==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-MAY-02 1LWG . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR N.C.GASSNER,W.A.BAASE,B.H.M.MOOERS,R.D.BUSAM,L.H.WEAVER, . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8706.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 71.0 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 . 6 3.7 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 . 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 1 2 0 0 1 1 0 0 0 0 0 1 0 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 65 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 147.6 43.3 -1.7 7.6 2 2 A N > - 0 0 67 95,-0.0 4,-2.6 1,-0.0 5,-0.3 -0.939 360.0 -87.5-151.9 169.3 40.2 -0.9 9.6 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.840 125.2 51.0 -52.6 -36.6 38.0 2.1 10.1 4 4 A F H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.950 112.9 42.6 -69.4 -47.0 40.2 3.3 13.0 5 5 A E H > S+ 0 0 99 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.843 115.0 53.8 -65.5 -30.5 43.4 3.2 11.1 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.960 112.3 41.2 -67.5 -55.7 41.7 4.7 8.0 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.3 5,-0.4 0.874 110.1 58.8 -63.7 -32.3 40.4 7.7 9.9 8 8 A R H X S+ 0 0 105 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.910 109.6 44.7 -63.2 -37.0 43.6 8.1 11.8 9 9 A I H < S+ 0 0 79 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.915 117.5 44.9 -72.4 -42.8 45.4 8.5 8.4 10 10 A D H < S+ 0 0 16 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.830 122.0 34.7 -72.3 -30.2 42.8 10.8 7.1 11 11 A E H < S- 0 0 34 -4,-2.7 19,-0.4 -5,-0.2 -3,-0.2 0.755 92.4-151.9 -94.9 -29.3 42.4 13.0 10.1 12 12 A G < - 0 0 26 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.256 23.3 -88.6 80.3 177.7 45.8 13.1 11.5 13 13 A L + 0 0 57 16,-0.2 2,-0.3 -4,-0.1 16,-0.2 -0.990 43.9 169.5-136.6 121.9 46.6 13.6 15.2 14 14 A R E -A 28 0A 118 14,-1.9 14,-2.8 -2,-0.4 4,-0.1 -0.994 18.3-164.9-137.5 123.5 47.0 17.1 16.8 15 15 A L E S+ 0 0 65 -2,-0.3 43,-2.5 12,-0.2 2,-0.4 0.498 74.9 63.5 -87.7 -7.9 47.2 17.6 20.6 16 16 A K E S-C 57 0B 83 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.890 99.6 -92.5-121.6 150.7 46.7 21.2 20.4 17 17 A I E + 0 0 1 39,-2.1 2,-0.3 -2,-0.4 10,-0.2 -0.295 53.7 166.7 -57.1 139.8 43.6 23.0 19.2 18 18 A Y E -A 26 0A 50 8,-3.4 8,-3.3 -4,-0.1 2,-0.5 -0.844 35.2-104.6-144.6 178.1 43.9 23.9 15.6 19 19 A K E -A 25 0A 123 6,-0.3 6,-0.2 -2,-0.3 5,-0.1 -0.934 29.3-137.4-113.5 135.2 41.6 25.1 12.7 20 20 A D > - 0 0 51 4,-2.4 3,-2.0 -2,-0.5 -1,-0.1 -0.027 46.0 -77.0 -74.8-173.2 40.4 22.7 9.9 21 21 A T T 3 S+ 0 0 88 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.815 133.5 49.1 -57.7 -30.7 40.4 23.7 6.2 22 22 A E T 3 S- 0 0 70 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.275 123.3 -99.6 -93.5 10.3 37.1 25.8 6.8 23 23 A G S < S+ 0 0 32 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.465 74.8 141.5 91.5 -3.6 38.4 27.7 9.8 24 24 A Y - 0 0 62 1,-0.1 -4,-2.4 -5,-0.1 -1,-0.3 -0.610 56.7-111.3 -85.0 134.9 36.7 25.6 12.5 25 25 A Y E +AB 19 34A 20 9,-0.6 8,-3.0 11,-0.5 9,-1.4 -0.344 48.8 162.4 -63.4 131.0 38.5 24.7 15.8 26 26 A T E -AB 18 32A 4 -8,-3.3 -8,-3.4 6,-0.3 2,-0.3 -0.897 14.2-176.6-141.2 164.8 39.4 21.0 16.0 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.6 -2,-0.3 2,-0.3 -0.965 49.1 11.2-158.6 167.0 41.7 18.8 18.0 28 28 A G E 4 S-A 14 0A 0 -14,-2.8 -14,-1.9 -2,-0.3 2,-0.6 -0.525 122.9 -8.8 65.1-117.1 42.9 15.2 18.4 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -2,-0.3 -16,-0.2 -0.806 128.1 -50.3-114.6 79.7 41.8 13.0 15.5 30 30 A G T 4 S+ 0 0 12 -2,-0.6 2,-1.0 -19,-0.4 -2,-0.2 0.778 84.7 160.9 66.2 28.4 39.4 15.2 13.6 31 31 A H E < -B 27 0A 32 -4,-2.6 -4,-1.7 -20,-0.0 2,-0.4 -0.706 31.4-146.6 -87.1 109.3 37.4 16.1 16.6 32 32 A L E -B 26 0A 77 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.509 18.2-178.7 -70.1 126.0 35.4 19.3 15.7 33 33 A L E - 0 0 16 -8,-3.0 2,-0.3 -2,-0.4 -7,-0.2 0.894 57.5 -24.3 -88.7 -46.7 35.0 21.4 18.8 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.6 2,-0.1 -1,-0.3 -0.983 35.2-135.5-165.3 157.6 33.0 24.4 17.5 35 35 A K S S+ 0 0 143 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.318 74.8 112.9 -97.8 -0.0 32.1 26.4 14.5 36 36 A S - 0 0 38 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.499 67.4-140.0 -76.6 148.8 32.6 29.5 16.5 37 37 A P S S+ 0 0 109 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.575 75.5 102.2 -80.8 -11.0 35.5 31.9 15.6 38 38 A S > - 0 0 50 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.605 59.1-160.1 -82.6 124.1 36.2 32.4 19.3 39 39 A L H > S+ 0 0 56 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.856 95.3 58.3 -65.5 -27.5 39.1 30.5 20.6 40 40 A N H > S+ 0 0 114 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.923 103.3 49.9 -69.2 -39.4 37.7 30.9 23.9 41 41 A A H > S+ 0 0 30 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.954 110.1 50.1 -62.5 -46.0 34.6 29.3 23.0 42 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.847 106.7 57.6 -57.4 -37.4 36.5 26.4 21.5 43 43 A K H X S+ 0 0 47 -4,-2.3 4,-2.7 2,-0.2 11,-0.3 0.907 107.8 45.8 -61.7 -41.2 38.5 26.2 24.8 44 44 A S H X S+ 0 0 71 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.906 109.7 54.4 -62.8 -45.1 35.3 25.7 26.8 45 45 A E H X S+ 0 0 60 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.909 109.5 48.8 -57.8 -45.6 34.1 23.2 24.4 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.4 0.934 108.0 51.3 -63.9 -46.4 37.4 21.3 24.9 47 47 A D H X>S+ 0 0 37 -4,-2.7 4,-3.0 1,-0.2 5,-1.4 0.912 113.2 47.9 -57.2 -37.1 37.2 21.4 28.7 48 48 A K H <5S+ 0 0 153 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.839 110.4 50.6 -73.0 -31.6 33.7 20.0 28.5 49 49 A A H <5S+ 0 0 35 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.889 123.2 31.3 -68.7 -40.1 34.6 17.3 26.1 50 50 A I H <5S- 0 0 38 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.748 102.5-127.5 -88.0 -32.2 37.5 16.2 28.3 51 51 A G T <5S+ 0 0 65 -4,-3.0 2,-0.3 -5,-0.4 -3,-0.2 0.814 75.3 82.3 83.3 34.7 36.0 17.0 31.6 52 52 A R S - 0 0 11 -2,-1.2 3,-0.9 -11,-0.3 -1,-0.2 0.750 34.4-148.0 -92.0 -30.4 42.6 22.1 29.6 55 55 A N T 3 S- 0 0 115 1,-0.2 -2,-0.1 -12,-0.2 -11,-0.1 0.985 74.2 -59.6 58.6 44.2 43.9 25.3 28.2 56 56 A G T 3 S+ 0 0 2 -13,-0.2 -39,-2.1 1,-0.1 2,-0.4 0.498 112.6 96.8 58.0 14.5 43.7 23.8 24.6 57 57 A V B < -C 16 0B 75 -3,-0.9 2,-0.3 -41,-0.2 -41,-0.2 -0.985 46.1-177.8-132.8 142.9 46.1 20.9 24.8 58 58 A I - 0 0 4 -43,-2.5 2,-0.1 -2,-0.4 -30,-0.1 -0.867 26.0-105.6-135.3 167.6 45.3 17.2 25.4 59 59 A T > - 0 0 66 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.414 32.1-111.4 -88.8 165.4 47.0 13.9 25.8 60 60 A K H > S+ 0 0 114 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.904 120.2 52.0 -62.4 -41.8 47.2 11.2 23.3 61 61 A D H > S+ 0 0 123 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.904 110.3 49.4 -61.4 -40.5 45.0 9.0 25.4 62 62 A E H > S+ 0 0 39 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.933 110.0 51.3 -62.4 -44.5 42.5 11.8 25.7 63 63 A A H X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.2 -34,-0.4 0.919 110.0 49.0 -57.5 -44.2 42.6 12.3 21.9 64 64 A E H X S+ 0 0 72 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.806 107.5 56.3 -65.1 -32.5 42.0 8.5 21.4 65 65 A K H X S+ 0 0 133 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.921 107.7 46.3 -65.2 -46.8 39.0 8.7 23.8 66 66 A L H X S+ 0 0 3 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.886 112.0 53.8 -63.8 -31.5 37.3 11.4 21.8 67 67 A F H X S+ 0 0 14 -4,-1.7 4,-3.0 -5,-0.3 5,-0.2 0.926 107.3 48.6 -70.9 -40.4 38.0 9.3 18.6 68 68 A N H X S+ 0 0 90 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.946 114.7 46.9 -61.6 -46.2 36.4 6.2 20.1 69 69 A Q H X S+ 0 0 89 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.936 113.5 49.1 -57.8 -46.3 33.4 8.3 21.0 70 70 A D H X S+ 0 0 33 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.883 112.1 45.5 -66.6 -42.2 33.4 9.9 17.6 71 71 A V H X S+ 0 0 7 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.944 113.8 50.5 -67.0 -43.6 33.6 6.7 15.6 72 72 A D H X S+ 0 0 87 -4,-3.0 4,-2.4 -5,-0.2 -2,-0.2 0.911 110.1 50.1 -56.7 -45.8 30.9 5.2 17.8 73 73 A A H X S+ 0 0 46 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.851 111.1 50.6 -61.1 -33.4 28.7 8.3 17.3 74 74 A A H X S+ 0 0 4 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.928 110.0 47.2 -69.4 -48.5 29.2 8.0 13.5 75 75 A V H X S+ 0 0 36 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.902 114.7 48.9 -58.6 -41.1 28.2 4.3 13.4 76 76 A R H X S+ 0 0 115 -4,-2.4 4,-2.6 -5,-0.2 5,-0.3 0.921 105.1 56.3 -65.9 -44.1 25.3 5.2 15.5 77 77 A G H X S+ 0 0 7 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.826 111.6 45.9 -58.0 -32.7 24.2 8.1 13.3 78 78 A I H < S+ 0 0 0 -4,-1.7 7,-0.3 2,-0.2 -2,-0.2 0.960 115.3 44.3 -69.5 -54.9 24.1 5.6 10.4 79 79 A L H < S+ 0 0 69 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.782 112.8 51.7 -56.9 -39.7 22.2 3.0 12.3 80 80 A R H < S+ 0 0 205 -4,-2.6 -1,-0.2 -5,-0.2 2,-0.2 0.800 95.0 93.0 -67.0 -40.6 19.7 5.5 13.8 81 81 A N X - 0 0 44 -4,-1.1 4,-2.0 -5,-0.3 -4,-0.0 -0.428 67.2-148.0 -72.9 135.5 19.0 6.9 10.4 82 82 A A T 4 S+ 0 0 85 -2,-0.2 -1,-0.1 2,-0.2 -4,-0.0 0.765 98.1 32.3 -71.0 -33.3 16.2 5.7 8.2 83 83 A K T > S+ 0 0 139 2,-0.1 4,-1.2 3,-0.1 -1,-0.2 0.840 123.3 46.2 -93.0 -37.9 17.7 6.2 4.8 84 84 A M H > S+ 0 0 16 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.911 102.6 62.3 -72.5 -40.8 21.3 5.5 5.8 85 85 A K H X S+ 0 0 78 -4,-2.0 4,-2.7 -7,-0.3 5,-0.2 0.973 108.2 42.5 -49.1 -55.6 20.7 2.4 7.8 86 86 A P H > S+ 0 0 59 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.841 112.8 52.6 -59.1 -34.5 19.4 0.6 4.8 87 87 A M H < S+ 0 0 8 -4,-1.2 4,-0.4 2,-0.2 -2,-0.2 0.913 111.0 47.7 -68.8 -40.4 22.1 1.9 2.6 88 88 A Y H >< S+ 0 0 37 -4,-2.6 3,-1.8 1,-0.2 -1,-0.2 0.924 107.0 58.2 -62.1 -49.2 24.9 0.7 5.1 89 89 A D H 3< S+ 0 0 73 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.801 102.5 53.8 -54.7 -31.6 23.3 -2.7 5.4 90 90 A S T 3< S+ 0 0 69 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.646 94.8 87.8 -84.0 -9.6 23.5 -3.3 1.7 91 91 A M S < S- 0 0 15 -3,-1.8 31,-0.0 -4,-0.4 -3,-0.0 -0.551 76.0-114.5 -91.4 155.5 27.3 -2.6 1.5 92 92 A D > - 0 0 62 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.115 46.4 -91.0 -73.1 174.5 30.4 -4.9 1.9 93 93 A A H > S+ 0 0 78 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.856 124.0 49.7 -59.3 -38.5 32.8 -4.2 4.8 94 94 A V H > S+ 0 0 23 2,-0.2 4,-2.4 62,-0.2 -1,-0.2 0.950 112.8 44.6 -65.1 -55.4 35.1 -1.9 3.0 95 95 A R H > S+ 0 0 31 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.877 111.0 57.4 -61.4 -34.8 32.4 0.3 1.5 96 96 A R H X S+ 0 0 78 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.939 105.4 49.4 -63.3 -41.0 30.8 0.3 5.0 97 97 A A H X S+ 0 0 9 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.947 109.6 53.1 -62.6 -40.8 34.0 1.6 6.5 98 98 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.912 107.8 49.3 -60.2 -38.7 34.1 4.4 3.8 99 99 A M H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.902 108.8 52.8 -69.9 -35.2 30.6 5.5 4.6 100 100 A I H X S+ 0 0 9 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.901 106.8 53.5 -64.8 -34.7 31.5 5.6 8.2 101 101 A N H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.951 108.9 50.5 -61.5 -47.1 34.5 7.8 7.3 102 102 A M H X S+ 0 0 0 -4,-2.6 4,-4.4 1,-0.2 5,-0.4 0.956 110.5 46.2 -55.6 -54.0 32.1 10.2 5.5 103 103 A V H X S+ 0 0 7 -4,-2.5 4,-3.1 1,-0.2 -1,-0.2 0.896 109.6 55.6 -57.9 -37.3 29.7 10.5 8.3 104 104 A F H < S+ 0 0 28 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.926 116.6 37.2 -62.5 -43.0 32.5 11.1 10.8 105 105 A Q H < S+ 0 0 62 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.942 134.9 20.3 -77.0 -42.9 33.7 13.9 8.8 106 106 A M H X S- 0 0 40 -4,-4.4 4,-1.2 -5,-0.2 -3,-0.2 0.611 95.6-134.3-106.4 -11.1 30.5 15.4 7.6 107 107 A G H X - 0 0 28 -4,-3.1 4,-3.1 -5,-0.4 3,-0.2 0.258 40.2 -67.5 75.9 159.6 27.7 14.2 9.9 108 108 A E H > S+ 0 0 74 1,-0.3 4,-1.0 2,-0.2 -1,-0.1 0.905 136.3 52.9 -43.0 -47.6 24.2 12.8 9.3 109 109 A T H >4 S+ 0 0 129 2,-0.2 3,-0.5 1,-0.2 4,-0.4 0.877 107.9 45.9 -60.0 -48.6 23.4 16.3 8.0 110 110 A G H >< S+ 0 0 27 -4,-1.2 3,-2.1 -3,-0.2 4,-0.4 0.950 106.5 62.8 -65.1 -42.1 26.3 16.5 5.5 111 111 A M H >< S+ 0 0 7 -4,-3.1 3,-2.0 1,-0.3 4,-0.3 0.800 84.5 77.2 -49.6 -30.4 25.4 13.1 4.4 112 112 A A G X< S+ 0 0 61 -4,-1.0 3,-1.3 -3,-0.5 -1,-0.3 0.851 88.2 54.7 -54.4 -37.6 22.1 14.2 3.2 113 113 A G G < S+ 0 0 69 -3,-2.1 3,-0.4 -4,-0.4 -1,-0.3 0.654 99.5 65.3 -74.4 -6.6 23.4 15.8 0.0 114 114 A F G <> + 0 0 20 -3,-2.0 4,-2.8 -4,-0.4 3,-0.3 0.335 67.6 110.2 -89.9 2.8 25.1 12.5 -0.9 115 115 A T H <> S+ 0 0 50 -3,-1.3 4,-2.1 -4,-0.3 5,-0.2 0.872 76.2 48.5 -46.7 -48.8 21.8 10.8 -1.3 116 116 A N H > S+ 0 0 103 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.920 112.4 45.6 -63.4 -44.8 22.1 10.4 -5.0 117 117 A S H > S+ 0 0 0 -3,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.851 111.7 52.9 -64.9 -36.2 25.5 9.1 -5.1 118 118 A M H X S+ 0 0 11 -4,-2.8 4,-2.5 1,-0.2 3,-0.2 0.912 108.9 50.2 -61.0 -45.2 24.7 6.6 -2.3 119 119 A R H X S+ 0 0 87 -4,-2.1 4,-2.8 -5,-0.3 -2,-0.2 0.878 108.0 53.4 -58.0 -42.4 21.7 5.4 -4.4 120 120 A M H <>S+ 0 0 35 -4,-2.0 5,-3.2 2,-0.2 -1,-0.2 0.881 106.8 52.8 -59.9 -35.8 24.1 5.0 -7.4 121 121 A M H ><5S+ 0 0 1 -4,-1.5 3,-2.5 -3,-0.2 -2,-0.2 0.914 107.1 51.8 -62.9 -52.9 26.3 2.9 -5.1 122 122 A Q H 3<5S+ 0 0 82 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.897 108.6 51.4 -57.7 -36.9 23.3 0.8 -4.3 123 123 A Q T 3<5S- 0 0 90 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.441 116.5-115.2 -83.2 10.9 22.7 0.5 -8.0 124 124 A K T < 5S+ 0 0 157 -3,-2.5 2,-1.1 1,-0.2 -3,-0.2 0.730 72.9 135.7 68.5 22.1 26.4 -0.7 -8.6 125 125 A R >< + 0 0 121 -5,-3.2 4,-2.3 1,-0.2 5,-0.2 -0.678 21.7 161.8-102.8 74.0 27.2 2.4 -10.7 126 126 A W H > + 0 0 66 -2,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.908 67.0 47.5 -59.2 -51.9 30.5 2.9 -9.0 127 127 A D H > S+ 0 0 98 2,-0.2 4,-2.3 -3,-0.2 5,-0.2 0.894 114.0 46.3 -60.5 -44.5 32.2 5.1 -11.4 128 128 A E H > S+ 0 0 97 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.912 111.9 51.3 -65.7 -45.9 29.2 7.4 -11.8 129 129 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.910 109.8 52.0 -56.3 -44.0 28.8 7.6 -8.1 130 130 A A H X S+ 0 0 10 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.927 109.4 46.7 -64.3 -43.8 32.4 8.5 -7.7 131 131 A V H X S+ 0 0 96 -4,-2.3 4,-0.9 1,-0.2 3,-0.3 0.934 113.3 51.1 -66.0 -37.1 32.4 11.3 -10.2 132 132 A N H >< S+ 0 0 54 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.957 105.5 54.5 -62.6 -44.7 29.4 12.5 -8.6 133 133 A M H 3< S+ 0 0 0 -4,-3.1 6,-0.4 1,-0.3 -1,-0.2 0.810 101.2 59.0 -59.3 -32.2 30.9 12.4 -5.2 134 134 A A H 3< S+ 0 0 29 -4,-1.6 2,-1.8 -3,-0.3 -1,-0.3 0.613 87.5 80.3 -72.4 -17.6 33.9 14.6 -6.3 135 135 A K S << S+ 0 0 177 -3,-1.3 2,-0.3 -4,-0.9 -1,-0.2 -0.420 79.6 96.8 -86.1 74.7 31.5 17.3 -7.2 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.5 1,-0.1 5,-0.2 -0.987 85.2-116.9-155.2 159.4 31.0 18.5 -3.6 137 137 A R H > S+ 0 0 154 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.900 116.0 64.0 -64.9 -31.8 32.2 21.1 -1.3 138 138 A W H > S+ 0 0 23 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.952 108.2 36.0 -51.4 -55.6 33.5 18.1 0.6 139 139 A Y H 4 S+ 0 0 58 -6,-0.4 -1,-0.2 1,-0.2 7,-0.2 0.931 115.1 56.7 -66.5 -44.1 35.9 17.0 -2.0 140 140 A N H < S+ 0 0 105 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.863 107.1 47.7 -57.1 -39.0 36.8 20.5 -3.0 141 141 A Q H < S+ 0 0 59 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.900 131.4 14.4 -69.3 -44.2 37.9 21.5 0.5 142 142 A T S X S+ 0 0 29 -4,-1.5 4,-2.2 -5,-0.3 -1,-0.2 -0.627 70.8 168.7-137.8 77.5 40.1 18.4 1.2 143 143 A P H > + 0 0 59 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.745 69.8 57.8 -62.7 -31.6 40.7 16.6 -2.0 144 144 A N H > S+ 0 0 124 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.957 113.3 37.8 -70.2 -45.1 43.3 14.2 -0.9 145 145 A R H > S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.902 117.3 51.4 -69.4 -39.9 41.3 12.7 1.8 146 146 A A H X S+ 0 0 0 -4,-2.2 4,-3.5 1,-0.2 5,-0.3 0.919 106.1 54.9 -60.9 -40.2 38.2 12.8 -0.2 147 147 A K H X S+ 0 0 125 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.933 109.4 48.7 -60.1 -44.8 40.0 11.1 -3.1 148 148 A R H X S+ 0 0 65 -4,-1.8 4,-2.0 2,-0.2 12,-0.2 0.932 113.2 46.8 -58.9 -45.0 41.0 8.2 -0.8 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.950 112.8 47.7 -61.3 -50.7 37.5 7.9 0.5 150 150 A I H X S+ 0 0 12 -4,-3.5 4,-3.0 1,-0.2 -1,-0.2 0.948 110.0 53.8 -58.4 -47.3 35.9 7.9 -2.9 151 151 A T H X S+ 0 0 31 -4,-2.8 4,-2.8 -5,-0.3 6,-0.4 0.892 108.7 50.4 -54.4 -39.2 38.4 5.4 -4.2 152 152 A T H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.910 112.7 44.5 -69.1 -39.9 37.5 3.1 -1.3 153 153 A F H < S+ 0 0 0 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.869 114.9 50.2 -70.1 -33.6 33.8 3.4 -2.0 154 154 A R H < S+ 0 0 81 -4,-3.0 -2,-0.2 -5,-0.3 -3,-0.2 0.969 123.3 25.6 -66.5 -58.8 34.4 3.0 -5.6 155 155 A T H < S- 0 0 44 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.662 86.1-133.5 -81.7 -27.9 36.6 -0.1 -5.5 156 156 A G S < S+ 0 0 18 -4,-2.1 2,-0.2 -5,-0.4 -62,-0.2 0.768 75.4 104.9 75.8 14.5 35.6 -1.9 -2.3 157 157 A T S S- 0 0 49 -6,-0.4 -1,-0.3 -5,-0.2 3,-0.3 -0.810 76.9-126.3-122.9 169.3 39.4 -2.3 -1.7 158 158 A W > + 0 0 51 -2,-0.2 3,-2.1 1,-0.2 4,-0.2 0.131 70.0 119.5 -99.7 18.3 42.0 -0.5 0.6 159 159 A D G > + 0 0 113 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.810 66.1 61.7 -53.4 -36.5 44.4 0.4 -2.1 160 160 A A G 3 S+ 0 0 33 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.664 104.1 51.9 -63.5 -20.8 44.1 4.1 -1.5 161 161 A Y G < 0 0 17 -3,-2.1 -1,-0.3 -13,-0.1 -2,-0.2 0.283 360.0 360.0-103.6 10.5 45.5 3.5 1.9 162 162 A K < 0 0 162 -3,-1.5 -2,-0.2 -4,-0.2 -3,-0.1 0.821 360.0 360.0-107.2 360.0 48.7 1.6 1.1