==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-OCT-05 2B6X . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.D.COLLINS,M.L.QUILLIN,B.W.MATTHEWS,S.M.GRUNER . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8629.0 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 . 8 4.9 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 . 84 51.9 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 1 0 2 1 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 74 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 150.0 43.2 -1.9 9.0 2 2 A N > - 0 0 66 156,-0.0 4,-2.6 95,-0.0 5,-0.2 -0.914 360.0 -78.6-153.5-179.8 39.9 -0.8 10.6 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.835 125.7 51.6 -57.3 -37.5 37.8 2.4 11.1 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.940 113.0 42.8 -67.8 -48.3 39.9 3.6 14.0 5 5 A E H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.885 114.5 53.6 -64.4 -36.7 43.2 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 3,-0.2 0.973 112.8 41.4 -62.8 -55.8 41.5 4.8 9.0 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.4 0.827 109.7 58.6 -61.6 -33.2 40.3 7.9 10.8 8 8 A R H X S+ 0 0 98 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.900 109.8 45.4 -62.5 -38.3 43.6 8.2 12.8 9 9 A I H < S+ 0 0 85 -4,-2.0 -2,-0.2 -3,-0.2 -1,-0.2 0.937 117.9 42.8 -65.4 -47.1 45.4 8.5 9.3 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.820 125.4 31.3 -72.8 -32.9 42.8 10.9 8.0 11 11 A E H < S- 0 0 48 -4,-2.8 19,-0.3 -5,-0.2 -3,-0.2 0.750 91.1-155.2 -99.8 -26.8 42.5 13.2 11.0 12 12 A G < - 0 0 24 -4,-1.8 2,-0.3 -5,-0.4 -1,-0.2 -0.330 24.4 -89.3 78.7-170.0 46.0 12.9 12.6 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -2,-0.1 16,-0.2 -0.943 41.7 171.2-142.6 125.3 46.5 13.6 16.3 14 14 A R E -A 28 0A 148 14,-1.6 14,-2.5 -2,-0.3 4,-0.1 -0.996 20.1-158.5-135.6 133.6 47.2 16.9 18.0 15 15 A L E S+ 0 0 70 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.401 75.2 60.8 -93.0 -2.0 47.2 17.4 21.8 16 16 A K E S-C 57 0B 93 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.923 102.0 -83.3-124.2 151.1 46.6 21.2 21.8 17 17 A I E + 0 0 15 39,-1.9 2,-0.3 -2,-0.3 10,-0.2 -0.227 59.3 168.7 -52.6 134.3 43.6 23.1 20.4 18 18 A Y E -A 26 0A 24 8,-3.1 8,-2.9 -4,-0.1 2,-0.4 -0.878 37.2-103.4-142.2 170.2 44.0 23.6 16.6 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.865 34.6-139.7-100.4 137.2 42.0 24.8 13.7 20 20 A D > - 0 0 46 4,-2.4 3,-1.8 -2,-0.4 -1,-0.1 -0.032 43.0 -75.5 -83.7-166.4 40.7 22.1 11.3 21 21 A T T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.695 135.2 48.7 -70.9 -19.3 40.6 22.4 7.5 22 22 A E T 3 S- 0 0 73 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.442 122.9-103.6 -94.7 -3.8 37.6 24.7 7.7 23 23 A G S < S+ 0 0 37 -3,-1.8 2,-0.4 1,-0.3 -2,-0.1 0.618 75.3 139.2 89.0 15.4 39.2 27.0 10.4 24 24 A Y - 0 0 75 1,-0.1 -4,-2.4 9,-0.0 -1,-0.3 -0.788 61.9-101.1 -98.9 137.8 37.2 25.5 13.4 25 25 A Y E +AB 19 34A 30 9,-0.6 8,-2.7 11,-0.4 9,-1.1 -0.292 54.7 162.1 -55.4 130.7 38.7 24.8 16.8 26 26 A T E -AB 18 32A 2 -8,-2.9 -8,-3.1 6,-0.3 2,-0.3 -0.902 18.9-165.1-147.0 159.5 39.4 21.1 17.1 27 27 A I E > - B 0 31A 0 4,-1.9 4,-2.2 -2,-0.3 -12,-0.2 -0.978 52.2 -0.6-145.5 162.5 41.5 18.9 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.6 -2,-0.3 2,-0.9 -0.376 124.2 -4.1 71.2-130.9 42.8 15.3 19.4 29 29 A I T 4 S- 0 0 2 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.679 128.7 -53.7-103.7 72.4 41.7 13.1 16.5 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.828 83.3 161.0 65.0 31.9 39.5 15.5 14.6 31 31 A H E < -B 27 0A 31 -4,-2.2 -4,-1.9 -20,-0.1 -1,-0.2 -0.779 32.3-144.3 -85.5 102.6 37.2 16.2 17.7 32 32 A L E -B 26 0A 72 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.442 18.9-176.3 -68.9 130.6 35.5 19.5 16.7 33 33 A L E - 0 0 13 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.881 59.5 -25.9 -93.8 -47.9 35.0 21.8 19.7 34 34 A T E -B 25 0A 32 -9,-1.1 -9,-0.6 2,-0.1 -1,-0.4 -0.951 37.4-135.6-164.6 147.9 33.0 24.7 18.3 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.423 74.5 113.9 -82.3 -2.3 32.4 26.6 15.1 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.444 72.5-132.9 -72.8 142.5 32.8 29.9 17.0 37 37 A P S S+ 0 0 123 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.506 78.2 105.2 -69.8 -2.7 35.8 32.2 16.3 38 38 A S > - 0 0 49 1,-0.2 4,-1.5 2,-0.0 -2,-0.1 -0.695 56.2-163.2 -91.5 117.7 36.4 32.4 20.0 39 39 A L H > S+ 0 0 63 -2,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.817 94.6 55.9 -65.6 -29.5 39.3 30.5 21.5 40 40 A N H > S+ 0 0 125 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.860 104.3 53.4 -71.0 -34.5 37.8 30.9 25.0 41 41 A A H > S+ 0 0 32 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.877 110.5 48.0 -60.1 -37.4 34.6 29.3 23.7 42 42 A A H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.905 110.5 50.4 -70.6 -43.9 36.8 26.4 22.5 43 43 A K H X S+ 0 0 51 -4,-2.4 4,-1.9 2,-0.2 11,-0.3 0.893 111.2 49.0 -62.0 -40.1 38.6 26.1 25.8 44 44 A S H X S+ 0 0 73 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.899 111.4 48.7 -67.8 -40.0 35.3 26.0 27.6 45 45 A E H X S+ 0 0 63 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.902 111.4 52.2 -65.0 -39.4 33.9 23.3 25.3 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.854 108.1 48.0 -62.8 -41.8 37.1 21.4 25.8 47 47 A D H X>S+ 0 0 33 -4,-1.9 4,-2.4 2,-0.2 5,-1.0 0.897 112.9 50.9 -65.2 -40.2 36.9 21.5 29.6 48 48 A K H <5S+ 0 0 143 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.906 111.6 46.7 -59.0 -47.9 33.3 20.4 29.3 49 49 A A H <5S+ 0 0 41 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.854 122.0 35.5 -65.6 -37.7 34.2 17.4 27.0 50 50 A I H <5S- 0 0 35 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.701 101.8-127.1 -92.4 -26.9 37.1 16.2 29.2 51 51 A G T <5S+ 0 0 69 -4,-2.4 2,-0.3 1,-0.3 -3,-0.2 0.746 76.6 69.1 85.9 24.4 35.7 17.0 32.7 52 52 A R S - 0 0 10 -2,-0.9 3,-1.1 -11,-0.3 -1,-0.2 0.732 32.4-145.8 -95.5 -27.0 42.6 21.7 30.6 55 55 A N T 3 S- 0 0 115 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.920 75.3 -53.6 47.5 47.5 43.8 25.1 29.5 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.9 1,-0.1 2,-0.4 0.449 118.8 97.1 81.4 1.5 43.7 23.9 25.8 57 57 A V B < +C 16 0B 71 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.988 44.7 178.5-129.6 135.8 45.9 20.8 26.2 58 58 A I - 0 0 3 -43,-2.3 2,-0.1 -2,-0.4 -30,-0.1 -0.822 28.1-109.5-129.1 165.0 44.9 17.2 26.7 59 59 A T > - 0 0 69 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.441 32.8-105.9 -91.1 171.4 46.7 13.9 27.1 60 60 A K H > S+ 0 0 95 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.899 121.3 52.8 -63.8 -42.6 46.9 11.1 24.5 61 61 A D H > S+ 0 0 126 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.887 109.9 49.3 -57.0 -43.0 44.5 8.9 26.5 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.891 109.4 51.7 -64.3 -38.4 42.0 11.8 26.7 63 63 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -34,-0.5 0.905 111.3 47.9 -66.4 -37.9 42.3 12.3 22.9 64 64 A E H X S+ 0 0 72 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.802 107.4 56.1 -75.9 -28.1 41.7 8.6 22.3 65 65 A K H X S+ 0 0 139 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.951 109.6 44.4 -67.0 -48.6 38.7 8.7 24.7 66 66 A L H X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.915 112.2 55.2 -56.2 -42.1 37.0 11.5 22.7 67 67 A F H X S+ 0 0 12 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.925 106.7 49.1 -58.5 -47.2 37.9 9.6 19.5 68 68 A N H X S+ 0 0 86 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.891 112.7 48.3 -58.9 -42.1 36.2 6.4 20.7 69 69 A Q H X S+ 0 0 90 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.885 112.3 48.6 -65.2 -41.2 33.1 8.4 21.6 70 70 A D H X S+ 0 0 32 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.883 111.3 48.6 -71.0 -41.2 33.0 10.2 18.2 71 71 A V H X S+ 0 0 6 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.965 114.3 47.5 -61.8 -48.2 33.4 6.9 16.2 72 72 A D H X S+ 0 0 88 -4,-2.3 4,-2.8 -5,-0.2 -2,-0.2 0.934 113.0 48.2 -55.2 -50.2 30.6 5.4 18.3 73 73 A A H X S+ 0 0 43 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.870 109.3 52.7 -61.5 -38.3 28.4 8.5 17.8 74 74 A A H X S+ 0 0 8 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.956 111.6 46.3 -62.0 -48.3 29.1 8.5 14.0 75 75 A V H X S+ 0 0 32 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.948 113.8 48.3 -56.7 -51.0 28.0 4.8 13.8 76 76 A R H X S+ 0 0 119 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.883 108.0 54.7 -63.3 -35.1 24.9 5.5 16.0 77 77 A G H < S+ 0 0 4 -4,-2.5 4,-0.4 -5,-0.2 -1,-0.2 0.881 108.8 49.6 -63.1 -39.8 24.0 8.6 13.8 78 78 A I H >< S+ 0 0 2 -4,-2.1 3,-1.6 1,-0.2 7,-0.5 0.972 111.1 48.7 -56.0 -54.5 24.1 6.3 10.7 79 79 A L H 3< S+ 0 0 71 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.780 111.9 48.3 -64.8 -27.9 21.9 3.7 12.3 80 80 A R T 3< S+ 0 0 168 -4,-1.8 2,-0.6 -5,-0.2 -1,-0.3 0.488 93.3 91.8 -85.8 -6.2 19.3 6.2 13.5 81 81 A N <> - 0 0 19 -3,-1.6 4,-3.1 -4,-0.4 3,-0.2 -0.837 65.9-151.8-100.1 122.2 19.1 7.9 10.1 82 82 A A T 4 S+ 0 0 81 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.0 0.723 98.7 44.4 -62.3 -25.1 16.4 6.6 7.7 83 83 A K T 4 S+ 0 0 143 2,-0.1 4,-0.4 3,-0.1 -1,-0.2 0.782 120.2 38.8 -90.5 -28.9 18.4 7.6 4.7 84 84 A L T > S+ 0 0 8 -6,-0.2 4,-2.7 -7,-0.2 3,-0.2 0.843 104.3 65.0 -88.7 -40.7 21.8 6.3 5.9 85 85 A K H X S+ 0 0 88 -4,-3.1 4,-2.8 -7,-0.5 5,-0.3 0.932 100.2 47.8 -55.1 -54.6 20.9 3.1 7.7 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.858 114.2 48.0 -62.3 -28.6 19.6 1.0 4.7 87 87 A V H > S+ 0 0 7 -4,-0.4 4,-0.9 -3,-0.2 3,-0.4 0.938 112.8 48.6 -69.8 -46.5 22.7 2.0 2.7 88 88 A Y H >< S+ 0 0 32 -4,-2.7 3,-1.1 1,-0.2 -1,-0.2 0.930 109.2 52.1 -58.0 -48.3 25.0 1.1 5.6 89 89 A D H 3< S+ 0 0 72 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.816 107.5 54.8 -58.2 -29.5 23.3 -2.3 6.2 90 90 A S H 3< S+ 0 0 38 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.683 95.2 87.9 -78.5 -21.4 23.7 -3.2 2.5 91 91 A L S << S- 0 0 5 -3,-1.1 2,-0.0 -4,-0.9 31,-0.0 -0.431 77.3-115.7 -81.7 152.6 27.5 -2.6 2.5 92 92 A D > - 0 0 55 -2,-0.1 4,-2.0 1,-0.1 5,-0.2 -0.251 43.8 -91.8 -73.7 174.2 30.3 -5.0 3.3 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.813 122.2 48.4 -63.7 -36.5 32.6 -4.3 6.2 94 94 A V H > S+ 0 0 27 2,-0.2 4,-1.2 1,-0.2 3,-0.3 0.933 113.1 46.3 -74.6 -42.5 35.2 -2.3 4.5 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.802 104.9 61.9 -71.9 -26.7 32.8 0.1 2.7 96 96 A R H X S+ 0 0 78 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.898 99.8 55.7 -60.1 -39.0 30.9 0.5 6.0 97 97 A A H X S+ 0 0 6 -4,-1.2 4,-2.5 -3,-0.3 -2,-0.2 0.874 104.6 52.9 -59.8 -38.4 34.1 2.0 7.3 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.865 107.7 51.4 -63.9 -38.8 34.1 4.5 4.4 99 99 A A H X S+ 0 0 15 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.887 111.0 46.9 -63.8 -40.7 30.5 5.5 5.4 100 100 A I H X S+ 0 0 9 -4,-2.0 4,-3.2 2,-0.2 5,-0.2 0.924 108.3 56.6 -67.4 -42.8 31.5 6.1 9.0 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.946 108.8 46.7 -53.0 -52.6 34.6 8.1 7.9 102 102 A M H X S+ 0 0 4 -4,-2.2 4,-2.9 2,-0.2 5,-0.4 0.891 113.7 47.1 -55.9 -44.1 32.3 10.5 5.9 103 103 A V H X S+ 0 0 9 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.922 110.4 53.3 -68.0 -41.5 29.8 10.9 8.8 104 104 A F H < S+ 0 0 29 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.908 115.9 40.1 -54.1 -47.2 32.6 11.5 11.2 105 105 A Q H < S+ 0 0 53 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.908 134.6 13.9 -73.0 -47.0 34.0 14.3 9.0 106 106 A M H X S- 0 0 58 -4,-2.9 4,-0.5 -5,-0.2 -3,-0.2 0.526 103.4-115.1-117.8 -3.5 30.8 16.0 7.9 107 107 A G H X - 0 0 30 -4,-2.7 4,-2.2 -5,-0.4 5,-0.2 0.037 34.8 -72.8 87.8 163.2 28.0 14.8 10.1 108 108 A E H > S+ 0 0 57 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.840 128.9 49.6 -60.8 -41.5 24.8 12.8 9.6 109 109 A T H > S+ 0 0 125 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.916 109.2 51.6 -67.3 -48.0 23.0 15.6 7.8 110 110 A G H >< S+ 0 0 33 -4,-0.5 3,-1.6 2,-0.2 -2,-0.2 0.970 113.7 42.8 -51.0 -58.7 25.8 16.3 5.4 111 111 A V H >< S+ 0 0 6 -4,-2.2 3,-3.4 1,-0.3 -2,-0.2 0.941 104.9 62.1 -59.4 -50.9 26.2 12.7 4.3 112 112 A A H 3< S+ 0 0 19 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.681 95.0 66.6 -49.5 -19.8 22.4 12.1 4.0 113 113 A G T << S+ 0 0 58 -3,-1.6 2,-0.8 -4,-0.8 -1,-0.3 0.433 75.0 85.8 -77.6 -2.8 22.5 14.9 1.3 114 114 A F <> + 0 0 35 -3,-3.4 4,-2.9 1,-0.2 5,-0.2 -0.269 56.8 154.1 -90.0 50.6 24.6 12.6 -1.0 115 115 A T H > + 0 0 92 -2,-0.8 4,-1.9 1,-0.2 -1,-0.2 0.854 68.1 42.1 -49.4 -50.5 21.2 11.2 -2.1 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.903 115.3 49.2 -67.3 -44.3 22.4 10.1 -5.6 117 117 A S H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.884 110.0 52.6 -58.5 -44.3 25.7 8.6 -4.3 118 118 A L H X S+ 0 0 18 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.897 109.1 49.6 -62.2 -42.9 23.8 6.7 -1.5 119 119 A R H X S+ 0 0 123 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.928 112.2 47.1 -60.3 -49.0 21.4 5.2 -4.1 120 120 A M H <>S+ 0 0 32 -4,-2.3 5,-2.4 2,-0.2 4,-0.4 0.884 111.4 52.0 -62.1 -38.3 24.4 4.1 -6.3 121 121 A L H ><5S+ 0 0 3 -4,-2.7 3,-1.4 1,-0.2 -2,-0.2 0.946 108.5 50.1 -62.9 -45.4 26.1 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 92 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.847 112.0 48.4 -59.5 -34.5 23.0 0.7 -2.3 123 123 A Q T 3<5S- 0 0 86 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.451 112.5-122.0 -85.5 -3.8 22.8 -0.7 -5.9 124 124 A K T < 5 + 0 0 102 -3,-1.4 2,-1.2 -4,-0.4 -3,-0.2 0.805 61.6 147.7 61.7 37.6 26.6 -1.5 -5.8 125 125 A R >< + 0 0 117 -5,-2.4 4,-2.3 1,-0.2 -1,-0.2 -0.691 20.7 171.3 -95.1 75.6 27.3 0.6 -8.9 126 126 A W H > + 0 0 50 -2,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.883 67.3 46.9 -63.4 -48.8 30.8 1.4 -7.4 127 127 A D H > S+ 0 0 110 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.913 115.5 48.1 -62.2 -41.4 32.5 3.2 -10.3 128 128 A E H > S+ 0 0 105 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.853 110.3 50.3 -66.9 -37.3 29.4 5.4 -10.7 129 129 A A H X S+ 0 0 0 -4,-2.3 4,-3.2 2,-0.2 5,-0.2 0.910 109.0 53.5 -62.9 -43.9 29.1 6.2 -7.0 130 130 A A H X S+ 0 0 10 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.937 109.3 47.2 -57.3 -52.0 32.8 7.2 -7.0 131 131 A V H < S+ 0 0 91 -4,-2.2 4,-0.4 1,-0.2 3,-0.3 0.931 115.9 45.2 -55.5 -47.2 32.3 9.6 -9.9 132 132 A N H >< S+ 0 0 41 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.898 108.2 56.2 -67.8 -39.1 29.2 11.1 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.2 6,-0.4 1,-0.3 -1,-0.2 0.815 103.6 56.8 -56.8 -34.6 30.9 11.4 -4.7 134 134 A A T 3< S+ 0 0 26 -4,-1.4 2,-1.5 -3,-0.3 -1,-0.3 0.571 85.9 79.4 -77.3 -16.7 33.7 13.4 -6.2 135 135 A K S < S+ 0 0 157 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.2 -0.631 81.5 100.5 -87.0 71.2 31.3 16.1 -7.6 136 136 A S S > S- 0 0 16 -2,-1.5 4,-2.1 1,-0.1 5,-0.2 -0.993 85.4-118.2-154.7 149.5 31.1 17.7 -4.2 137 137 A R H > S+ 0 0 147 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.906 116.0 63.7 -54.5 -40.9 32.4 20.6 -2.1 138 138 A W H > S+ 0 0 14 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.919 106.1 41.2 -45.9 -53.0 33.7 17.8 0.1 139 139 A Y H 4 S+ 0 0 61 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.870 114.7 51.2 -70.7 -37.4 36.0 16.5 -2.6 140 140 A N H < S+ 0 0 110 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.824 114.8 41.6 -73.6 -26.9 37.1 19.9 -3.8 141 141 A Q H < S+ 0 0 104 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.845 132.4 20.5 -86.5 -36.1 38.1 21.2 -0.3 142 142 A T S X S+ 0 0 21 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 -0.603 73.2 161.1-130.6 68.0 39.8 18.0 0.9 143 143 A P H > S+ 0 0 47 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.870 70.9 51.5 -60.2 -40.5 40.7 16.1 -2.3 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.940 116.6 39.7 -68.2 -43.7 43.4 13.7 -0.9 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.937 116.7 50.1 -62.6 -51.8 41.2 12.5 2.0 146 146 A A H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.918 108.2 53.8 -56.3 -44.0 38.1 12.3 -0.1 147 147 A K H X S+ 0 0 97 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.864 108.0 50.2 -58.2 -38.9 40.0 10.3 -2.8 148 148 A R H X S+ 0 0 68 -4,-1.4 4,-1.4 2,-0.2 12,-0.2 0.914 114.2 43.6 -65.9 -43.3 41.1 7.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.914 114.6 50.0 -67.8 -44.2 37.5 7.4 1.1 150 150 A I H X S+ 0 0 12 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.899 108.4 52.5 -60.7 -44.3 36.1 7.2 -2.4 151 151 A T H X S+ 0 0 34 -4,-2.4 4,-2.5 2,-0.2 6,-0.4 0.823 107.0 54.3 -57.9 -36.6 38.7 4.6 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.900 111.8 43.0 -65.5 -44.1 37.5 2.5 -0.4 153 153 A F H < S+ 0 0 4 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.875 115.4 50.7 -67.9 -38.5 33.9 2.7 -1.6 154 154 A R H < S+ 0 0 103 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.941 126.9 20.0 -65.4 -45.4 35.0 2.0 -5.2 155 155 A T H < S- 0 0 40 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.635 84.9-135.6-100.9 -22.7 37.1 -1.1 -4.4 156 156 A G S < S+ 0 0 17 -4,-2.3 2,-0.3 -5,-0.3 -62,-0.2 0.779 73.6 103.7 63.0 26.5 36.0 -2.4 -1.0 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.815 80.7-120.4-128.0 172.1 39.7 -2.8 -0.1 158 158 A W S >> S+ 0 0 42 -2,-0.3 3,-2.1 1,-0.2 4,-0.7 0.164 71.2 122.9 -96.7 18.7 42.1 -0.8 2.1 159 159 A D G >4 + 0 0 93 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.828 67.4 56.2 -54.7 -38.3 44.4 -0.1 -0.8 160 160 A A G 34 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.698 111.7 45.2 -69.2 -16.5 44.3 3.7 -0.4 161 161 A Y G <4 0 0 19 -3,-2.1 -1,-0.2 -13,-0.1 -2,-0.2 0.503 360.0 360.0-104.3 -5.0 45.4 3.4 3.2 162 162 A K << 0 0 176 -3,-0.9 -2,-0.1 -4,-0.7 -3,-0.1 0.855 360.0 360.0 -97.1 360.0 48.2 0.9 2.7