==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 06-MAY-91 1L55 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR H.NICHOLSON,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8517.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 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 . 12 7.4 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 1 0 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 76 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 138.1 43.9 -1.7 8.7 2 2 A N > - 0 0 67 95,-0.0 4,-2.1 92,-0.0 3,-0.5 -0.915 360.0 -88.9-143.0 173.0 40.7 -0.8 10.7 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.815 123.9 54.0 -54.9 -41.0 38.6 2.3 11.0 4 4 A F H > S+ 0 0 77 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.886 112.3 42.5 -63.3 -41.7 40.7 3.6 14.0 5 5 A E H > S+ 0 0 100 -3,-0.5 4,-1.4 2,-0.2 -2,-0.2 0.738 113.9 53.8 -75.0 -26.6 44.0 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.946 112.2 41.5 -72.6 -49.9 42.4 4.8 9.0 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 5,-0.3 0.827 108.9 59.1 -66.8 -34.4 41.1 7.8 10.8 8 8 A R H X S+ 0 0 103 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.927 108.6 48.1 -65.1 -34.0 44.3 8.3 12.8 9 9 A I H < S+ 0 0 85 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.937 114.9 43.8 -66.3 -45.1 46.0 8.6 9.4 10 10 A D H < S+ 0 0 19 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.770 125.9 28.9 -73.6 -28.7 43.4 11.1 8.0 11 11 A E H < S- 0 0 39 -4,-2.1 19,-0.4 -5,-0.2 -2,-0.2 0.706 90.2-153.4-106.9 -28.9 43.2 13.3 11.0 12 12 A G < - 0 0 23 -4,-1.9 2,-0.4 -5,-0.3 -1,-0.1 -0.194 26.2 -83.9 78.8-169.8 46.6 13.1 12.7 13 13 A L + 0 0 43 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.967 41.9 173.6-138.9 121.1 47.1 13.7 16.5 14 14 A R E -A 28 0A 134 14,-1.5 14,-2.6 -2,-0.4 4,-0.1 -0.999 18.4-164.2-130.8 128.7 47.6 17.1 18.2 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.392 75.7 60.1 -88.7 0.7 47.8 17.6 21.9 16 16 A K E S-C 57 0B 98 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.932 100.4 -88.0-129.8 148.5 47.2 21.3 21.8 17 17 A I E + 0 0 16 39,-1.3 2,-0.3 -2,-0.3 10,-0.2 -0.270 56.9 169.2 -53.1 139.0 44.2 23.2 20.4 18 18 A Y E -A 26 0A 31 8,-2.5 8,-2.9 -4,-0.1 2,-0.4 -0.921 34.7-102.3-146.0 172.1 44.7 23.9 16.8 19 19 A K E -A 25 0A 126 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.808 30.9-133.7-101.7 140.9 42.7 25.1 14.0 20 20 A D > - 0 0 48 4,-3.2 3,-1.9 -2,-0.4 -1,-0.1 -0.116 39.4 -89.0 -77.7-176.7 41.3 22.8 11.4 21 21 A T T 3 S+ 0 0 99 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.825 132.2 52.3 -59.7 -32.1 41.6 23.4 7.7 22 22 A E T 3 S- 0 0 63 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.391 124.6-104.7 -84.4 0.4 38.3 25.3 8.0 23 23 A G S < S+ 0 0 34 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.557 74.9 139.4 86.3 13.0 39.7 27.4 10.7 24 24 A Y - 0 0 78 1,-0.1 -4,-3.2 -5,-0.0 2,-0.3 -0.716 59.6-104.6 -95.6 148.6 37.8 25.7 13.5 25 25 A Y E +AB 19 34A 31 9,-0.8 8,-3.1 11,-0.4 9,-1.2 -0.441 51.2 163.2 -66.9 126.3 39.2 24.8 16.9 26 26 A T E -AB 18 32A 4 -8,-2.9 -8,-2.5 -2,-0.3 2,-0.3 -0.858 18.0-165.7-136.3 164.3 40.0 21.2 17.2 27 27 A I E > - B 0 31A 0 4,-1.3 4,-1.9 -2,-0.3 -12,-0.2 -0.979 51.6 -3.9-148.2 162.3 42.1 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.5 -2,-0.3 2,-1.1 -0.338 123.2 -3.9 62.0-130.8 43.5 15.3 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.594 128.1 -51.9 -95.8 76.4 42.4 13.1 16.6 30 30 A G T 4 S+ 0 0 14 -2,-1.1 2,-1.2 -19,-0.4 -2,-0.2 0.784 83.4 159.5 70.7 20.4 40.0 15.4 14.6 31 31 A H E < -B 27 0A 31 -4,-1.9 -4,-1.3 1,-0.0 -1,-0.2 -0.619 34.4-142.9 -82.2 99.6 37.8 16.3 17.6 32 32 A L E -B 26 0A 70 -2,-1.2 -6,-0.3 -6,-0.2 3,-0.1 -0.283 19.6-176.7 -56.5 126.1 36.0 19.4 16.7 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.914 57.6 -30.0 -91.5 -48.2 35.7 21.7 19.7 34 34 A T E -B 25 0A 29 -9,-1.2 -9,-0.8 2,-0.1 -1,-0.4 -0.952 35.5-137.1-165.9 152.8 33.6 24.6 18.5 35 35 A K S S+ 0 0 134 -2,-0.3 7,-0.0 -11,-0.2 -1,-0.0 0.474 72.3 113.5 -93.9 -6.8 32.9 26.6 15.4 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.389 72.4-131.2 -67.6 141.3 33.1 29.8 17.4 37 37 A P S S+ 0 0 124 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.659 76.7 105.8 -68.7 -13.0 36.0 32.2 16.6 38 38 A S > - 0 0 47 1,-0.2 4,-1.2 2,-0.1 3,-0.5 -0.588 56.9-159.9 -79.6 122.6 36.8 32.5 20.3 39 39 A L H > S+ 0 0 72 -2,-0.6 4,-1.7 1,-0.3 -1,-0.2 0.795 97.1 53.4 -65.3 -27.7 39.8 30.7 21.6 40 40 A N H > S+ 0 0 122 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.802 102.8 54.5 -78.7 -27.1 38.2 30.9 25.0 41 41 A A H > S+ 0 0 36 -3,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.752 110.0 49.5 -74.5 -15.9 35.1 29.4 23.9 42 42 A A H X S+ 0 0 0 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.858 108.5 51.1 -82.5 -39.2 37.2 26.5 22.7 43 43 A K H X S+ 0 0 49 -4,-1.7 4,-1.6 2,-0.2 11,-0.3 0.827 108.9 53.2 -67.3 -29.9 39.1 26.2 25.9 44 44 A S H X S+ 0 0 70 -4,-1.5 4,-2.0 2,-0.2 5,-0.2 0.939 110.0 45.4 -65.6 -54.3 35.7 26.1 27.7 45 45 A E H X S+ 0 0 62 -4,-1.4 4,-2.6 1,-0.2 5,-0.2 0.903 111.5 54.8 -58.3 -43.0 34.3 23.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.924 108.2 46.4 -59.9 -44.9 37.6 21.4 25.9 47 47 A D H X>S+ 0 0 35 -4,-1.6 4,-2.0 1,-0.2 5,-1.0 0.854 113.4 50.6 -67.8 -32.5 37.5 21.5 29.7 48 48 A K H <5S+ 0 0 147 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.894 110.8 49.0 -66.6 -47.7 33.9 20.4 29.7 49 49 A A H <5S+ 0 0 45 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.895 120.5 35.8 -62.0 -39.1 34.7 17.5 27.4 50 50 A I H <5S- 0 0 36 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.713 99.6-126.2 -90.4 -30.2 37.7 16.3 29.6 51 51 A G T <5S+ 0 0 71 -4,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.793 77.2 76.1 88.4 22.7 36.5 17.1 33.1 52 52 A R S - 0 0 6 -2,-1.1 3,-1.9 -11,-0.3 -1,-0.2 0.714 31.3-147.0 -89.7 -17.5 43.2 21.8 30.7 55 55 A N T 3 S- 0 0 117 1,-0.3 -2,-0.1 -12,-0.1 3,-0.1 0.904 75.7 -59.0 51.0 38.8 44.6 25.2 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.3 1,-0.1 2,-0.4 0.519 116.8 103.4 71.8 7.6 44.3 23.9 26.0 57 57 A V B < +C 16 0B 66 -3,-1.9 2,-0.3 -41,-0.2 -41,-0.2 -0.968 43.7 179.2-128.2 135.3 46.5 21.0 26.4 58 58 A I - 0 0 4 -43,-2.5 2,-0.1 -2,-0.4 -30,-0.1 -0.828 26.0-112.5-128.3 164.0 45.7 17.3 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.409 34.2-107.7 -86.7 163.8 47.5 13.9 27.2 60 60 A K H > S+ 0 0 103 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.898 121.7 55.4 -59.0 -43.1 47.6 11.2 24.5 61 61 A D H > S+ 0 0 118 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.879 106.6 49.3 -55.6 -47.6 45.3 9.1 26.7 62 62 A E H > S+ 0 0 36 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.840 110.4 52.8 -61.4 -38.6 42.7 12.0 26.8 63 63 A A H X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.2 -34,-0.4 0.849 109.3 46.3 -66.3 -40.4 43.0 12.2 23.0 64 64 A E H X S+ 0 0 74 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.792 108.1 57.9 -74.6 -26.5 42.3 8.6 22.4 65 65 A K H X S+ 0 0 140 -4,-1.4 4,-1.9 -5,-0.2 -2,-0.2 0.941 108.9 44.5 -67.6 -42.0 39.4 8.7 24.9 66 66 A L H X S+ 0 0 3 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.844 112.2 54.7 -67.5 -35.8 37.8 11.5 22.8 67 67 A F H X S+ 0 0 15 -4,-1.6 4,-2.4 2,-0.2 5,-0.3 0.933 105.4 51.2 -66.3 -44.6 38.6 9.4 19.7 68 68 A N H X S+ 0 0 90 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.922 112.3 47.4 -57.7 -42.1 36.8 6.3 21.0 69 69 A Q H X S+ 0 0 94 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.841 111.8 48.9 -65.6 -40.8 33.7 8.3 21.8 70 70 A D H X S+ 0 0 36 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.818 112.3 47.6 -73.6 -34.2 33.6 10.0 18.4 71 71 A V H X S+ 0 0 8 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.952 114.6 46.7 -69.3 -45.9 34.0 6.8 16.5 72 72 A D H X S+ 0 0 87 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.962 114.6 47.6 -55.6 -48.1 31.3 5.2 18.7 73 73 A A H X S+ 0 0 44 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.919 110.8 53.1 -59.2 -44.2 29.1 8.3 18.1 74 74 A A H X S+ 0 0 8 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.978 111.4 43.5 -57.0 -59.0 29.8 8.2 14.4 75 75 A V H X S+ 0 0 34 -4,-2.9 4,-2.0 1,-0.2 3,-0.2 0.933 114.2 51.1 -52.6 -51.9 28.8 4.5 14.0 76 76 A R H X S+ 0 0 115 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.874 107.5 53.3 -56.2 -37.9 25.6 5.0 16.2 77 77 A G H X S+ 0 0 2 -4,-2.3 4,-0.7 -5,-0.2 -1,-0.2 0.898 108.3 50.7 -67.0 -35.3 24.5 8.0 14.2 78 78 A I H >< S+ 0 0 0 -4,-1.6 3,-0.6 -3,-0.2 7,-0.4 0.925 110.8 47.2 -63.4 -46.6 24.7 6.0 11.0 79 79 A L H 3< S+ 0 0 73 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.708 114.2 49.2 -70.4 -21.4 22.7 3.2 12.5 80 80 A R H 3< S+ 0 0 169 -4,-1.4 2,-0.5 -5,-0.2 -1,-0.2 0.455 92.3 92.0 -93.0 -13.3 20.1 5.8 13.8 81 81 A N S+ 0 0 119 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.826 118.3 41.3 -85.5 -37.3 19.0 7.4 5.2 84 84 A L H >> S+ 0 0 0 -7,-0.2 4,-2.3 1,-0.2 3,-0.6 0.888 100.6 67.2 -82.4 -40.1 22.4 6.1 6.2 85 85 A K H 3X S+ 0 0 81 -4,-2.4 4,-2.6 -7,-0.4 5,-0.3 0.877 98.5 50.1 -49.5 -49.3 21.6 2.8 7.8 86 86 A P H 3> S+ 0 0 52 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.873 111.5 49.8 -63.5 -31.1 20.4 1.0 4.6 87 87 A V H << S+ 0 0 3 -3,-0.6 4,-0.5 -4,-0.5 3,-0.3 0.957 111.1 48.4 -70.9 -46.0 23.5 2.1 2.8 88 88 A Y H >< S+ 0 0 33 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.924 109.8 52.3 -56.7 -49.1 25.8 0.8 5.6 89 89 A D H 3< S+ 0 0 80 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.802 107.2 54.7 -60.8 -28.9 24.0 -2.6 5.8 90 90 A S T 3< S+ 0 0 35 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.609 98.0 81.9 -80.7 -10.5 24.5 -3.0 2.2 91 91 A L S < S- 0 0 7 -3,-1.6 31,-0.0 -4,-0.5 2,-0.0 -0.595 75.3-116.7 -98.9 160.9 28.2 -2.5 2.2 92 92 A N > - 0 0 72 -2,-0.2 4,-1.8 1,-0.1 5,-0.1 -0.150 44.5 -88.9 -81.8-177.2 31.2 -4.7 2.9 93 93 A A H > S+ 0 0 79 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.851 123.3 46.4 -62.4 -40.8 33.6 -4.1 5.8 94 94 A V H > S+ 0 0 24 62,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.952 114.9 45.9 -69.6 -47.1 36.0 -1.8 4.0 95 95 A R H > S+ 0 0 20 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.791 107.1 59.6 -65.8 -29.1 33.4 0.3 2.5 96 96 A R H X S+ 0 0 78 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.910 103.7 51.7 -63.2 -42.9 31.6 0.5 5.8 97 97 A A H X S+ 0 0 6 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.894 106.1 55.3 -50.5 -48.5 34.8 2.0 7.2 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.860 109.0 46.2 -58.7 -41.1 34.8 4.6 4.3 99 99 A L H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 5,-0.2 0.891 111.6 51.5 -72.8 -36.1 31.2 5.7 5.2 100 100 A I H X S+ 0 0 8 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.949 107.0 55.0 -65.5 -39.8 32.2 5.9 8.9 101 101 A N H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 5,-0.3 0.966 108.6 47.3 -53.9 -55.4 35.1 8.1 7.9 102 102 A M H X S+ 0 0 2 -4,-2.0 4,-3.1 1,-0.2 5,-0.3 0.870 111.9 49.8 -49.6 -48.8 32.9 10.5 6.1 103 103 A V H X S+ 0 0 8 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.894 109.0 52.4 -63.9 -40.6 30.4 10.7 9.0 104 104 A F H < S+ 0 0 30 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.924 117.4 37.6 -60.1 -43.3 33.2 11.4 11.4 105 105 A Q H < S+ 0 0 58 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.883 133.2 22.1 -76.9 -38.6 34.5 14.3 9.3 106 106 A M H X S- 0 0 50 -4,-3.1 4,-0.6 -5,-0.3 -3,-0.2 0.501 102.2-113.1-115.3 0.9 31.3 15.7 8.2 107 107 A G H X - 0 0 33 -4,-2.3 4,-2.7 -5,-0.3 5,-0.2 0.166 32.2 -86.6 80.0 148.1 28.5 14.8 10.4 108 108 A E H > S+ 0 0 51 1,-0.2 4,-3.2 2,-0.2 5,-0.1 0.885 126.4 52.0 -59.9 -44.4 25.5 12.5 9.8 109 109 A T H > S+ 0 0 119 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.900 110.2 48.2 -61.5 -44.4 23.5 15.3 8.4 110 110 A G H >< S+ 0 0 34 -4,-0.6 3,-1.2 2,-0.2 4,-0.2 0.963 115.5 43.3 -62.3 -52.2 26.1 16.4 6.0 111 111 A V H >< S+ 0 0 0 -4,-2.7 3,-2.8 1,-0.3 -2,-0.2 0.941 106.5 61.7 -60.9 -41.5 26.7 12.9 4.7 112 112 A A H 3< S+ 0 0 11 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.790 95.2 65.0 -55.0 -26.2 23.0 12.2 4.6 113 113 A G T << S+ 0 0 55 -3,-1.2 2,-1.3 -4,-1.0 -1,-0.3 0.495 73.6 89.3 -75.2 -5.7 22.9 15.1 2.0 114 114 A F <> + 0 0 43 -3,-2.8 4,-2.3 -4,-0.2 5,-0.3 -0.310 55.0 158.5 -87.4 52.4 24.9 13.1 -0.5 115 115 A T H > + 0 0 82 -2,-1.3 4,-1.7 1,-0.2 -1,-0.2 0.830 66.9 43.5 -44.2 -52.7 21.6 11.7 -1.9 116 116 A N H > S+ 0 0 83 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.923 114.7 48.5 -67.4 -43.1 22.8 10.7 -5.3 117 117 A S H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.879 110.9 51.2 -63.1 -44.3 26.1 9.2 -4.2 118 118 A L H X S+ 0 0 13 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.913 109.8 50.6 -60.8 -40.3 24.4 7.1 -1.5 119 119 A R H X S+ 0 0 115 -4,-1.7 4,-1.1 -5,-0.3 -2,-0.2 0.894 110.4 48.9 -64.1 -39.1 22.0 5.8 -4.0 120 120 A M H <>S+ 0 0 24 -4,-2.2 5,-2.5 2,-0.2 -1,-0.2 0.865 111.6 49.1 -71.7 -34.2 24.8 4.9 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.3 3,-2.4 1,-0.2 -2,-0.2 0.935 106.9 55.0 -71.4 -40.5 26.7 3.1 -3.5 122 122 A Q H 3<5S+ 0 0 92 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.840 109.7 47.9 -60.4 -25.8 23.6 1.2 -2.5 123 123 A Q T 3<5S- 0 0 82 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.181 114.2-120.7 -96.0 10.1 23.3 -0.0 -6.1 124 124 A K T < 5 + 0 0 99 -3,-2.4 2,-1.2 1,-0.2 -3,-0.2 0.768 61.0 149.8 57.5 34.2 27.0 -0.9 -6.1 125 125 A R >< + 0 0 110 -5,-2.5 4,-2.2 1,-0.2 5,-0.2 -0.680 18.6 173.1 -97.0 77.4 27.9 1.4 -9.0 126 126 A W H > + 0 0 49 -2,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.866 69.7 45.7 -54.9 -53.4 31.4 2.0 -7.7 127 127 A D H > S+ 0 0 111 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.901 115.4 48.7 -64.0 -38.8 33.0 3.9 -10.5 128 128 A E H > S+ 0 0 109 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.892 109.8 50.0 -71.5 -35.6 30.0 6.1 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.905 107.2 55.7 -66.4 -41.9 29.8 6.9 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.900 109.5 46.3 -55.7 -45.2 33.4 7.8 -7.1 131 131 A V H >X S+ 0 0 91 -4,-1.8 3,-0.6 2,-0.2 4,-0.6 0.947 115.3 46.0 -63.0 -48.9 32.8 10.4 -9.9 132 132 A N H >< S+ 0 0 42 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.890 107.4 56.9 -65.4 -36.3 29.7 11.8 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.0 6,-0.3 1,-0.2 -1,-0.2 0.831 100.8 60.0 -64.8 -26.7 31.5 12.0 -4.7 134 134 A A H << S+ 0 0 26 -4,-1.0 2,-1.7 -3,-0.6 -1,-0.2 0.663 85.5 78.4 -77.9 -15.7 34.2 14.2 -6.3 135 135 A K S << S+ 0 0 154 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.535 80.2 101.1 -89.3 70.3 31.8 16.9 -7.3 136 136 A S S > S- 0 0 16 -2,-1.7 4,-1.8 1,-0.1 3,-0.3 -0.998 84.7-117.6-149.5 156.6 31.5 18.4 -3.9 137 137 A R H > S+ 0 0 161 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.881 115.3 62.6 -56.6 -38.7 32.8 21.1 -1.7 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.911 103.6 43.8 -52.4 -49.2 34.3 18.3 0.4 139 139 A Y H 4 S+ 0 0 59 -6,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.884 114.3 50.3 -67.1 -42.5 36.6 17.0 -2.3 140 140 A N H < S+ 0 0 117 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.873 114.5 44.6 -64.1 -37.1 37.7 20.6 -3.3 141 141 A Q H < S+ 0 0 73 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.742 131.4 17.3 -78.6 -36.8 38.5 21.5 0.3 142 142 A T S X S+ 0 0 27 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 -0.468 75.0 164.7-138.8 64.8 40.4 18.3 1.4 143 143 A P H > + 0 0 48 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.801 69.6 49.0 -56.9 -40.6 41.3 16.7 -1.8 144 144 A N H > S+ 0 0 113 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.928 116.5 42.5 -70.7 -39.7 43.9 14.2 -0.6 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.948 114.4 51.9 -64.9 -50.0 41.8 12.8 2.2 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 -8,-0.2 5,-0.2 0.925 108.5 50.5 -54.1 -48.2 38.8 12.8 -0.0 147 147 A K H X S+ 0 0 86 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.875 109.3 52.0 -58.6 -38.4 40.6 10.8 -2.8 148 148 A R H X S+ 0 0 69 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.936 113.5 42.7 -63.0 -45.4 41.7 8.3 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.926 115.2 50.4 -65.3 -44.5 38.1 7.9 0.9 150 150 A I H X S+ 0 0 13 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.847 108.9 50.8 -57.5 -41.1 36.8 7.8 -2.6 151 151 A T H X S+ 0 0 37 -4,-2.2 4,-3.2 2,-0.2 5,-0.5 0.873 106.7 56.0 -67.7 -38.1 39.3 5.2 -3.7 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.901 110.9 43.1 -61.8 -43.5 38.3 3.1 -0.8 153 153 A F H < S+ 0 0 1 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.911 116.4 49.0 -68.0 -39.8 34.7 3.1 -1.9 154 154 A R H < S+ 0 0 106 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.937 124.1 26.4 -65.7 -46.9 35.8 2.6 -5.6 155 155 A T H < S- 0 0 43 -4,-3.2 -3,-0.2 2,-0.2 -1,-0.2 0.693 87.7-138.3 -90.0 -28.3 38.1 -0.4 -5.0 156 156 A G S < S+ 0 0 15 -4,-1.9 -62,-0.2 -5,-0.5 2,-0.2 0.672 71.4 100.3 74.5 12.4 36.7 -1.9 -1.9 157 157 A T S S- 0 0 48 -6,-0.3 3,-0.3 -5,-0.1 -1,-0.3 -0.658 80.8-118.0-122.0 178.2 40.3 -2.4 -0.6 158 158 A W S > S+ 0 0 43 -2,-0.2 3,-2.4 1,-0.2 4,-0.1 0.186 74.6 118.8-100.1 10.0 42.7 -0.5 1.9 159 159 A D G > + 0 0 92 1,-0.3 3,-2.4 2,-0.2 -1,-0.2 0.859 64.4 61.3 -49.3 -43.6 45.2 0.3 -0.8 160 160 A A G 3 S+ 0 0 35 1,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.690 108.7 46.5 -60.5 -13.9 44.9 4.1 -0.5 161 161 A Y G < 0 0 17 -3,-2.4 -1,-0.3 -13,-0.1 -2,-0.2 0.191 360.0 360.0-112.4 11.5 46.1 3.7 3.0 162 162 A K < 0 0 178 -3,-2.4 -2,-0.2 -4,-0.1 -3,-0.1 0.695 360.0 360.0-118.4 360.0 49.0 1.4 2.3