0 8 -3,-0.6 4,-0.6 -4,-0.5 3,-0.6 0.946 112.0 47.2 -69.9 -51.0 22.8 2.0 2.8 88 88 A Y H >< S+ 0 0 26 -4,-2.9 3,-0.9 1,-0.2 -1,-0.2 0.872 108.7 56.5 -58.1 -38.3 25.2 1.1 5.5 89 89 A D H 3< S+ 0 0 68 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.821 103.0 54.8 -67.4 -25.1 23.5 -2.2 6.0 90 90 A S H << S+ 0 0 39 -4,-1.1 -1,-0.2 -3,-0.6 2,-0.2 0.581 94.4 91.3 -81.5 -11.4 24.0 -3.2 2.5 91 91 A L S << S- 0 0 5 -3,-0.9 31,-0.0 -4,-0.6 30,-0.0 -0.585 74.8-116.1 -89.3 155.1 27.7 -2.7 2.5 92 92 A D > - 0 0 55 -2,-0.2 4,-1.9 1,-0.1 -1,-0.1 -0.127 44.3 -93.5 -75.7 171.9 30.6 -5.0 3.2 93 93 A A H > S+ 0 0 82 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.902 120.5 49.1 -62.9 -42.8 32.9 -4.3 6.2 94 94 A V H > S+ 0 0 26 1,-0.2 4,-1.5 62,-0.2 3,-0.3 0.940 112.4 48.9 -59.2 -48.2 35.6 -2.2 4.4 95 95 A R H > S+ 0 0 24 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.844 102.6 60.3 -65.6 -28.5 33.1 -0.1 2.8 96 96 A R H X S+ 0 0 81 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.899 102.1 55.6 -60.7 -34.7 31.2 0.6 6.1 97 97 A A H X S+ 0 0 7 -4,-1.5 4,-2.8 -3,-0.3 -1,-0.2 0.919 103.6 54.3 -64.9 -37.6 34.4 2.1 7.4 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.913 109.1 47.9 -61.5 -41.3 34.4 4.4 4.5 99 99 A A H X S+ 0 0 17 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.904 111.2 50.2 -65.8 -40.9 30.9 5.5 5.3 100 100 A I H X S+ 0 0 10 -4,-2.7 4,-3.5 2,-0.2 5,-0.3 0.938 106.6 55.1 -64.7 -44.5 31.8 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.965 108.9 48.7 -51.5 -49.0 34.8 8.1 7.9 102 102 A M H X S+ 0 0 6 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.913 112.1 47.2 -56.6 -44.9 32.6 10.4 6.0 103 103 A V H X S+ 0 0 9 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.923 108.7 56.0 -65.3 -38.7 30.1 10.8 8.8 104 104 A F H < S+ 0 0 31 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.923 114.4 40.0 -59.6 -39.3 33.0 11.4 11.2 105 105 A Q H < S+ 0 0 56 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.845 133.7 13.5 -76.2 -42.3 34.2 14.3 9.1 106 106 A M H X S- 0 0 53 -4,-2.3 4,-0.6 -5,-0.2 -3,-0.2 0.417 101.3-111.0-125.2 5.7 31.0 15.9 8.0 107 107 A G H X - 0 0 29 -4,-2.5 4,-2.6 -5,-0.3 5,-0.2 0.207 32.7 -80.8 80.5 156.6 28.1 14.7 10.1 108 108 A V H > S+ 0 0 32 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.904 127.8 52.2 -59.1 -47.1 25.1 12.6 9.4 109 109 A T H > S+ 0 0 123 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.902 109.3 49.2 -56.1 -51.0 23.2 15.3 8.0 110 110 A G H < S+ 0 0 33 -4,-0.6 3,-0.4 1,-0.2 -2,-0.2 0.920 116.6 41.1 -59.0 -51.6 26.0 16.2 5.6 111 111 A V H >< S+ 0 0 5 -4,-2.6 3,-2.3 1,-0.2 -2,-0.2 0.884 106.4 61.4 -65.9 -41.5 26.4 12.7 4.4 112 112 A A H 3< S+ 0 0 18 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.788 96.4 67.4 -58.5 -19.8 22.7 11.9 4.3 113 113 A G T 3< S+ 0 0 52 -4,-0.8 2,-2.1 -3,-0.4 -1,-0.3 0.675 74.1 85.1 -73.9 -17.2 22.7 14.8 1.7 114 114 A F <> + 0 0 40 -3,-2.3 4,-2.6 1,-0.2 5,-0.3 -0.343 57.2 159.6 -80.0 55.9 24.7 12.8 -1.0 115 115 A T H > + 0 0 84 -2,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.881 65.1 45.8 -48.7 -51.0 21.5 11.2 -2.2 116 116 A N H > S+ 0 0 81 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.898 114.6 49.1 -64.9 -37.2 22.5 10.2 -5.6 117 117 A S H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.905 108.6 54.2 -66.5 -38.0 25.8 8.7 -4.3 118 118 A L H X S+ 0 0 17 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.910 107.5 49.7 -59.7 -47.4 24.0 6.8 -1.6 119 119 A R H X S+ 0 0 116 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.936 111.3 49.7 -58.4 -45.1 21.7 5.2 -4.1 120 120 A M H <>S+ 0 0 29 -4,-2.1 5,-2.4 1,-0.2 4,-0.3 0.864 110.0 50.0 -61.8 -40.3 24.6 4.2 -6.3 121 121 A L H ><5S+ 0 0 5 -4,-2.6 3,-2.1 2,-0.2 -1,-0.2 0.939 108.4 53.2 -63.1 -45.1 26.3 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 94 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.927 109.8 48.5 -59.7 -36.3 23.2 0.8 -2.4 123 123 A Q T 3<5S- 0 0 79 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.547 112.8-121.7 -79.9 0.2 23.1 -0.6 -5.8 124 124 A K T < 5 + 0 0 97 -3,-2.1 2,-1.4 -4,-0.3 -3,-0.2 0.753 61.6 146.5 63.1 33.3 26.8 -1.6 -5.7 125 125 A R >< + 0 0 119 -5,-2.4 4,-2.2 1,-0.2 -1,-0.2 -0.659 20.8 173.5 -94.3 76.2 27.6 0.5 -8.7 126 126 A W H > + 0 0 48 -2,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.856 68.4 46.8 -59.3 -45.6 31.1 1.4 -7.4 127 127 A D H > S+ 0 0 105 1,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.919 114.7 49.1 -64.7 -38.4 32.7 3.2 -10.3 128 128 A E H > S+ 0 0 111 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.915 110.3 48.8 -68.6 -40.3 29.6 5.3 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.2 4,-3.5 2,-0.2 5,-0.2 0.927 107.0 57.3 -62.7 -39.7 29.4 6.2 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.929 108.1 48.0 -57.2 -45.4 33.1 7.2 -7.1 131 131 A V H X S+ 0 0 94 -4,-2.1 4,-0.6 1,-0.2 3,-0.3 0.952 113.6 44.8 -64.5 -50.0 32.5 9.6 -9.9 132 132 A N H >< S+ 0 0 36 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.909 107.6 58.7 -62.1 -36.2 29.5 11.2 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-3.5 6,-0.3 -5,-0.3 -1,-0.2 0.895 101.2 57.0 -62.8 -27.3 31.1 11.4 -4.9 134 134 A A H 3< S+ 0 0 28 -4,-1.4 2,-1.8 -3,-0.3 -1,-0.3 0.674 84.8 82.0 -77.5 -13.2 33.9 13.5 -6.4 135 135 A K S << S+ 0 0 166 -3,-1.3 2,-0.3 -4,-0.6 -1,-0.2 -0.513 81.4 99.4 -88.6 67.1 31.4 16.1 -7.7 136 136 A S S > S- 0 0 16 -2,-1.8 4,-2.4 1,-0.1 5,-0.2 -0.998 84.7-118.9-155.2 153.5 31.4 17.8 -4.3 137 137 A R H > S+ 0 0 143 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.902 113.6 64.0 -59.0 -40.1 32.7 20.5 -2.3 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.7 2,-0.2 8,-0.2 0.930 106.3 41.4 -47.6 -50.8 34.1 17.8 -0.0 139 139 A Y H 4 S+ 0 0 64 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.927 114.1 52.2 -67.8 -42.7 36.4 16.6 -2.7 140 140 A N H < S+ 0 0 109 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.856 116.2 39.9 -63.0 -35.3 37.3 20.0 -3.9 141 141 A Q H < S+ 0 0 106 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.876 131.1 21.8 -83.1 -39.7 38.3 21.1 -0.4 142 142 A T S X S+ 0 0 22 -4,-2.7 4,-2.9 -5,-0.3 5,-0.2 -0.591 72.1 161.4-129.5 70.5 40.0 18.0 0.9 143 143 A P H > + 0 0 45 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.859 69.0 51.7 -57.4 -44.5 41.0 16.1 -2.2 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.926 117.3 39.8 -68.8 -35.1 43.7 13.8 -0.7 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.952 115.1 50.5 -72.4 -50.7 41.4 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.919 109.3 54.4 -53.1 -44.8 38.4 12.4 -0.2 147 147 A K H X S+ 0 0 89 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.879 106.4 51.0 -57.5 -41.0 40.4 10.5 -2.7 148 148 A R H X S+ 0 0 69 -4,-1.5 4,-1.2 -5,-0.2 12,-0.2 0.921 113.8 43.3 -63.0 -42.4 41.4 7.9 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.889 112.7 51.9 -68.3 -41.5 37.8 7.4 1.0 150 150 A I H X S+ 0 0 13 -4,-2.6 4,-2.8 -5,-0.3 -2,-0.2 0.903 108.1 51.8 -63.5 -42.7 36.4 7.3 -2.5 151 151 A T H X S+ 0 0 40 -4,-2.3 4,-2.3 -5,-0.2 6,-0.4 0.841 106.8 55.0 -61.8 -33.7 39.0 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.2 4,-2.4 2,-0.2 5,-0.3 0.922 110.8 44.1 -67.3 -40.9 37.9 2.6 -0.5 153 153 A F H < S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.909 114.2 51.6 -68.6 -40.1 34.3 2.7 -1.7 154 154 A R H < S+ 0 0 105 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.922 124.2 23.4 -60.4 -44.4 35.3 2.0 -5.2 155 155 A T H < S- 0 0 46 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.526 84.0-135.9-101.1 -14.2 37.5 -1.1 -4.4 156 156 A G S < S+ 0 0 16 -4,-2.4 2,-0.3 1,-0.2 -62,-0.2 0.692 74.4 105.4 58.5 20.7 36.2 -2.5 -1.1 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.2 -0.799 79.0-124.6-121.9 171.3 39.9 -2.8 -0.2 158 158 A W S > S+ 0 0 53 -2,-0.3 3,-2.1 1,-0.2 4,-0.3 0.258 70.6 120.0 -94.3 15.0 42.3 -0.9 2.1 159 159 A D G > + 0 0 121 1,-0.3 3,-2.1 2,-0.2 -1,-0.2 0.840 65.5 60.7 -53.1 -30.8 44.8 -0.1 -0.6 160 160 A A G 3 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.647 107.6 47.2 -67.5 -16.0 44.5 3.8 -0.3 161 161 A Y G < 0 0 14 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.411 360.0 360.0-107.5 4.2 45.7 3.4 3.2 162 162 A K < 0 0 217 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.1 -0.324 360.0 360.0 55.8 360.0 48.5 1.1 2.0