==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-JAN-02 1KS3 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR N.C.GASSNER,W.A.BAASE,B.H.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) . 8556.0 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 . 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 1 0 0 3 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 79 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 149.7 43.6 -1.9 9.2 2 2 A N > - 0 0 66 156,-0.0 4,-3.1 95,-0.0 3,-0.5 -0.937 360.0 -78.0-147.5 178.0 40.3 -0.7 10.7 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.8 1,-0.3 5,-0.3 0.785 124.7 51.1 -49.1 -43.9 38.2 2.3 11.3 4 4 A F H > S+ 0 0 77 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.929 114.6 41.3 -65.9 -46.1 40.3 3.6 14.2 5 5 A E H > S+ 0 0 95 -3,-0.5 4,-1.2 2,-0.2 -2,-0.2 0.836 114.3 54.8 -68.3 -37.1 43.6 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-3.1 4,-1.9 1,-0.2 3,-0.3 0.934 113.3 38.5 -63.7 -50.2 42.0 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.830 109.5 62.3 -69.7 -31.2 40.6 7.8 10.9 8 8 A R H X S+ 0 0 95 -4,-1.8 4,-1.2 -5,-0.3 -1,-0.2 0.867 107.4 45.0 -63.1 -27.3 43.7 8.2 12.9 9 9 A I H < S+ 0 0 86 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.934 115.0 45.8 -79.3 -44.6 45.6 8.6 9.6 10 10 A D H < S+ 0 0 18 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.809 123.2 33.7 -67.2 -32.9 43.1 11.0 8.0 11 11 A E H < S- 0 0 43 -4,-2.6 19,-0.4 1,-0.2 -1,-0.2 0.688 92.7-150.3 -98.3 -26.6 42.8 13.2 11.1 12 12 A G < - 0 0 25 -4,-1.2 2,-0.4 -5,-0.3 -1,-0.2 -0.168 24.5 -85.7 77.5-173.5 46.2 13.2 12.7 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.954 45.3 170.3-136.6 116.4 46.8 13.6 16.4 14 14 A R E -A 28 0A 122 14,-1.8 14,-2.2 -2,-0.4 4,-0.1 -0.988 19.2-168.7-126.2 133.6 47.2 17.0 18.1 15 15 A L E S+ 0 0 62 -2,-0.4 43,-1.8 12,-0.2 2,-0.3 0.509 71.6 66.4-101.8 1.2 47.3 17.7 21.8 16 16 A K E S-C 57 0B 94 41,-0.2 12,-0.2 12,-0.1 41,-0.2 -0.874 100.2 -88.9-118.9 145.6 46.9 21.4 21.7 17 17 A I E + 0 0 15 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.213 59.0 175.9 -47.1 144.9 43.8 23.3 20.5 18 18 A Y E -A 26 0A 28 8,-2.7 8,-2.9 -4,-0.1 2,-0.6 -0.972 34.6-107.0-149.5 165.9 44.1 23.8 16.7 19 19 A K E -A 25 0A 135 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.829 34.1-142.8 -96.8 128.5 42.2 25.2 13.7 20 20 A D > - 0 0 48 4,-2.8 3,-2.1 -2,-0.6 -1,-0.0 -0.145 43.3 -77.3 -74.7-176.2 41.0 22.6 11.4 21 21 A T T 3 S+ 0 0 119 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.755 138.3 46.0 -54.9 -27.7 41.0 23.0 7.5 22 22 A E T 3 S- 0 0 86 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.372 123.2-105.9 -92.4 -3.7 37.9 25.3 7.9 23 23 A G S < S+ 0 0 33 -3,-2.1 2,-0.4 1,-0.3 -2,-0.1 0.750 72.0 141.3 83.9 28.4 39.4 27.3 10.9 24 24 A Y - 0 0 72 1,-0.0 -4,-2.8 13,-0.0 -1,-0.3 -0.862 60.5-101.7-103.8 143.3 37.3 25.7 13.6 25 25 A Y E +AB 19 34A 34 9,-0.7 8,-3.0 11,-0.5 9,-1.7 -0.491 54.3 160.9 -67.3 125.4 38.8 24.9 16.9 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.7 -2,-0.3 2,-0.3 -0.853 16.2-174.0-135.7 165.1 39.5 21.3 17.2 27 27 A I E > + B 0 31A 0 4,-2.0 4,-2.0 -2,-0.3 2,-0.2 -0.994 48.7 9.1-157.2 167.6 41.7 19.1 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.2 -14,-1.8 -2,-0.3 2,-1.0 -0.450 121.9 -9.5 71.0-132.3 42.8 15.4 19.6 29 29 A I T 4 S- 0 0 2 34,-0.4 -1,-0.2 -2,-0.2 -17,-0.1 -0.659 128.4 -50.1-102.4 73.0 42.0 13.2 16.7 30 30 A G T 4 S+ 0 0 16 -2,-1.0 2,-0.9 -19,-0.4 -2,-0.2 0.732 84.8 159.0 65.4 31.3 39.6 15.4 14.8 31 31 A H E < -B 27 0A 34 -4,-2.0 -4,-2.0 1,-0.0 2,-0.2 -0.669 33.9-143.2 -88.9 107.7 37.4 16.3 17.7 32 32 A L E -B 26 0A 66 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.406 17.8-175.1 -68.6 124.2 35.6 19.6 16.7 33 33 A L E - 0 0 14 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.885 56.6 -22.4 -88.8 -43.0 35.3 21.7 19.6 34 34 A T E -B 25 0A 26 -9,-1.7 -9,-0.7 2,-0.1 -1,-0.4 -0.928 36.8-135.6-163.1 152.5 33.3 24.6 18.3 35 35 A K S S+ 0 0 148 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.709 78.1 100.0 -83.5 -19.2 32.2 26.5 15.3 36 36 A S S S- 0 0 49 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.139 75.2-127.9 -72.6 158.0 32.8 29.8 17.0 37 37 A P S S+ 0 0 115 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.477 77.2 101.3 -84.2 -12.4 35.7 32.2 16.8 38 38 A S > - 0 0 56 1,-0.2 4,-1.7 -13,-0.0 -13,-0.1 -0.720 55.9-160.4 -86.3 126.2 36.3 32.5 20.4 39 39 A L H > S+ 0 0 64 -2,-0.5 4,-2.9 2,-0.2 -1,-0.2 0.666 96.5 59.9 -70.7 -20.3 39.2 30.5 21.7 40 40 A N H > S+ 0 0 110 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.974 100.7 50.0 -74.1 -51.6 37.5 30.9 25.0 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.917 112.5 50.8 -53.6 -36.5 34.5 29.3 23.8 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-3.4 2,-0.2 -2,-0.2 0.940 110.7 47.4 -64.9 -44.2 36.8 26.5 22.6 43 43 A K H X S+ 0 0 65 -4,-2.9 4,-2.1 2,-0.2 11,-0.2 0.923 112.7 48.8 -65.4 -40.4 38.6 26.2 25.9 44 44 A S H X S+ 0 0 75 -4,-3.1 4,-2.3 2,-0.2 5,-0.3 0.945 111.8 48.3 -64.1 -47.8 35.3 26.2 27.7 45 45 A E H X S+ 0 0 67 -4,-2.8 4,-1.8 -5,-0.3 -2,-0.2 0.941 111.3 53.1 -61.1 -41.6 34.0 23.5 25.4 46 46 A L H X S+ 0 0 0 -4,-3.4 4,-2.4 -5,-0.2 5,-0.3 0.913 110.2 45.5 -59.0 -39.4 37.2 21.6 25.9 47 47 A D H X>S+ 0 0 30 -4,-2.1 4,-2.3 2,-0.2 5,-1.3 0.910 109.6 54.0 -74.0 -37.3 37.0 21.6 29.7 48 48 A K H <5S+ 0 0 142 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.868 114.4 44.0 -60.7 -39.6 33.4 20.6 29.7 49 49 A A H <5S+ 0 0 45 -4,-1.8 -2,-0.2 -5,-0.3 -1,-0.2 0.867 118.7 39.7 -76.1 -41.3 34.3 17.6 27.5 50 50 A I H <5S- 0 0 33 -4,-2.4 -1,-0.2 2,-0.3 -2,-0.2 0.697 102.7-130.4 -81.9 -28.0 37.3 16.5 29.3 51 51 A G T <5S+ 0 0 63 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.846 75.9 67.0 83.4 29.1 35.9 17.2 32.8 52 52 A R S - 0 0 6 -2,-0.9 3,-0.8 -11,-0.2 -1,-0.2 0.736 32.7-142.1 -85.8 -28.9 42.8 21.6 30.6 55 55 A N T 3 S- 0 0 118 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.787 71.6 -57.4 64.9 27.9 44.0 24.9 29.9 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.2 2,-0.4 0.521 120.0 97.3 83.7 6.4 43.7 23.9 26.1 57 57 A V B < +C 16 0B 61 -3,-0.8 2,-0.3 -41,-0.2 -41,-0.2 -0.981 46.5 177.7-130.3 137.4 46.0 21.0 26.4 58 58 A I - 0 0 4 -43,-1.8 2,-0.2 -2,-0.4 -30,-0.1 -0.842 27.0-113.8-128.5 168.2 45.1 17.3 26.9 59 59 A T > - 0 0 66 -2,-0.3 4,-2.2 1,-0.1 3,-0.4 -0.610 34.1-103.0 -95.1 176.7 47.1 14.2 27.1 60 60 A K H > S+ 0 0 103 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.886 121.2 57.8 -61.3 -43.6 47.1 11.3 24.6 61 61 A D H > S+ 0 0 122 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.887 107.8 45.1 -53.1 -51.1 44.9 9.3 26.8 62 62 A E H > S+ 0 0 36 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.863 110.8 54.3 -66.0 -38.8 42.2 12.0 26.8 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -34,-0.4 0.914 111.0 48.1 -56.4 -44.6 42.5 12.4 22.9 64 64 A E H X S+ 0 0 72 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.824 106.8 54.2 -69.8 -29.6 42.0 8.8 22.7 65 65 A K H X S+ 0 0 136 -4,-1.6 4,-1.8 -5,-0.2 -2,-0.2 0.961 110.5 45.8 -71.3 -42.9 39.1 8.9 25.0 66 66 A L H X S+ 0 0 4 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.908 110.9 55.8 -58.7 -38.9 37.4 11.6 22.8 67 67 A F H X S+ 0 0 10 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.968 106.2 49.2 -63.8 -45.1 38.2 9.6 19.7 68 68 A N H X S+ 0 0 89 -4,-2.3 4,-2.1 1,-0.3 -1,-0.2 0.895 112.3 48.0 -56.8 -43.3 36.5 6.5 21.1 69 69 A Q H X S+ 0 0 97 -4,-1.8 4,-2.6 1,-0.2 -1,-0.3 0.882 110.8 51.4 -68.1 -36.5 33.4 8.4 21.9 70 70 A D H X S+ 0 0 37 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.838 109.9 47.8 -72.6 -30.6 33.3 10.0 18.6 71 71 A V H X S+ 0 0 6 -4,-2.4 4,-2.3 -5,-0.2 5,-0.2 0.962 112.6 48.8 -75.3 -42.6 33.6 6.9 16.6 72 72 A D H X S+ 0 0 80 -4,-2.1 4,-2.4 -5,-0.3 5,-0.3 0.960 109.4 52.5 -57.8 -45.3 30.9 5.2 18.7 73 73 A A H X S+ 0 0 53 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.841 109.2 52.2 -57.1 -39.1 28.6 8.3 18.2 74 74 A A H X S+ 0 0 10 -4,-1.4 4,-2.5 2,-0.2 5,-0.2 0.961 108.6 47.1 -64.4 -51.6 29.1 8.1 14.4 75 75 A V H X S+ 0 0 35 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.916 116.2 45.4 -54.8 -46.0 28.2 4.4 14.1 76 76 A R H X S+ 0 0 102 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.884 109.6 55.8 -73.8 -31.9 25.1 4.9 16.3 77 77 A G H X S+ 0 0 3 -4,-2.3 4,-1.1 -5,-0.3 3,-0.3 0.938 109.0 45.3 -64.5 -44.3 24.3 8.0 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 7,-0.5 0.968 112.3 53.6 -58.5 -48.5 24.3 6.1 11.0 79 79 A L H 3< S+ 0 0 64 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.743 112.0 42.9 -61.3 -27.3 22.3 3.3 12.5 80 80 A R H 3< S+ 0 0 190 -4,-1.5 2,-0.5 -3,-0.3 -1,-0.3 0.554 93.6 95.3 -90.3 -18.1 19.7 5.6 13.8 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.9 -3,-0.2 3,-0.5 0.825 100.3 70.2 -92.6 -39.3 22.0 6.0 6.1 85 85 A K H X S+ 0 0 82 -4,-2.7 4,-2.6 -7,-0.5 5,-0.2 0.889 98.4 47.1 -47.0 -53.6 21.1 2.8 7.8 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.816 112.4 53.5 -62.2 -31.9 20.0 0.9 4.8 87 87 A V H >> S+ 0 0 0 -3,-0.5 4,-0.7 -4,-0.3 3,-0.5 0.971 110.7 44.4 -66.8 -47.9 23.0 2.1 3.1 88 88 A Y H >< S+ 0 0 31 -4,-2.9 3,-0.6 1,-0.3 -1,-0.2 0.826 109.1 55.7 -64.2 -39.2 25.3 0.9 5.7 89 89 A D H 3< S+ 0 0 75 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.788 105.3 54.0 -68.4 -29.8 23.5 -2.5 6.1 90 90 A S H << S+ 0 0 42 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.638 96.4 85.9 -75.8 -20.9 24.0 -3.2 2.3 91 91 A L S << S- 0 0 5 -4,-0.7 2,-0.1 -3,-0.6 31,-0.0 -0.545 76.2-118.2 -83.4 163.4 27.8 -2.6 2.4 92 92 A D > - 0 0 56 -2,-0.2 4,-1.8 1,-0.0 5,-0.2 -0.208 43.8 -88.7 -85.7 177.5 30.7 -4.9 3.2 93 93 A A H > S+ 0 0 78 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.865 121.9 48.3 -61.4 -43.8 33.1 -4.3 6.1 94 94 A V H > S+ 0 0 25 62,-0.2 4,-1.7 1,-0.2 3,-0.4 0.955 112.4 48.7 -61.9 -48.4 35.7 -2.1 4.3 95 95 A R H > S+ 0 0 21 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.870 104.8 57.7 -64.1 -36.5 33.1 0.1 2.8 96 96 A R H X S+ 0 0 78 -4,-1.8 4,-2.6 2,-0.2 -1,-0.3 0.891 103.2 55.2 -59.0 -38.6 31.2 0.7 6.0 97 97 A A H X S+ 0 0 6 -4,-1.4 4,-2.4 -3,-0.4 -1,-0.2 0.913 107.0 51.2 -64.6 -33.4 34.4 2.0 7.4 98 98 A A H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.902 109.9 47.0 -69.2 -38.0 34.5 4.4 4.5 99 99 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.861 110.6 53.7 -69.4 -36.8 30.9 5.6 5.2 100 100 A I H X S+ 0 0 10 -4,-2.6 4,-3.4 -5,-0.2 5,-0.2 0.940 106.2 53.6 -63.4 -38.7 31.8 5.9 8.9 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.955 110.2 46.9 -56.7 -50.4 34.9 8.2 7.9 102 102 A M H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.894 112.9 48.1 -59.3 -48.4 32.7 10.5 6.0 103 103 A V H X S+ 0 0 10 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.941 110.7 52.8 -60.6 -40.6 30.1 10.6 8.7 104 104 A F H < S+ 0 0 31 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.957 114.0 41.7 -57.6 -47.5 32.9 11.3 11.3 105 105 A Q H < S+ 0 0 58 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.821 131.7 18.0 -71.9 -31.0 34.2 14.2 9.2 106 106 A M H X S- 0 0 51 -4,-2.1 4,-1.0 -5,-0.2 -2,-0.2 0.510 100.8-101.6-131.3 4.8 31.0 15.7 8.3 107 107 A G H X - 0 0 29 -4,-2.9 4,-2.3 -5,-0.2 5,-0.1 0.120 35.7 -91.1 86.8 138.6 28.0 14.8 10.2 108 108 A E H > S+ 0 0 62 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.634 127.4 58.4 -51.3 -32.3 25.2 12.5 9.4 109 109 A T H > S+ 0 0 118 2,-0.2 4,-0.8 -6,-0.1 -1,-0.2 0.961 102.8 44.0 -70.6 -57.7 23.7 15.3 8.0 110 110 A G H >< S+ 0 0 37 -4,-1.0 3,-0.9 1,-0.2 -2,-0.2 0.891 116.9 53.5 -57.6 -41.2 26.2 16.4 5.4 111 111 A V H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.912 97.8 58.1 -65.4 -42.1 26.4 12.7 4.5 112 112 A A H 3< S+ 0 0 13 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.730 95.9 68.1 -63.7 -18.6 22.8 12.1 3.9 113 113 A G T << S+ 0 0 67 -3,-0.9 3,-0.3 -4,-0.8 -1,-0.2 0.258 78.1 80.7 -79.6 2.8 22.8 14.9 1.1 114 114 A F <> + 0 0 33 -3,-1.6 4,-2.0 1,-0.2 -1,-0.2 -0.440 60.2 146.5 -98.6 47.3 25.0 12.7 -1.1 115 115 A T H > + 0 0 58 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.804 63.7 52.1 -51.7 -49.3 21.8 11.0 -2.1 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.923 112.4 44.0 -59.8 -44.0 22.8 10.2 -5.5 117 117 A S H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.816 112.9 54.9 -63.0 -39.0 26.0 8.6 -4.4 118 118 A M H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.905 106.4 48.9 -66.3 -47.7 24.2 6.8 -1.7 119 119 A R H X S+ 0 0 119 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.907 111.4 50.3 -62.9 -32.6 21.7 5.3 -4.0 120 120 A M H X>S+ 0 0 19 -4,-1.6 5,-2.3 2,-0.2 4,-0.7 0.815 107.6 54.5 -69.7 -36.8 24.5 4.1 -6.3 121 121 A M H ><5S+ 0 0 0 -4,-1.8 3,-1.4 1,-0.2 -1,-0.2 0.942 105.2 51.8 -65.4 -40.0 26.3 2.7 -3.5 122 122 A Q H 3<5S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.915 109.6 49.9 -63.7 -35.2 23.2 0.7 -2.6 123 123 A Q H 3<5S- 0 0 86 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.588 114.8-118.4 -77.7 -8.3 23.0 -0.6 -6.2 124 124 A K T <<5 + 0 0 101 -3,-1.4 2,-1.3 -4,-0.7 -3,-0.2 0.698 61.9 149.7 76.6 30.8 26.8 -1.6 -6.1 125 125 A R >< + 0 0 112 -5,-2.3 4,-2.7 1,-0.2 5,-0.2 -0.707 17.2 171.4 -98.2 76.4 27.7 0.8 -8.9 126 126 A W H > + 0 0 49 -2,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.899 68.9 43.9 -58.2 -55.1 31.2 1.4 -7.6 127 127 A D H > S+ 0 0 119 1,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.930 116.3 48.7 -64.4 -35.8 32.8 3.3 -10.4 128 128 A E H > S+ 0 0 104 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.931 109.3 50.6 -72.6 -41.5 29.8 5.5 -10.8 129 129 A A H X S+ 0 0 2 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.881 108.8 54.3 -60.3 -37.2 29.4 6.3 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.884 108.8 47.8 -64.6 -35.9 33.1 7.3 -7.1 131 131 A V H X S+ 0 0 99 -4,-1.8 4,-0.5 1,-0.2 3,-0.3 0.941 113.9 46.4 -72.8 -42.3 32.6 9.6 -9.9 132 132 A N H >< S+ 0 0 38 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.885 107.1 57.4 -64.4 -40.9 29.6 11.2 -8.3 133 133 A L H 3< S+ 0 0 0 -4,-2.8 6,-0.3 1,-0.2 -1,-0.2 0.870 99.5 62.4 -57.8 -32.5 31.3 11.4 -4.9 134 134 A A H 3< S+ 0 0 28 -4,-1.2 2,-1.5 -3,-0.3 -1,-0.2 0.682 83.5 78.5 -70.4 -15.3 34.0 13.5 -6.5 135 135 A K S << S+ 0 0 168 -3,-1.2 2,-0.4 -4,-0.5 -1,-0.2 -0.585 79.4 97.2 -93.4 75.7 31.6 16.3 -7.6 136 136 A S S > S- 0 0 17 -2,-1.5 4,-1.9 1,-0.1 5,-0.2 -0.994 83.4-117.7-160.6 152.0 31.4 17.9 -4.2 137 137 A R H > S+ 0 0 142 -2,-0.4 4,-3.1 2,-0.2 5,-0.2 0.863 112.4 67.3 -55.7 -43.0 32.8 20.6 -2.2 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 8,-0.2 0.918 105.9 40.2 -44.1 -49.5 34.1 17.9 0.1 139 139 A Y H 4 S+ 0 0 56 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.867 114.0 51.8 -72.9 -42.0 36.5 16.7 -2.5 140 140 A N H < S+ 0 0 107 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.871 115.6 42.6 -64.6 -33.9 37.5 20.1 -3.8 141 141 A Q H < S+ 0 0 107 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.896 132.7 17.7 -79.1 -45.4 38.4 21.3 -0.3 142 142 A T S X S+ 0 0 22 -4,-2.0 4,-3.3 -5,-0.2 -1,-0.2 -0.625 75.2 162.2-126.2 64.6 40.2 18.1 1.0 143 143 A P H > + 0 0 49 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.884 69.2 50.8 -55.7 -47.7 41.0 16.3 -2.1 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.6 3,-0.1 5,-0.1 0.942 115.8 41.3 -64.6 -36.0 43.7 14.0 -0.8 145 145 A R H > S+ 0 0 23 2,-0.2 4,-2.1 1,-0.2 3,-0.5 0.973 114.7 52.5 -74.9 -42.9 41.6 12.7 2.1 146 146 A A H X S+ 0 0 0 -4,-3.3 4,-2.4 1,-0.3 -2,-0.2 0.868 107.4 53.3 -59.2 -39.0 38.5 12.6 -0.2 147 147 A K H X S+ 0 0 102 -4,-2.8 4,-2.4 1,-0.2 -1,-0.3 0.864 106.4 52.1 -62.4 -43.0 40.5 10.4 -2.7 148 148 A R H X S+ 0 0 69 -4,-1.6 4,-1.5 -3,-0.5 12,-0.2 0.940 113.2 43.0 -59.7 -46.7 41.5 7.9 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 5,-0.2 0.924 113.3 53.3 -63.3 -41.3 37.9 7.4 1.1 150 150 A I H X S+ 0 0 14 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.868 107.7 48.9 -58.4 -46.2 36.7 7.4 -2.5 151 151 A T H X S+ 0 0 34 -4,-2.4 4,-2.6 1,-0.2 6,-0.4 0.769 108.3 57.9 -58.6 -36.9 39.1 4.6 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-3.0 2,-0.2 5,-0.3 0.902 109.8 41.0 -61.1 -46.5 38.0 2.8 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.851 116.8 50.9 -68.3 -37.2 34.4 2.8 -1.7 154 154 A R H < S+ 0 0 94 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.923 124.0 23.9 -69.4 -44.7 35.4 2.1 -5.1 155 155 A T H < S- 0 0 46 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.679 84.4-136.7 -93.8 -25.8 37.6 -0.9 -4.4 156 156 A G S < S+ 0 0 16 -4,-3.0 2,-0.2 1,-0.3 -62,-0.2 0.714 74.1 104.7 68.1 21.3 36.3 -2.2 -1.2 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.796 78.7-122.9-122.7 175.8 40.1 -2.6 -0.2 158 158 A W S > S+ 0 0 44 -2,-0.2 3,-3.1 1,-0.2 4,-0.4 0.324 71.5 119.6-100.1 9.5 42.5 -0.7 2.1 159 159 A D G > + 0 0 93 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.769 67.0 59.8 -47.2 -34.4 45.0 0.1 -0.7 160 160 A A G 3 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.641 106.0 52.6 -69.0 -18.2 44.7 3.8 -0.4 161 161 A Y G < 0 0 18 -3,-3.1 -1,-0.3 -13,-0.1 -2,-0.2 0.538 360.0 360.0-101.6 -0.6 45.8 3.4 3.0 162 162 A K < 0 0 187 -3,-1.5 -2,-0.1 -4,-0.4 -3,-0.1 0.761 360.0 360.0-106.3 360.0 49.0 1.4 2.6