==== 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 01-FEB-02 1KY0 . 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) . 8670.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 114 70.4 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 . 83 51.2 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 2 0 0 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 82 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.8 43.5 -1.8 9.1 2 2 A N > - 0 0 69 156,-0.0 4,-2.9 95,-0.0 5,-0.2 -0.914 360.0 -78.8-157.0 179.6 40.3 -0.7 10.7 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.843 124.8 53.4 -58.2 -40.5 38.2 2.4 11.2 4 4 A F H > S+ 0 0 77 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.951 113.9 39.4 -63.4 -51.5 40.4 3.6 14.1 5 5 A E H > S+ 0 0 95 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.850 115.0 55.4 -65.5 -40.3 43.7 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 3,-0.5 0.954 112.1 40.8 -58.1 -50.2 42.1 4.6 9.2 7 7 A L H X S+ 0 0 0 -4,-3.2 4,-2.1 -5,-0.2 5,-0.3 0.818 107.8 60.6 -70.4 -26.6 40.8 7.7 10.8 8 8 A R H X S+ 0 0 100 -4,-1.8 4,-1.0 -5,-0.3 -1,-0.2 0.811 107.8 48.7 -69.7 -23.2 44.0 8.3 12.9 9 9 A I H < S+ 0 0 87 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.903 113.7 43.7 -76.5 -43.3 45.8 8.5 9.5 10 10 A D H < S+ 0 0 20 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.1 0.785 126.1 30.3 -71.6 -31.8 43.3 11.0 8.0 11 11 A E H < S- 0 0 45 -4,-2.1 19,-0.4 -5,-0.2 -1,-0.2 0.621 90.8-153.6-101.9 -28.1 43.0 13.2 11.0 12 12 A G < - 0 0 23 -4,-1.0 2,-0.3 -5,-0.3 -1,-0.1 -0.192 25.0 -85.4 75.4-171.4 46.4 13.0 12.8 13 13 A L + 0 0 39 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.971 42.7 171.5-139.3 123.1 46.9 13.6 16.5 14 14 A R E -A 28 0A 133 14,-1.8 14,-2.3 -2,-0.3 4,-0.1 -0.997 18.5-165.3-137.7 128.3 47.4 17.0 18.2 15 15 A L E S+ 0 0 59 -2,-0.4 43,-2.3 12,-0.2 2,-0.4 0.420 73.4 65.2 -95.8 -2.4 47.5 17.6 21.9 16 16 A K E S-C 57 0B 96 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.948 100.6 -89.6-117.3 145.4 47.1 21.3 21.8 17 17 A I E + 0 0 26 39,-1.8 2,-0.3 -2,-0.4 10,-0.2 -0.192 58.3 170.8 -49.2 135.8 44.1 23.2 20.5 18 18 A Y E -A 26 0A 26 8,-3.1 8,-3.5 -4,-0.1 2,-0.5 -0.909 35.4-104.5-141.9 169.4 44.5 23.8 16.7 19 19 A K E -A 25 0A 117 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.861 33.6-141.5 -99.1 137.9 42.5 25.1 13.8 20 20 A D > - 0 0 50 4,-3.0 3,-1.4 -2,-0.5 -1,-0.1 -0.054 40.6 -77.9 -80.5-167.7 41.3 22.5 11.4 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.636 133.8 49.2 -66.1 -24.0 41.2 22.9 7.5 22 22 A E T 3 S- 0 0 82 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.440 124.8-103.4 -91.3 -6.2 38.0 25.1 7.8 23 23 A G S < S+ 0 0 33 -3,-1.4 2,-0.3 1,-0.3 -2,-0.1 0.621 75.0 141.4 94.4 21.3 39.6 27.2 10.4 24 24 A Y - 0 0 81 1,-0.1 -4,-3.0 9,-0.0 -1,-0.3 -0.796 59.6-100.2-102.3 151.7 37.8 25.7 13.4 25 25 A Y E +AB 19 34A 33 9,-0.8 8,-3.0 11,-0.4 9,-1.4 -0.434 54.0 161.7 -67.6 127.0 39.1 24.9 16.8 26 26 A T E -AB 18 32A 4 -8,-3.5 -8,-3.1 -2,-0.3 2,-0.3 -0.854 17.7-172.4-139.9 165.2 39.9 21.3 17.1 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.1 -2,-0.3 2,-0.2 -0.978 50.6 3.9-154.8 162.4 41.9 19.0 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.8 -2,-0.3 2,-0.9 -0.426 122.1 -7.5 69.9-131.7 43.0 15.3 19.5 29 29 A I T 4 S- 0 0 3 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.684 128.5 -51.2-104.1 75.0 42.1 13.1 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.737 83.9 161.0 72.3 22.7 39.9 15.4 14.7 31 31 A H E < -B 27 0A 33 -4,-2.1 -4,-1.5 1,-0.0 -1,-0.2 -0.644 32.3-144.2 -80.6 101.5 37.7 16.3 17.6 32 32 A L E -B 26 0A 76 -2,-1.1 -6,-0.2 -6,-0.2 3,-0.1 -0.360 19.5-178.4 -62.5 127.9 35.8 19.6 16.6 33 33 A L E - 0 0 13 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.867 58.4 -18.1 -92.8 -49.6 35.4 21.8 19.6 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.8 2,-0.1 -1,-0.4 -0.937 36.3-141.1-160.2 148.0 33.6 24.7 18.3 35 35 A K S S+ 0 0 155 -2,-0.3 -1,-0.0 -11,-0.2 -3,-0.0 0.326 75.5 109.8 -89.4 5.7 32.7 26.5 15.1 36 36 A S S S- 0 0 42 2,-0.1 -11,-0.4 1,-0.1 6,-0.1 -0.527 74.3-130.0 -90.5 150.9 33.2 29.8 17.0 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.536 79.7 99.1 -70.1 -8.5 36.0 32.3 16.5 38 38 A S > - 0 0 45 1,-0.2 4,-2.2 -13,-0.0 5,-0.2 -0.721 54.2-165.9 -94.3 124.6 36.8 32.4 20.2 39 39 A L H > S+ 0 0 72 -2,-0.6 4,-2.8 2,-0.2 5,-0.2 0.775 94.4 59.0 -74.4 -25.3 39.5 30.5 21.7 40 40 A N H > S+ 0 0 120 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.938 106.5 48.1 -68.7 -40.8 38.0 31.1 25.0 41 41 A A H > S+ 0 0 32 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.934 112.1 49.0 -61.0 -45.3 34.9 29.5 23.8 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-3.1 1,-0.2 -2,-0.2 0.913 110.9 51.0 -62.3 -41.3 37.0 26.6 22.5 43 43 A K H X S+ 0 0 64 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.924 109.4 49.6 -65.8 -37.8 38.8 26.3 25.7 44 44 A S H X S+ 0 0 73 -4,-2.9 4,-2.0 1,-0.2 5,-0.2 0.952 110.8 49.5 -62.9 -48.5 35.5 26.2 27.6 45 45 A E H X S+ 0 0 73 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.909 109.7 52.8 -59.5 -42.8 34.2 23.5 25.3 46 46 A L H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.921 108.6 49.0 -59.1 -44.6 37.4 21.5 25.8 47 47 A D H X>S+ 0 0 33 -4,-2.2 4,-2.1 1,-0.2 5,-0.9 0.891 110.9 49.6 -63.7 -37.7 37.1 21.7 29.6 48 48 A K H <5S+ 0 0 145 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.850 112.7 48.6 -65.0 -37.6 33.5 20.6 29.6 49 49 A A H <5S+ 0 0 46 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.893 119.4 36.2 -71.4 -39.8 34.4 17.7 27.3 50 50 A I H <5S- 0 0 37 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.726 102.3-126.4 -86.6 -29.7 37.4 16.5 29.3 51 51 A G T <5S+ 0 0 67 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.2 0.752 75.6 69.3 87.4 21.7 36.0 17.2 32.8 52 52 A R S - 0 0 8 -2,-1.0 3,-1.0 -11,-0.2 -1,-0.2 0.710 34.2-145.9 -85.5 -33.1 42.9 21.8 30.7 55 55 A N T 3 S- 0 0 115 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.808 72.5 -59.2 66.8 26.1 44.1 25.1 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.8 1,-0.2 2,-0.4 0.634 116.8 99.0 82.4 8.2 43.9 23.9 26.0 57 57 A V B < -C 16 0B 58 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.996 47.0-178.6-129.9 132.9 46.3 20.9 26.3 58 58 A I - 0 0 5 -43,-2.3 2,-0.2 -2,-0.4 -30,-0.1 -0.843 26.2-110.6-124.1 168.1 45.2 17.2 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.513 31.8-107.6 -92.3 170.7 47.0 14.0 27.2 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.909 121.2 54.2 -61.1 -43.2 47.2 11.2 24.6 61 61 A D H > S+ 0 0 121 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.904 107.5 48.5 -59.6 -43.8 45.0 9.2 26.7 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.904 109.3 54.4 -60.7 -42.3 42.3 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -34,-0.5 0.897 108.9 49.1 -56.9 -44.4 42.6 12.3 23.0 64 64 A E H X S+ 0 0 74 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.854 108.5 52.8 -66.5 -33.9 41.9 8.6 22.6 65 65 A K H X S+ 0 0 139 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.970 110.5 46.0 -70.6 -46.6 39.0 8.8 24.8 66 66 A L H X S+ 0 0 5 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.906 113.1 52.6 -55.3 -42.3 37.4 11.6 22.8 67 67 A F H X S+ 0 0 13 -4,-2.0 4,-2.8 2,-0.2 5,-0.3 0.950 107.7 49.5 -64.3 -43.6 38.2 9.6 19.6 68 68 A N H X S+ 0 0 92 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.943 112.5 47.6 -60.3 -44.4 36.5 6.5 20.8 69 69 A Q H X S+ 0 0 100 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.888 112.0 50.6 -63.8 -40.7 33.5 8.4 21.8 70 70 A D H X S+ 0 0 36 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.885 110.6 47.7 -66.3 -38.0 33.4 10.2 18.4 71 71 A V H X S+ 0 0 6 -4,-2.8 4,-2.4 2,-0.2 3,-0.4 0.965 112.3 50.9 -65.9 -46.9 33.8 7.0 16.4 72 72 A D H X S+ 0 0 91 -4,-2.6 4,-2.7 -5,-0.3 5,-0.2 0.938 109.9 48.7 -53.8 -47.4 31.0 5.5 18.4 73 73 A A H X S+ 0 0 56 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.3 0.826 107.3 55.7 -62.8 -36.5 28.7 8.4 17.9 74 74 A A H X S+ 0 0 9 -4,-1.6 4,-1.6 -3,-0.4 -2,-0.2 0.955 110.2 46.9 -63.9 -42.8 29.4 8.4 14.1 75 75 A V H X S+ 0 0 30 -4,-2.4 4,-2.5 1,-0.2 3,-0.5 0.948 112.6 47.6 -60.1 -51.1 28.3 4.8 14.0 76 76 A R H X S+ 0 0 136 -4,-2.7 4,-1.5 1,-0.3 -1,-0.2 0.893 108.2 56.1 -64.9 -31.6 25.2 5.4 16.0 77 77 A G H < S+ 0 0 4 -4,-2.2 -1,-0.3 -5,-0.2 4,-0.2 0.850 108.1 48.4 -62.8 -38.8 24.3 8.4 13.9 78 78 A I H >< S+ 0 0 0 -4,-1.6 3,-1.6 -3,-0.5 7,-0.4 0.936 110.9 50.3 -67.0 -48.3 24.4 6.3 10.7 79 79 A L H 3< S+ 0 0 62 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.715 110.8 49.3 -65.2 -25.5 22.2 3.6 12.3 80 80 A R T 3< S+ 0 0 177 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.3 0.385 91.8 96.0 -87.2 -5.3 19.7 6.1 13.5 81 81 A N <> - 0 0 14 -3,-1.6 4,-2.9 -4,-0.2 -4,-0.0 -0.796 62.9-154.1 -98.7 120.1 19.5 7.8 10.0 82 82 A A T 4 S+ 0 0 79 -2,-0.6 -1,-0.2 1,-0.2 -4,-0.0 0.833 95.1 44.2 -62.9 -26.9 16.7 6.6 7.9 83 83 A K T 4 S+ 0 0 119 1,-0.1 4,-0.4 2,-0.1 -1,-0.2 0.771 120.7 38.9 -85.9 -29.8 18.5 7.4 4.7 84 84 A M T >> S+ 0 0 0 -6,-0.2 4,-2.8 -7,-0.2 3,-0.5 0.847 98.0 70.8 -90.3 -39.5 21.8 6.1 5.7 85 85 A K H 3X S+ 0 0 86 -4,-2.9 4,-2.9 -7,-0.4 5,-0.2 0.885 98.9 47.3 -49.4 -46.7 21.2 2.9 7.6 86 86 A P H 3> S+ 0 0 57 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.869 112.4 51.6 -70.4 -27.8 20.0 0.8 4.7 87 87 A V H <4 S+ 0 0 2 -3,-0.5 4,-0.4 -4,-0.4 3,-0.3 0.959 112.9 44.4 -66.9 -49.8 22.9 1.9 2.6 88 88 A Y H >< S+ 0 0 27 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 0.906 112.0 52.4 -59.5 -44.6 25.3 1.0 5.3 89 89 A D H 3< S+ 0 0 72 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.833 103.9 59.1 -66.9 -25.5 23.6 -2.3 6.0 90 90 A S T 3< S+ 0 0 39 -4,-1.3 -1,-0.3 -3,-0.3 2,-0.2 0.564 97.5 80.8 -75.7 -12.5 23.8 -3.3 2.4 91 91 A M S < S- 0 0 8 -3,-1.5 31,-0.0 -4,-0.4 30,-0.0 -0.623 77.3-111.8-100.5 162.0 27.7 -3.0 2.3 92 92 A D > - 0 0 57 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.170 45.2 -92.3 -77.3 174.2 30.6 -5.0 3.3 93 93 A A H > S+ 0 0 75 2,-0.2 4,-1.7 1,-0.2 -1,-0.1 0.786 119.3 49.4 -61.0 -41.5 33.0 -4.0 6.2 94 94 A V H > S+ 0 0 26 62,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.917 113.4 47.4 -68.3 -43.2 35.6 -2.0 4.4 95 95 A R H > S+ 0 0 25 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.912 108.4 54.9 -68.6 -35.8 33.0 0.1 2.6 96 96 A R H X S+ 0 0 78 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.938 105.9 53.5 -59.3 -39.5 31.1 0.6 5.9 97 97 A A H X S+ 0 0 7 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.907 105.4 53.9 -61.0 -39.8 34.4 1.9 7.3 98 98 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.875 109.7 48.5 -59.7 -40.0 34.6 4.4 4.4 99 99 A M H X S+ 0 0 3 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.899 108.2 51.7 -69.7 -42.1 31.1 5.6 5.3 100 100 A I H X S+ 0 0 10 -4,-2.6 4,-3.3 2,-0.2 5,-0.2 0.931 107.3 55.4 -59.4 -43.4 31.9 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.937 108.6 48.1 -53.0 -47.1 35.0 8.1 7.9 102 102 A M H X S+ 0 0 4 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.907 112.8 45.9 -61.0 -47.7 32.8 10.4 5.9 103 103 A V H X S+ 0 0 7 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.908 110.2 56.3 -65.6 -34.8 30.2 10.9 8.7 104 104 A F H < S+ 0 0 31 -4,-3.3 -2,-0.2 -5,-0.2 -1,-0.2 0.935 115.6 36.5 -60.0 -41.4 33.0 11.4 11.1 105 105 A Q H < S+ 0 0 56 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.889 131.6 24.5 -79.3 -43.9 34.4 14.3 9.0 106 106 A M H X S- 0 0 50 -4,-3.1 4,-0.7 -5,-0.2 -3,-0.2 0.526 103.5-111.1-114.2 2.8 31.2 15.8 7.8 107 107 A G H X - 0 0 30 -4,-2.4 4,-2.1 -5,-0.2 5,-0.2 0.220 35.1 -84.3 83.5 151.4 28.5 15.0 10.2 108 108 A E H > S+ 0 0 62 1,-0.3 4,-2.2 2,-0.2 -1,-0.1 0.811 128.8 51.3 -60.2 -36.9 25.5 12.8 9.7 109 109 A T H > S+ 0 0 116 2,-0.2 4,-0.8 1,-0.1 -1,-0.3 0.923 104.7 53.8 -65.9 -52.6 23.6 15.5 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.7 3,-1.1 1,-0.2 -2,-0.2 0.956 114.9 43.3 -50.9 -50.2 26.4 16.4 5.6 111 111 A V H >< S+ 0 0 2 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.856 101.7 65.2 -69.2 -33.9 26.5 12.8 4.4 112 112 A A H 3< S+ 0 0 17 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.706 94.9 63.1 -64.8 -13.2 22.7 12.3 4.3 113 113 A G T << S+ 0 0 57 -3,-1.1 2,-0.4 -4,-0.8 3,-0.3 0.294 74.0 89.9 -91.9 4.1 22.5 14.9 1.4 114 114 A F <> + 0 0 44 -3,-1.6 4,-2.9 1,-0.2 3,-0.3 -0.336 54.7 155.0 -90.8 48.3 24.6 12.9 -1.0 115 115 A T H > + 0 0 83 -2,-0.4 4,-1.8 1,-0.3 -1,-0.2 0.866 65.1 47.7 -46.8 -51.9 21.4 11.4 -2.0 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.916 113.2 46.4 -62.3 -43.7 22.5 10.4 -5.4 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.8 1,-0.2 -2,-0.2 0.893 109.2 56.5 -65.1 -40.7 25.7 8.8 -4.3 118 118 A L H X S+ 0 0 15 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.862 107.3 48.7 -58.9 -41.0 23.9 6.9 -1.5 119 119 A R H X S+ 0 0 134 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.929 111.9 47.6 -66.5 -42.8 21.6 5.4 -4.0 120 120 A M H <>S+ 0 0 28 -4,-1.8 5,-2.2 2,-0.2 4,-0.3 0.900 111.0 52.8 -64.9 -41.7 24.3 4.3 -6.3 121 121 A L H ><5S+ 0 0 4 -4,-2.8 3,-1.9 1,-0.2 -1,-0.2 0.921 107.8 50.1 -58.8 -45.3 26.2 2.9 -3.4 122 122 A Q H 3<5S+ 0 0 90 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.860 109.1 52.6 -65.0 -28.2 23.2 0.9 -2.4 123 123 A Q T 3<5S- 0 0 82 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.474 112.3-122.6 -82.8 0.4 23.0 -0.4 -6.0 124 124 A K T < 5 + 0 0 100 -3,-1.9 2,-1.4 -4,-0.3 -3,-0.2 0.739 62.7 146.8 62.5 29.3 26.7 -1.5 -5.8 125 125 A R >< + 0 0 108 -5,-2.2 4,-2.2 1,-0.2 5,-0.2 -0.658 20.6 172.4 -94.1 74.9 27.5 0.8 -8.8 126 126 A W H > + 0 0 47 -2,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.842 64.8 47.1 -59.2 -50.5 30.9 1.6 -7.5 127 127 A D H > S+ 0 0 103 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.918 114.9 48.9 -65.1 -34.0 32.6 3.5 -10.3 128 128 A E H > S+ 0 0 106 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.899 110.2 48.0 -69.4 -46.2 29.6 5.6 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.916 109.8 55.9 -60.3 -36.7 29.2 6.5 -7.2 130 130 A A H X S+ 0 0 13 -4,-1.9 4,-1.0 -5,-0.2 -2,-0.2 0.885 108.7 46.4 -63.1 -37.9 32.9 7.2 -7.1 131 131 A V H X S+ 0 0 93 -4,-2.0 4,-0.6 1,-0.2 3,-0.5 0.928 113.0 49.3 -69.6 -46.8 32.6 9.7 -9.9 132 132 A N H >< S+ 0 0 36 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.852 106.0 55.7 -59.4 -42.7 29.6 11.3 -8.3 133 133 A L H 3< S+ 0 0 4 -4,-2.8 6,-0.4 1,-0.2 -1,-0.2 0.830 101.2 58.8 -61.6 -31.3 31.2 11.7 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.0 2,-1.8 -3,-0.5 -1,-0.2 0.640 86.6 79.7 -70.9 -20.8 34.2 13.6 -6.4 135 135 A K S << S+ 0 0 167 -3,-0.7 2,-0.3 -4,-0.6 -1,-0.2 -0.421 82.4 96.6 -84.5 63.0 31.7 16.2 -7.7 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.0 1,-0.1 5,-0.2 -0.992 85.6-117.5-151.5 156.5 31.5 17.9 -4.3 137 137 A R H > S+ 0 0 149 -2,-0.3 4,-3.0 2,-0.2 5,-0.3 0.905 113.7 64.2 -62.0 -39.8 32.9 20.6 -2.3 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.946 105.9 43.0 -49.1 -48.5 34.3 17.9 0.1 139 139 A Y H 4 S+ 0 0 57 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.861 113.1 51.5 -70.2 -39.9 36.5 16.6 -2.7 140 140 A N H < S+ 0 0 105 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.852 115.4 42.3 -67.5 -31.8 37.6 20.1 -3.9 141 141 A Q H < S+ 0 0 99 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.864 131.3 19.2 -79.8 -41.8 38.6 21.2 -0.4 142 142 A T S X S+ 0 0 22 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 -0.632 74.0 162.1-128.6 65.0 40.4 18.1 0.9 143 143 A P H > + 0 0 49 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.853 68.4 53.4 -57.7 -45.3 41.2 16.2 -2.2 144 144 A N H > S+ 0 0 119 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.937 115.4 39.9 -60.4 -43.3 43.9 13.9 -0.9 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 3,-0.4 0.939 113.3 54.1 -70.6 -46.7 41.7 12.5 1.9 146 146 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.3 5,-0.2 0.903 107.3 52.1 -55.1 -42.9 38.6 12.4 -0.2 147 147 A K H X S+ 0 0 91 -4,-2.5 4,-2.2 1,-0.2 -1,-0.3 0.839 107.7 52.1 -60.6 -39.1 40.4 10.3 -2.8 148 148 A R H X S+ 0 0 69 -4,-1.2 4,-1.3 -3,-0.4 -1,-0.2 0.908 114.8 41.1 -61.7 -43.3 41.5 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.912 114.3 52.5 -71.2 -42.3 38.0 7.5 1.1 150 150 A I H X S+ 0 0 14 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.873 108.9 49.2 -62.2 -40.4 36.6 7.4 -2.4 151 151 A T H X S+ 0 0 43 -4,-2.2 4,-2.7 -5,-0.2 6,-0.4 0.828 109.8 52.2 -65.8 -39.6 39.0 4.6 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.917 112.4 45.2 -58.7 -45.6 38.2 2.5 -0.4 153 153 A M H < S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.919 115.7 49.3 -65.0 -40.3 34.4 2.9 -1.3 154 154 A R H < S+ 0 0 90 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.911 125.0 23.4 -61.6 -53.0 35.2 2.1 -4.9 155 155 A T H < S- 0 0 46 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.487 87.4-134.6 -94.3 -18.5 37.3 -1.0 -4.4 156 156 A G S < S+ 0 0 15 -4,-2.2 2,-0.3 -5,-0.2 -62,-0.2 0.742 73.1 104.5 60.3 23.7 36.2 -2.2 -1.1 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.2 -0.837 77.5-122.4-124.9 173.3 40.0 -2.8 -0.2 158 158 A W S > S+ 0 0 44 -2,-0.3 3,-2.1 1,-0.2 4,-0.4 0.183 71.9 119.2 -96.8 17.2 42.4 -0.8 2.0 159 159 A D G > + 0 0 95 1,-0.3 3,-1.8 2,-0.2 -1,-0.2 0.835 65.8 61.9 -56.9 -33.6 44.9 -0.2 -0.7 160 160 A A G 3 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.689 106.3 49.9 -63.6 -19.0 44.6 3.6 -0.5 161 161 A Y G < 0 0 19 -3,-2.1 -1,-0.3 -13,-0.1 -2,-0.2 0.475 360.0 360.0-102.6 3.6 45.9 3.3 3.0 162 162 A K < 0 0 190 -3,-1.8 -2,-0.1 -4,-0.4 -3,-0.1 0.859 360.0 360.0 -98.0 360.0 49.0 1.0 2.4