==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-JAN-99 1B6I . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR I.R.VETTER,W.A.BAASE,S.SNOW,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8615.0 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 . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 53.1 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 75 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.5 43.7 -1.7 9.0 2 2 A N > - 0 0 72 156,-0.0 4,-2.8 95,-0.0 5,-0.2 -0.900 360.0 -80.3-151.0 179.2 40.5 -0.8 10.8 3 3 A I H > S+ 0 0 28 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.810 124.6 50.2 -53.8 -39.2 38.4 2.4 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.931 113.4 44.8 -68.3 -43.6 40.5 3.8 14.2 5 5 A E H > S+ 0 0 104 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.927 113.4 51.8 -66.5 -44.8 43.7 3.4 12.3 6 6 A M H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.934 113.3 43.3 -53.9 -54.1 42.0 4.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.4 0.860 108.3 57.7 -67.2 -33.9 40.8 7.9 10.9 8 8 A R H X S+ 0 0 103 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.901 108.9 48.2 -61.4 -37.1 44.1 8.4 12.9 9 9 A I H < S+ 0 0 90 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.954 116.0 43.4 -65.5 -47.5 45.8 8.7 9.5 10 10 A D H < S+ 0 0 21 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.834 126.4 27.8 -66.4 -38.5 43.2 11.1 8.1 11 11 A E H < S- 0 0 43 -4,-2.6 19,-0.4 -5,-0.1 -1,-0.2 0.632 91.6-152.7-100.2 -23.4 42.9 13.4 11.1 12 12 A G < - 0 0 24 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.1 -0.128 24.9 -85.9 72.3-171.1 46.3 13.2 12.9 13 13 A L + 0 0 39 16,-0.1 2,-0.4 17,-0.1 16,-0.2 -0.991 43.4 170.9-136.7 121.0 46.9 13.7 16.6 14 14 A R E -A 28 0A 136 14,-1.3 14,-2.0 -2,-0.4 4,-0.1 -0.996 21.0-161.0-132.6 136.7 47.5 17.1 18.3 15 15 A L E S+ 0 0 64 -2,-0.4 43,-2.4 12,-0.2 2,-0.3 0.471 75.5 61.9 -93.9 -1.9 47.5 17.7 22.0 16 16 A K E S-C 57 0B 116 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.887 100.0 -87.2-124.4 147.2 47.0 21.4 21.8 17 17 A I E + 0 0 23 39,-1.4 2,-0.3 -2,-0.3 10,-0.2 -0.306 57.2 170.8 -54.6 134.0 43.9 23.3 20.4 18 18 A Y E -A 26 0A 28 8,-3.1 8,-3.0 -4,-0.1 2,-0.4 -0.854 35.6-102.5-141.5 172.2 44.4 23.9 16.7 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 2,-0.0 -0.806 34.1-141.7 -99.0 133.1 42.4 25.2 13.7 20 20 A D > - 0 0 49 4,-1.9 3,-2.4 -2,-0.4 -1,-0.1 -0.223 40.1 -80.5 -83.0-172.0 41.1 22.6 11.4 21 21 A C T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.736 134.4 49.5 -58.8 -27.6 40.9 22.9 7.5 22 22 A E T 3 S- 0 0 84 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.313 122.8-106.4 -88.2 -5.7 37.8 25.0 7.9 23 23 A G S < S+ 0 0 33 -3,-2.4 2,-0.4 1,-0.3 -2,-0.1 0.577 73.5 139.1 90.6 10.2 39.3 27.2 10.5 24 24 A Y - 0 0 73 1,-0.1 -4,-1.9 -5,-0.0 -1,-0.3 -0.713 61.0-100.9 -94.4 145.9 37.4 25.7 13.5 25 25 A Y E +AB 19 34A 33 9,-0.7 8,-3.5 11,-0.4 9,-1.4 -0.331 54.9 160.0 -67.3 129.8 38.8 25.0 16.8 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-3.1 6,-0.3 2,-0.3 -0.896 18.3-169.6-141.9 165.6 39.7 21.4 17.2 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.3 -2,-0.3 -12,-0.2 -0.988 49.3 3.3-155.3 167.9 41.8 19.0 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.0 -14,-1.3 -2,-0.3 2,-1.0 -0.368 121.7 -3.5 63.3-128.3 43.1 15.5 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.656 128.9 -52.7 -98.4 74.4 42.1 13.2 16.9 30 30 A G T 4 S+ 0 0 13 -2,-1.0 2,-0.9 -19,-0.4 -2,-0.2 0.735 85.4 162.6 68.1 22.4 39.8 15.4 14.7 31 31 A H E < -B 27 0A 35 -4,-2.3 -4,-1.7 -20,-0.1 -1,-0.2 -0.555 31.3-143.9 -82.4 104.1 37.7 16.4 17.8 32 32 A L E -B 26 0A 71 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.444 19.5-177.8 -63.8 127.4 35.7 19.5 16.8 33 33 A L E - 0 0 15 -8,-3.5 2,-0.3 1,-0.4 -7,-0.2 0.899 58.1 -24.3 -92.2 -51.9 35.3 21.8 19.7 34 34 A T E -B 25 0A 29 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.976 38.7-138.4-159.3 149.2 33.3 24.8 18.4 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.1 -11,-0.2 -2,-0.0 0.704 76.5 101.0 -84.3 -19.3 32.4 26.5 15.1 36 36 A S S S- 0 0 44 1,-0.1 -11,-0.4 -12,-0.1 6,-0.1 -0.224 78.4-124.5 -66.6 154.1 32.7 29.9 16.7 37 37 A P S S+ 0 0 113 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.504 75.1 108.0 -70.3 -14.3 35.8 32.2 16.4 38 38 A S > - 0 0 40 1,-0.2 4,-2.2 -13,-0.0 5,-0.2 -0.587 53.6-160.4 -79.7 122.2 36.4 32.6 20.2 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.870 96.3 56.0 -65.8 -27.9 39.3 30.9 21.7 40 40 A N H > S+ 0 0 117 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.966 102.4 52.9 -65.9 -50.9 37.6 31.3 25.0 41 41 A A H > S+ 0 0 27 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.929 110.8 50.2 -45.6 -48.0 34.6 29.5 23.8 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.904 108.8 49.1 -62.7 -45.8 36.9 26.7 22.7 43 43 A K H X S+ 0 0 48 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.933 111.4 51.8 -61.9 -41.6 38.8 26.4 26.0 44 44 A S H X S+ 0 0 62 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.934 109.4 48.0 -57.2 -51.3 35.5 26.3 27.7 45 45 A E H X S+ 0 0 63 -4,-2.7 4,-2.7 -5,-0.2 5,-0.2 0.958 110.6 52.3 -56.1 -46.4 34.2 23.5 25.5 46 46 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.3 0.928 108.2 50.8 -56.1 -47.3 37.4 21.5 26.0 47 47 A D H X>S+ 0 0 32 -4,-2.6 4,-2.0 -5,-0.2 5,-1.3 0.926 111.8 46.8 -57.5 -45.6 37.1 21.8 29.8 48 48 A K H <5S+ 0 0 146 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.902 113.0 50.4 -63.0 -41.7 33.6 20.6 29.8 49 49 A A H <5S+ 0 0 43 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.859 120.3 34.3 -63.8 -40.1 34.5 17.6 27.4 50 50 A I H <5S- 0 0 34 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.673 102.2-131.0 -88.4 -24.3 37.4 16.5 29.5 51 51 A G T <5S+ 0 0 68 -4,-2.0 2,-0.3 -5,-0.3 -3,-0.2 0.823 75.4 78.7 77.2 30.5 35.9 17.4 32.9 52 52 A R S - 0 0 10 -2,-0.8 3,-2.0 -11,-0.2 -1,-0.1 0.653 37.0-139.0 -98.5 -15.0 43.0 22.2 30.9 55 55 A N T 3 S- 0 0 120 1,-0.3 3,-0.1 -12,-0.1 -2,-0.1 0.934 76.1 -64.7 50.6 37.0 44.5 25.4 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.4 1,-0.1 2,-0.4 0.527 114.5 105.7 68.4 9.0 43.9 24.1 26.2 57 57 A V B < -C 16 0B 71 -3,-2.0 2,-0.3 -41,-0.2 -41,-0.2 -0.949 44.7-177.9-120.2 143.5 46.3 21.1 26.5 58 58 A I - 0 0 7 -43,-2.4 2,-0.2 -2,-0.4 -30,-0.1 -0.881 25.2-109.1-132.0 166.1 45.3 17.4 26.9 59 59 A T > - 0 0 59 -2,-0.3 4,-2.8 1,-0.1 5,-0.1 -0.607 30.7-110.6 -90.3 162.8 47.1 14.1 27.3 60 60 A K H > S+ 0 0 134 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.887 121.1 52.9 -52.6 -45.5 47.3 11.3 24.8 61 61 A D H > S+ 0 0 131 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.924 109.5 48.5 -57.4 -45.5 45.0 9.2 26.9 62 62 A E H > S+ 0 0 37 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.916 108.8 54.0 -63.9 -40.1 42.6 12.0 27.0 63 63 A A H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -34,-0.4 0.908 110.7 46.4 -58.9 -42.0 42.9 12.3 23.2 64 64 A E H X S+ 0 0 83 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.851 107.0 56.9 -72.2 -29.8 42.0 8.6 22.7 65 65 A K H X S+ 0 0 138 -4,-2.1 4,-2.4 -5,-0.3 5,-0.2 0.969 108.9 45.3 -64.8 -47.2 39.2 8.7 25.0 66 66 A L H X S+ 0 0 5 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.891 113.5 51.9 -58.0 -42.3 37.5 11.5 23.0 67 67 A F H X S+ 0 0 13 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.948 107.5 50.4 -63.7 -48.6 38.3 9.6 19.8 68 68 A N H X S+ 0 0 91 -4,-3.0 4,-2.4 1,-0.2 5,-0.3 0.941 113.9 46.1 -54.4 -43.5 36.7 6.4 21.1 69 69 A Q H X S+ 0 0 97 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.891 112.4 51.1 -65.0 -39.0 33.6 8.3 22.0 70 70 A D H X S+ 0 0 34 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.898 110.4 47.2 -66.8 -38.8 33.6 10.1 18.7 71 71 A V H X S+ 0 0 5 -4,-3.3 4,-2.4 2,-0.2 5,-0.2 0.946 112.7 50.0 -68.3 -44.1 33.8 6.8 16.7 72 72 A D H X S+ 0 0 80 -4,-2.4 4,-2.2 -5,-0.3 5,-0.3 0.933 110.3 51.3 -61.0 -34.3 31.0 5.2 18.8 73 73 A A H X S+ 0 0 52 -4,-2.1 4,-2.4 -5,-0.3 -1,-0.2 0.919 107.9 51.3 -70.3 -36.0 28.8 8.2 18.3 74 74 A A H X S+ 0 0 9 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.960 108.9 50.0 -68.2 -46.5 29.3 8.1 14.6 75 75 A V H X S+ 0 0 31 -4,-2.4 4,-3.3 1,-0.2 -2,-0.2 0.955 113.5 46.1 -54.6 -49.4 28.4 4.5 14.3 76 76 A R H X S+ 0 0 128 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.904 109.0 54.7 -65.5 -33.8 25.2 5.0 16.3 77 77 A G H < S+ 0 0 4 -4,-2.4 3,-0.4 -5,-0.3 4,-0.3 0.957 110.8 46.5 -65.1 -44.5 24.3 8.1 14.3 78 78 A I H >< S+ 0 0 0 -4,-2.6 3,-2.2 1,-0.2 7,-0.4 0.977 112.3 50.6 -54.2 -55.5 24.5 6.1 11.2 79 79 A L H 3< S+ 0 0 68 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.703 113.2 44.7 -62.2 -21.1 22.6 3.3 12.8 80 80 A R T 3< S+ 0 0 185 -4,-1.7 2,-0.5 -3,-0.4 -1,-0.3 0.224 92.8 99.3-100.9 1.0 19.8 5.7 13.9 81 81 A N <> - 0 0 30 -3,-2.2 4,-2.9 -4,-0.3 -4,-0.0 -0.875 64.0-149.6 -98.0 125.6 19.6 7.6 10.6 82 82 A A T 4 S+ 0 0 80 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.779 98.9 39.7 -62.1 -35.2 16.8 6.5 8.2 83 83 A K T > S+ 0 0 124 2,-0.1 4,-0.6 3,-0.1 -1,-0.2 0.859 119.9 43.7 -79.1 -40.9 18.7 7.4 5.2 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 3,-0.4 0.847 100.6 65.9 -78.3 -45.2 22.0 6.1 6.4 85 85 A K H X S+ 0 0 76 -4,-2.9 4,-2.8 -7,-0.4 5,-0.2 0.893 98.4 51.1 -47.8 -51.8 21.1 2.8 7.9 86 86 A P H > S+ 0 0 43 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.866 112.0 49.1 -59.4 -34.3 19.9 1.0 4.8 87 87 A V H X S+ 0 0 0 -4,-0.6 4,-0.6 -3,-0.4 -2,-0.2 0.944 110.4 47.7 -70.0 -51.5 23.1 1.9 3.1 88 88 A Y H >< S+ 0 0 36 -4,-2.1 3,-1.4 1,-0.2 -1,-0.2 0.920 110.3 55.4 -55.7 -41.9 25.4 0.8 5.9 89 89 A D H 3< S+ 0 0 78 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.825 105.2 53.0 -63.4 -28.7 23.5 -2.5 6.0 90 90 A S H 3< S+ 0 0 55 -4,-1.1 -1,-0.3 -5,-0.2 2,-0.2 0.632 96.6 86.8 -82.5 -11.0 24.1 -3.1 2.4 91 91 A L S << S- 0 0 8 -3,-1.4 31,-0.0 -4,-0.6 30,-0.0 -0.608 72.9-116.0 -98.8 159.3 27.9 -2.7 2.5 92 92 A D > - 0 0 59 -2,-0.2 4,-2.4 1,-0.1 -1,-0.1 -0.218 45.5 -92.9 -76.0 171.1 30.8 -4.9 3.1 93 93 A A H > S+ 0 0 80 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.771 122.2 47.6 -57.9 -39.0 33.2 -4.3 6.1 94 94 A V H > S+ 0 0 25 62,-0.2 4,-1.5 2,-0.2 3,-0.3 0.940 113.3 47.7 -68.7 -46.8 35.7 -2.1 4.3 95 95 A R H > S+ 0 0 25 1,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.811 105.5 60.0 -66.8 -29.8 33.1 0.1 2.7 96 96 A R H X S+ 0 0 73 -4,-2.4 4,-2.2 1,-0.2 -1,-0.3 0.917 102.7 51.8 -59.3 -45.3 31.3 0.4 6.0 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.7 -3,-0.3 -2,-0.2 0.895 106.3 56.0 -58.9 -40.6 34.5 2.0 7.5 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.903 108.3 46.0 -61.7 -36.4 34.5 4.5 4.5 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.857 110.4 53.4 -72.4 -33.9 31.0 5.7 5.3 100 100 A I H X S+ 0 0 8 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.948 106.1 55.1 -63.3 -42.8 31.9 6.0 9.1 101 101 A N H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.947 107.6 48.2 -53.5 -45.1 34.8 8.2 8.0 102 102 A M H X S+ 0 0 4 -4,-1.7 4,-2.8 1,-0.2 5,-0.3 0.915 111.9 48.7 -62.5 -46.1 32.5 10.5 6.1 103 103 A V H X S+ 0 0 10 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.914 108.8 53.4 -62.3 -42.5 30.1 10.8 9.1 104 104 A F H < S+ 0 0 32 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.902 117.5 38.0 -57.3 -41.1 32.9 11.5 11.5 105 105 A Q H < S+ 0 0 60 -4,-1.8 -2,-0.2 -5,-0.3 -1,-0.2 0.889 132.6 18.5 -78.5 -46.3 34.1 14.3 9.4 106 106 A M H X S- 0 0 51 -4,-2.8 4,-0.6 -5,-0.2 -3,-0.2 0.442 102.4-114.6-114.8 -1.2 30.9 15.9 8.1 107 107 A G H X - 0 0 29 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.099 32.2 -78.1 82.6 156.6 28.1 14.8 10.3 108 108 A E H > S+ 0 0 42 1,-0.2 4,-2.6 2,-0.2 -1,-0.1 0.848 129.5 48.8 -56.7 -43.5 24.9 12.6 9.8 109 109 A T H > S+ 0 0 124 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.962 109.1 49.7 -65.7 -52.1 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 0.925 116.1 43.7 -54.5 -48.7 25.9 16.4 5.8 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-2.6 1,-0.2 -1,-0.2 0.887 103.8 62.1 -64.3 -42.7 26.2 12.8 4.7 112 112 A A H 3< S+ 0 0 24 -4,-2.6 -1,-0.2 1,-0.3 3,-0.2 0.768 94.9 69.0 -55.8 -22.7 22.5 12.2 4.5 113 113 A G T << S+ 0 0 57 -4,-1.3 2,-0.5 -3,-0.7 -1,-0.3 0.483 74.5 83.6 -72.5 -5.9 22.8 15.0 1.8 114 114 A F <> + 0 0 38 -3,-2.6 4,-2.9 1,-0.2 3,-0.3 -0.191 55.1 154.2 -99.7 54.4 24.6 12.8 -0.7 115 115 A T H > + 0 0 85 -2,-0.5 4,-2.2 1,-0.3 -1,-0.2 0.790 66.7 46.6 -45.5 -58.5 21.4 11.2 -2.0 116 116 A N H > S+ 0 0 90 -3,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.893 115.5 46.1 -57.6 -44.1 22.4 10.2 -5.4 117 117 A S H > S+ 0 0 0 -3,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.869 110.5 53.2 -66.1 -44.7 25.7 8.6 -4.2 118 118 A L H X S+ 0 0 12 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.898 107.7 50.0 -59.4 -42.7 24.0 6.8 -1.4 119 119 A R H X S+ 0 0 113 -4,-2.2 4,-1.0 -5,-0.3 -2,-0.2 0.932 109.8 52.7 -65.6 -36.3 21.6 5.3 -3.7 120 120 A M H ><>S+ 0 0 23 -4,-2.1 5,-1.9 1,-0.2 3,-0.6 0.910 105.8 53.0 -65.8 -37.1 24.4 4.2 -6.0 121 121 A L H ><5S+ 0 0 4 -4,-2.4 3,-2.2 1,-0.2 -1,-0.2 0.948 103.8 57.9 -63.2 -40.2 26.2 2.6 -3.1 122 122 A Q H 3<5S+ 0 0 92 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.775 107.9 46.7 -58.7 -25.9 23.1 0.6 -2.3 123 123 A Q T <<5S- 0 0 88 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.328 113.3-114.8-100.5 9.7 23.1 -0.8 -5.8 124 124 A C T < 5 + 0 0 79 -3,-2.2 2,-1.0 -4,-0.2 3,-0.2 0.812 64.8 146.1 65.3 33.8 26.9 -1.7 -5.8 125 125 A R >< + 0 0 102 -5,-1.9 4,-3.3 1,-0.2 5,-0.2 -0.540 17.8 170.2-105.0 68.3 27.7 0.8 -8.6 126 126 A W H > S+ 0 0 56 -2,-1.0 4,-2.1 1,-0.3 -1,-0.2 0.862 70.3 44.5 -49.3 -46.6 31.2 1.6 -7.3 127 127 A D H > S+ 0 0 108 2,-0.2 4,-2.0 -3,-0.2 -1,-0.3 0.917 113.7 48.1 -73.2 -37.7 32.5 3.5 -10.2 128 128 A E H > S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.920 111.7 52.7 -68.6 -38.1 29.4 5.6 -10.7 129 129 A A H X S+ 0 0 1 -4,-3.3 4,-3.0 2,-0.2 -1,-0.2 0.909 105.9 52.7 -58.1 -41.3 29.4 6.3 -7.1 130 130 A A H X S+ 0 0 12 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.939 109.8 48.7 -64.9 -40.1 33.0 7.5 -7.0 131 131 A V H X S+ 0 0 89 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.894 112.4 47.5 -63.5 -45.8 32.4 10.0 -9.8 132 132 A N H >< S+ 0 0 35 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.923 108.6 54.5 -62.2 -44.3 29.3 11.3 -8.1 133 133 A L H 3< S+ 0 0 1 -4,-3.0 6,-0.4 1,-0.3 -1,-0.2 0.887 101.9 58.8 -55.5 -39.0 31.1 11.7 -4.7 134 134 A A H 3< S+ 0 0 27 -4,-1.7 2,-1.9 1,-0.2 -1,-0.3 0.679 86.6 80.4 -64.1 -19.9 33.9 13.8 -6.2 135 135 A K S << S+ 0 0 152 -3,-1.4 2,-0.3 -4,-0.5 -1,-0.2 -0.536 80.4 97.7 -88.4 69.6 31.4 16.3 -7.4 136 136 A S S > S- 0 0 16 -2,-1.9 4,-2.5 1,-0.1 5,-0.2 -0.997 85.8-115.8-155.5 152.8 31.1 18.0 -4.1 137 137 A R H > S+ 0 0 157 -2,-0.3 4,-2.6 2,-0.2 5,-0.3 0.916 117.1 61.0 -50.9 -43.2 32.4 20.8 -2.0 138 138 A W H > S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 8,-0.3 0.944 107.4 41.5 -50.7 -55.6 33.9 18.0 0.2 139 139 A Y H 4 S+ 0 0 62 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.896 116.6 49.7 -62.1 -42.6 36.1 16.7 -2.6 140 140 A N H < S+ 0 0 106 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.780 115.5 40.3 -74.6 -23.4 37.1 20.3 -3.8 141 141 A Q H < S+ 0 0 103 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.913 131.2 22.8 -87.8 -41.4 38.0 21.7 -0.4 142 142 A T S X S+ 0 0 20 -4,-2.1 4,-2.9 -5,-0.3 3,-0.2 -0.594 73.4 162.0-123.7 68.3 39.9 18.6 1.0 143 143 A P H > + 0 0 52 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.828 66.8 52.5 -60.6 -44.7 40.9 16.6 -2.0 144 144 A N H > S+ 0 0 104 2,-0.2 4,-1.3 1,-0.2 -5,-0.0 0.922 116.6 40.7 -66.1 -37.7 43.7 14.3 -0.7 145 145 A R H > S+ 0 0 23 -3,-0.2 4,-2.1 2,-0.2 3,-0.5 0.962 114.7 50.5 -68.3 -57.7 41.4 13.0 2.2 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-2.6 -8,-0.3 5,-0.2 0.914 107.6 56.2 -48.2 -42.9 38.3 12.8 -0.0 147 147 A K H X S+ 0 0 95 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.866 106.8 51.4 -56.1 -39.6 40.5 10.8 -2.7 148 148 A R H X S+ 0 0 66 -4,-1.3 4,-1.4 -3,-0.5 -1,-0.2 0.942 112.7 42.0 -61.3 -51.7 41.3 8.3 0.1 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.898 114.2 51.8 -65.5 -44.4 37.8 7.7 1.1 150 150 A I H X S+ 0 0 13 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.901 107.1 51.1 -60.0 -44.2 36.5 7.6 -2.3 151 151 A T H X S+ 0 0 31 -4,-2.3 4,-2.9 -5,-0.2 6,-0.3 0.833 107.1 56.7 -61.0 -33.3 39.0 5.0 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.881 108.2 45.8 -66.1 -37.8 38.0 3.0 -0.6 153 153 A F H < S+ 0 0 2 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.877 114.9 50.5 -67.3 -39.5 34.4 3.0 -1.8 154 154 A R H < S+ 0 0 101 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.940 123.9 22.5 -64.9 -48.5 35.5 2.2 -5.2 155 155 A T H < S- 0 0 45 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.578 83.5-136.6 -97.3 -20.4 37.7 -0.7 -4.5 156 156 A G S < S+ 0 0 17 -4,-1.7 2,-0.2 -5,-0.3 -62,-0.2 0.712 74.0 100.6 62.1 23.9 36.5 -2.1 -1.2 157 157 A T S S- 0 0 47 -6,-0.3 3,-0.3 -63,-0.1 -1,-0.2 -0.748 79.6-119.5-123.6 174.2 40.3 -2.6 -0.2 158 158 A W S >> S+ 0 0 40 -2,-0.2 3,-2.5 1,-0.2 4,-0.8 0.137 71.2 122.6-101.0 17.2 42.6 -0.4 2.1 159 159 A D G >4 + 0 0 98 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.786 64.9 58.3 -55.0 -27.0 45.0 0.3 -0.5 160 160 A A G 34 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.629 109.6 47.2 -76.4 -18.3 44.8 4.0 -0.3 161 161 A Y G <4 0 0 20 -3,-2.5 -1,-0.3 -13,-0.1 -2,-0.2 0.473 360.0 360.0-101.5 -8.3 45.8 3.8 3.2 162 162 A K << 0 0 159 -4,-0.8 -3,-0.1 -3,-0.7 -2,-0.1 0.494 360.0 360.0-111.6 360.0 48.6 1.5 2.5