==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-JAN-99 257L . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.W.WRAY,W.A.BAASE,G.J.OSTHEIMER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8539.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 72.2 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 0 1 2 1 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 80 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 162.4 43.7 -1.9 8.9 2 2 A N > - 0 0 68 156,-0.0 4,-2.9 95,-0.0 5,-0.2 -0.957 360.0 -84.9-159.9 169.8 40.5 -0.7 10.6 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.827 122.3 53.2 -53.4 -35.2 38.5 2.3 11.1 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.956 112.9 42.6 -68.2 -44.1 40.5 3.6 14.0 5 5 A E H > S+ 0 0 98 1,-0.2 4,-2.2 -3,-0.2 -2,-0.2 0.909 113.6 55.1 -66.1 -36.0 43.8 3.4 12.2 6 6 A M H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.942 112.9 39.0 -60.3 -52.9 42.2 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 -5,-0.2 5,-0.4 0.815 109.0 61.3 -72.2 -27.4 40.9 7.9 10.8 8 8 A R H X S+ 0 0 104 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.937 108.9 45.5 -62.6 -36.1 44.0 8.2 12.9 9 9 A I H < S+ 0 0 87 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.934 115.9 43.7 -68.8 -46.0 45.7 8.6 9.5 10 10 A D H < S+ 0 0 14 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.829 125.9 32.5 -68.9 -36.2 43.1 11.1 8.0 11 11 A E H < S- 0 0 45 -4,-2.8 19,-0.4 -5,-0.2 -2,-0.2 0.766 91.3-155.8 -95.8 -27.6 42.9 13.2 11.2 12 12 A G < - 0 0 22 -4,-2.2 2,-0.4 -5,-0.4 18,-0.1 -0.111 26.8 -82.1 76.8-173.8 46.4 13.0 12.7 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.969 44.8 169.3-137.0 119.8 47.0 13.6 16.5 14 14 A R E -A 28 0A 124 14,-1.5 14,-2.6 -2,-0.4 4,-0.1 -0.998 18.9-167.0-135.9 132.4 47.4 17.0 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.4 12,-0.2 2,-0.3 0.381 73.6 63.6 -98.6 -3.7 47.5 17.6 21.9 16 16 A K E S-C 57 0B 97 41,-0.2 12,-0.2 12,-0.1 41,-0.2 -0.917 99.4 -90.9-121.3 151.5 47.1 21.3 21.8 17 17 A I E + 0 0 19 39,-1.4 2,-0.3 -2,-0.3 10,-0.2 -0.347 57.3 170.4 -59.1 133.1 44.0 23.2 20.5 18 18 A Y E -A 26 0A 27 8,-3.1 8,-3.0 -4,-0.1 2,-0.4 -0.857 37.0-101.3-139.8 171.1 44.4 23.9 16.9 19 19 A K E -A 25 0A 135 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.821 35.2-142.5 -94.3 128.4 42.5 25.2 13.8 20 20 A D > - 0 0 45 4,-3.2 3,-1.3 -2,-0.4 -1,-0.1 -0.122 40.2 -82.2 -77.3-174.2 41.3 22.6 11.4 21 21 A H T 3 S+ 0 0 97 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.676 134.3 48.8 -62.9 -22.5 41.3 23.1 7.6 22 22 A E T 3 S- 0 0 75 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.369 125.4-107.3 -92.4 -8.0 37.9 25.0 7.8 23 23 A G S < S+ 0 0 32 -3,-1.3 2,-0.3 1,-0.3 -2,-0.2 0.674 71.7 141.8 86.7 29.3 39.5 27.0 10.5 24 24 A Y - 0 0 76 1,-0.0 -4,-3.2 9,-0.0 2,-0.3 -0.802 58.6 -97.8-107.2 153.2 37.6 25.6 13.5 25 25 A Y E +AB 19 34A 33 9,-0.8 8,-2.9 11,-0.5 9,-1.8 -0.492 56.3 155.4 -67.6 120.6 38.9 24.8 16.9 26 26 A T E -AB 18 32A 4 -8,-3.0 -8,-3.1 -2,-0.3 2,-0.3 -0.865 20.0-169.4-138.8 170.0 39.7 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.1 -2,-0.3 2,-0.2 -0.977 50.6 5.5-159.2 158.7 41.9 18.8 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 -0.440 122.2 -4.8 75.0-131.2 43.1 15.3 19.5 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.674 128.7 -52.9-101.6 72.9 42.2 13.1 16.7 30 30 A G T 4 S+ 0 0 13 -2,-1.1 2,-1.0 -19,-0.4 -2,-0.2 0.768 83.3 163.0 70.2 25.4 40.0 15.3 14.8 31 31 A H E < -B 27 0A 31 -4,-2.1 -4,-1.6 -20,-0.1 2,-0.3 -0.640 31.2-143.1 -80.1 105.0 37.8 16.2 17.7 32 32 A L E -B 26 0A 76 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.366 19.1-177.0 -65.5 127.9 35.9 19.4 16.8 33 33 A L E - 0 0 14 -8,-2.9 2,-0.3 1,-0.4 -7,-0.2 0.936 58.1 -25.7 -91.5 -47.3 35.5 21.6 19.7 34 34 A T E -B 25 0A 28 -9,-1.8 -9,-0.8 2,-0.1 -1,-0.4 -0.981 35.7-136.6-163.0 154.5 33.5 24.4 18.4 35 35 A K S S+ 0 0 148 -2,-0.3 -1,-0.1 -11,-0.2 -9,-0.0 0.666 75.3 111.7 -86.5 -19.1 32.6 26.2 15.3 36 36 A S S S- 0 0 38 1,-0.1 -11,-0.5 -3,-0.1 -2,-0.1 -0.185 72.0-134.0 -57.7 146.9 33.0 29.5 17.2 37 37 A P S S+ 0 0 126 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.380 75.8 102.7 -81.7 4.9 35.8 31.9 16.5 38 38 A S > - 0 0 46 1,-0.1 4,-2.2 -13,-0.0 5,-0.2 -0.783 57.4-157.8 -96.9 128.5 36.5 32.3 20.3 39 39 A L H > S+ 0 0 67 -2,-0.5 4,-2.3 1,-0.2 -1,-0.1 0.773 96.1 52.1 -68.1 -30.2 39.4 30.6 21.9 40 40 A N H > S+ 0 0 112 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.902 106.1 53.3 -74.9 -36.5 37.9 30.8 25.2 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.938 111.3 47.0 -59.1 -44.5 34.8 29.3 24.0 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.914 110.5 52.9 -62.3 -43.1 36.9 26.5 22.7 43 43 A K H X S+ 0 0 50 -4,-2.3 4,-2.2 1,-0.2 11,-0.3 0.853 109.7 48.4 -60.5 -37.3 38.8 26.2 25.9 44 44 A S H X S+ 0 0 68 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.876 108.8 51.4 -71.1 -45.3 35.5 25.9 27.8 45 45 A E H X S+ 0 0 67 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.911 110.8 51.1 -60.8 -39.3 34.2 23.3 25.6 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.2 5,-0.4 0.967 108.3 49.6 -59.9 -48.8 37.4 21.4 26.1 47 47 A D H X>S+ 0 0 31 -4,-2.2 4,-2.4 1,-0.2 5,-1.9 0.910 113.1 48.6 -54.0 -40.0 37.3 21.6 29.9 48 48 A K H <5S+ 0 0 140 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.825 111.7 48.2 -69.3 -37.4 33.8 20.4 29.7 49 49 A A H <5S+ 0 0 42 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.902 121.2 35.6 -71.4 -39.5 34.6 17.5 27.4 50 50 A I H <5S- 0 0 35 -4,-3.0 -2,-0.2 2,-0.2 -1,-0.2 0.721 104.1-126.4 -86.8 -31.7 37.5 16.3 29.4 51 51 A G T <5S+ 0 0 63 -4,-2.4 2,-0.3 -5,-0.4 -3,-0.2 0.856 74.8 74.1 85.7 31.4 36.1 17.1 32.8 52 52 A R S - 0 0 9 -2,-0.8 3,-1.2 -11,-0.3 -1,-0.2 0.717 34.2-145.8 -97.3 -30.0 42.9 21.9 30.7 55 55 A N T 3 S- 0 0 113 1,-0.2 3,-0.1 -12,-0.2 -2,-0.1 0.892 74.6 -59.6 62.1 35.4 44.3 25.2 29.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.4 1,-0.1 2,-0.4 0.533 114.9 101.8 68.1 15.5 44.1 23.8 26.0 57 57 A V B < +C 16 0B 66 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.968 43.7 175.9-131.5 139.3 46.3 20.9 26.4 58 58 A I - 0 0 5 -43,-2.4 2,-0.3 -2,-0.4 -30,-0.1 -0.799 26.0-110.5-131.5 174.0 45.5 17.3 26.8 59 59 A T > - 0 0 64 -2,-0.3 4,-3.0 1,-0.1 3,-0.4 -0.679 30.9-107.9-101.8 164.4 47.2 14.1 27.1 60 60 A K H > S+ 0 0 102 1,-0.3 4,-2.8 -2,-0.3 5,-0.2 0.862 119.8 53.5 -54.5 -43.0 47.3 11.2 24.7 61 61 A D H > S+ 0 0 120 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.903 110.5 48.2 -61.8 -37.5 45.1 9.1 26.9 62 62 A E H > S+ 0 0 42 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.905 109.7 51.4 -67.9 -43.8 42.6 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -34,-0.4 0.944 111.3 49.1 -58.1 -45.1 42.8 12.3 23.1 64 64 A E H X S+ 0 0 74 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.826 106.4 55.4 -63.7 -36.0 42.2 8.6 22.7 65 65 A K H X S+ 0 0 136 -4,-1.6 4,-2.3 -5,-0.2 -1,-0.2 0.924 108.9 46.4 -66.9 -43.5 39.2 8.6 25.0 66 66 A L H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.901 111.3 54.0 -64.5 -36.0 37.5 11.3 23.0 67 67 A F H X S+ 0 0 14 -4,-2.2 4,-3.1 2,-0.2 5,-0.4 0.969 107.2 50.5 -65.8 -44.9 38.3 9.4 19.8 68 68 A N H X S+ 0 0 87 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.935 112.5 46.7 -54.3 -48.1 36.7 6.3 21.1 69 69 A Q H X S+ 0 0 93 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.873 112.6 50.0 -60.4 -37.3 33.6 8.3 22.0 70 70 A D H X S+ 0 0 34 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.888 110.2 48.2 -76.8 -35.0 33.5 10.0 18.6 71 71 A V H X S+ 0 0 8 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.938 113.4 50.0 -69.7 -35.6 33.8 6.8 16.6 72 72 A D H X S+ 0 0 85 -4,-2.1 4,-2.5 -5,-0.4 -2,-0.2 0.923 108.8 49.5 -63.4 -47.7 31.1 5.3 18.7 73 73 A A H X S+ 0 0 42 -4,-2.0 4,-3.2 2,-0.2 -1,-0.2 0.896 110.7 53.3 -57.1 -41.1 28.8 8.2 18.3 74 74 A A H X S+ 0 0 10 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.980 109.3 45.7 -61.7 -56.2 29.3 8.0 14.5 75 75 A V H X S+ 0 0 37 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.951 117.9 45.2 -50.9 -49.8 28.5 4.3 14.2 76 76 A R H X S+ 0 0 114 -4,-2.5 4,-1.2 -5,-0.2 -1,-0.2 0.923 110.1 54.8 -64.2 -42.2 25.4 4.8 16.4 77 77 A G H >X S+ 0 0 2 -4,-3.2 4,-1.6 1,-0.2 3,-1.1 0.951 109.1 46.1 -54.4 -55.7 24.5 7.9 14.5 78 78 A I H >< S+ 0 0 0 -4,-2.9 3,-0.6 1,-0.3 7,-0.2 0.922 112.5 51.9 -53.6 -45.2 24.5 6.1 11.2 79 79 A L H 3< S+ 0 0 65 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.641 110.6 47.5 -73.0 -14.7 22.5 3.2 12.7 80 80 A R H << S+ 0 0 169 -4,-1.2 2,-0.4 -3,-1.1 -1,-0.3 0.627 93.6 94.8 -94.6 -21.7 20.0 5.5 14.0 81 81 A N S+ 0 0 133 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.891 119.5 40.2 -83.1 -38.5 18.8 7.4 5.3 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.824 101.9 68.8 -82.2 -33.6 22.2 6.0 6.3 85 85 A K H X S+ 0 0 82 -4,-3.3 4,-3.0 -7,-0.2 5,-0.2 0.925 97.8 48.2 -54.9 -48.5 21.2 2.8 7.9 86 86 A P H > S+ 0 0 46 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.895 113.8 50.0 -62.0 -34.4 20.0 1.0 4.8 87 87 A V H X S+ 0 0 1 -4,-0.6 4,-0.8 2,-0.2 3,-0.4 0.942 111.4 45.6 -67.4 -53.7 23.2 2.0 3.1 88 88 A Y H >< S+ 0 0 35 -4,-2.8 3,-1.3 1,-0.2 -1,-0.2 0.928 109.6 56.7 -51.1 -48.1 25.4 0.9 5.8 89 89 A D H 3< S+ 0 0 79 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.826 105.6 53.5 -58.2 -29.2 23.5 -2.4 6.1 90 90 A S H 3< S+ 0 0 37 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.689 95.5 89.3 -80.8 -18.2 24.1 -3.0 2.4 91 91 A L S << S- 0 0 6 -3,-1.3 31,-0.0 -4,-0.8 2,-0.0 -0.443 71.9-119.1 -89.1 160.1 27.8 -2.7 2.5 92 92 A D > - 0 0 55 -2,-0.2 4,-2.1 1,-0.0 -1,-0.1 -0.211 45.2 -89.9 -75.7 172.8 30.7 -4.9 3.0 93 93 A A H > S+ 0 0 80 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.875 119.5 45.5 -56.9 -48.7 33.2 -4.4 5.9 94 94 A V H > S+ 0 0 25 1,-0.2 4,-1.7 62,-0.2 3,-0.5 0.955 114.1 47.5 -65.0 -48.8 35.7 -2.1 4.2 95 95 A R H > S+ 0 0 23 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.882 103.4 62.2 -61.9 -33.1 33.3 0.1 2.7 96 96 A R H X S+ 0 0 82 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.953 102.8 52.2 -58.3 -35.5 31.3 0.4 5.9 97 97 A A H X S+ 0 0 8 -4,-1.4 4,-2.6 -3,-0.5 -1,-0.2 0.888 104.8 56.4 -64.9 -39.9 34.5 2.0 7.5 98 98 A A H X S+ 0 0 0 -4,-1.7 4,-1.6 1,-0.2 -1,-0.3 0.884 106.9 48.0 -61.5 -37.1 34.5 4.4 4.6 99 99 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.911 109.3 53.5 -70.3 -36.9 31.0 5.6 5.4 100 100 A I H X S+ 0 0 8 -4,-2.6 4,-3.4 -5,-0.2 5,-0.3 0.945 104.4 57.3 -59.8 -37.1 32.0 5.9 9.1 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.937 107.9 45.6 -60.8 -44.5 34.9 8.1 8.1 102 102 A M H X S+ 0 0 3 -4,-1.6 4,-3.3 2,-0.2 5,-0.3 0.896 113.2 48.0 -68.9 -41.4 32.6 10.6 6.3 103 103 A V H X S+ 0 0 8 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.923 110.0 55.1 -67.0 -40.8 30.0 10.8 9.1 104 104 A F H < S+ 0 0 30 -4,-3.4 -1,-0.2 -5,-0.3 -2,-0.2 0.916 116.4 37.8 -53.5 -43.9 32.9 11.3 11.6 105 105 A Q H < S+ 0 0 49 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.894 133.9 17.7 -78.9 -43.2 34.0 14.1 9.6 106 106 A M H X S- 0 0 54 -4,-3.3 4,-0.7 -5,-0.2 -3,-0.2 0.518 99.5-115.4-113.1 -6.5 30.9 15.7 8.5 107 107 A G H X - 0 0 28 -4,-2.7 4,-2.4 -5,-0.3 5,-0.2 0.078 34.5 -80.0 87.6 156.8 28.1 14.5 10.6 108 108 A E H > S+ 0 0 63 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.771 129.3 52.8 -61.5 -45.6 25.1 12.5 9.8 109 109 A T H > S+ 0 0 125 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.895 108.7 50.5 -60.8 -43.4 23.3 15.4 8.4 110 110 A G H >< S+ 0 0 30 -4,-0.7 3,-1.0 1,-0.2 -2,-0.2 0.951 116.6 39.1 -60.2 -53.3 26.1 16.2 6.2 111 111 A V H >< S+ 0 0 1 -4,-2.4 3,-2.9 1,-0.3 -1,-0.2 0.897 105.4 63.7 -67.6 -42.7 26.4 12.8 4.8 112 112 A A H 3< S+ 0 0 20 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.677 94.8 67.9 -56.4 -16.0 22.7 12.1 4.6 113 113 A G T << S+ 0 0 55 -3,-1.0 2,-1.5 -4,-0.6 3,-0.3 0.517 73.8 85.1 -81.7 -8.3 22.8 14.9 2.0 114 114 A F <> + 0 0 39 -3,-2.9 4,-2.4 1,-0.2 5,-0.3 -0.355 57.8 159.5 -85.8 53.2 24.7 13.0 -0.6 115 115 A T H > + 0 0 85 -2,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.871 64.9 43.4 -44.2 -54.6 21.5 11.6 -1.7 116 116 A N H > S+ 0 0 81 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.941 113.3 47.8 -64.0 -48.9 22.6 10.5 -5.1 117 117 A S H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.863 109.3 57.2 -61.3 -33.7 25.9 9.0 -4.2 118 118 A L H X S+ 0 0 12 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.926 105.8 48.6 -59.9 -42.0 24.2 7.1 -1.4 119 119 A R H X S+ 0 0 113 -4,-1.7 4,-2.1 1,-0.3 -1,-0.2 0.892 109.9 52.5 -69.4 -33.2 21.8 5.5 -3.8 120 120 A M H <>S+ 0 0 27 -4,-2.0 5,-2.5 1,-0.2 4,-0.3 0.835 108.4 50.4 -69.8 -32.0 24.6 4.5 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-1.8 3,-1.2 2,-0.2 -2,-0.2 0.898 108.5 52.0 -70.8 -39.6 26.4 2.9 -3.1 122 122 A Q H 3<5S+ 0 0 97 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.913 110.7 48.8 -59.9 -37.7 23.3 1.0 -2.2 123 123 A Q T 3<5S- 0 0 101 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.490 111.9-122.1 -80.0 -6.0 23.1 -0.2 -5.8 124 124 A K T < 5 + 0 0 102 -3,-1.2 2,-1.2 -4,-0.3 -3,-0.2 0.778 62.0 145.4 68.5 31.5 26.8 -1.2 -5.8 125 125 A R >< + 0 0 111 -5,-2.5 4,-2.7 1,-0.2 -1,-0.2 -0.671 21.3 173.4-101.2 73.2 27.7 1.0 -8.8 126 126 A W H > S+ 0 0 48 -2,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.863 70.8 45.5 -52.5 -54.9 31.2 1.8 -7.4 127 127 A D H > S+ 0 0 108 -3,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.940 115.4 49.6 -64.6 -36.8 32.7 3.8 -10.3 128 128 A E H > S+ 0 0 107 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.939 110.9 47.6 -65.7 -42.6 29.5 5.8 -10.6 129 129 A A H X S+ 0 0 1 -4,-2.7 4,-3.0 -9,-0.2 -1,-0.2 0.910 109.0 56.7 -60.3 -40.3 29.3 6.7 -6.9 130 130 A A H X S+ 0 0 11 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.862 108.0 45.9 -58.6 -42.3 33.0 7.6 -7.0 131 131 A V H < S+ 0 0 95 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.910 114.3 49.0 -66.3 -44.4 32.5 10.2 -9.7 132 132 A N H >< S+ 0 0 37 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.864 106.2 55.6 -63.7 -44.2 29.4 11.6 -8.0 133 133 A L H 3< S+ 0 0 2 -4,-3.0 6,-0.4 1,-0.2 -1,-0.2 0.904 102.2 58.7 -54.0 -39.9 31.2 11.8 -4.6 134 134 A A T 3< S+ 0 0 27 -4,-1.6 2,-1.6 1,-0.2 -1,-0.2 0.597 86.3 79.9 -66.8 -15.3 34.0 14.0 -6.2 135 135 A K S < S+ 0 0 168 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.2 -0.566 81.7 93.4 -94.3 68.2 31.5 16.6 -7.3 136 136 A S S > S- 0 0 17 -2,-1.6 4,-2.4 1,-0.1 5,-0.1 -0.993 84.8-115.7-156.9 155.4 31.3 18.2 -4.0 137 137 A R H > S+ 0 0 151 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.892 115.8 60.6 -57.1 -40.8 32.7 20.9 -1.8 138 138 A W H > S+ 0 0 21 1,-0.2 4,-1.4 2,-0.2 8,-0.2 0.940 108.4 41.0 -55.0 -50.5 34.0 18.2 0.4 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 3,-0.2 1,-0.2 -1,-0.2 0.931 114.5 53.7 -64.1 -44.9 36.1 16.8 -2.3 140 140 A N H < S+ 0 0 107 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.849 113.0 40.4 -60.9 -35.9 37.1 20.3 -3.6 141 141 A Q H < S+ 0 0 98 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.720 128.6 29.2 -84.5 -25.3 38.4 21.5 -0.2 142 142 A H X + 0 0 47 -4,-1.4 4,-2.9 -5,-0.3 5,-0.3 -0.492 68.0 162.6-137.9 66.3 40.2 18.3 0.8 143 143 A P H > S+ 0 0 51 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.893 72.4 49.6 -53.9 -46.9 41.2 16.5 -2.2 144 144 A N H > S+ 0 0 101 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.917 116.2 39.9 -66.0 -42.6 43.7 14.2 -0.7 145 145 A R H > S+ 0 0 5 2,-0.2 4,-2.4 -3,-0.2 3,-0.3 0.935 115.0 51.8 -69.2 -52.0 41.5 12.9 2.1 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-3.2 1,-0.2 5,-0.3 0.933 107.1 55.8 -52.7 -45.2 38.4 12.7 -0.1 147 147 A K H X S+ 0 0 80 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.903 107.1 48.3 -53.6 -44.3 40.4 10.7 -2.7 148 148 A R H X S+ 0 0 67 -4,-1.4 4,-1.8 -3,-0.3 -1,-0.2 0.949 114.3 45.7 -62.7 -43.5 41.4 8.1 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.939 114.3 48.3 -63.4 -47.5 37.8 7.8 1.1 150 150 A I H X S+ 0 0 13 -4,-3.2 4,-2.0 1,-0.2 -1,-0.2 0.859 108.4 53.1 -59.4 -42.2 36.5 7.6 -2.4 151 151 A T H X S+ 0 0 37 -4,-2.5 4,-2.8 -5,-0.3 6,-0.4 0.821 106.1 55.0 -64.3 -32.5 39.0 5.0 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-3.4 2,-0.2 5,-0.3 0.917 109.1 46.4 -65.6 -40.1 38.0 2.8 -0.6 153 153 A F H < S+ 0 0 2 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.866 115.7 47.6 -68.6 -35.1 34.4 3.0 -1.8 154 154 A R H < S+ 0 0 100 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.923 124.5 27.7 -71.1 -48.1 35.5 2.2 -5.3 155 155 A T H < S- 0 0 46 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.683 83.3-139.1 -91.0 -30.3 37.7 -0.7 -4.5 156 156 A G S < S+ 0 0 17 -4,-3.4 2,-0.2 1,-0.3 -62,-0.2 0.690 75.9 100.2 74.5 12.2 36.4 -2.2 -1.3 157 157 A T S S- 0 0 49 -6,-0.4 -1,-0.3 -5,-0.3 3,-0.3 -0.762 81.0-122.5-124.7 178.1 40.1 -2.5 -0.3 158 158 A W S >> S+ 0 0 45 -2,-0.2 3,-2.4 1,-0.2 4,-1.3 0.164 70.4 120.0-101.8 10.4 42.5 -0.4 1.9 159 159 A D G >4 + 0 0 95 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.887 66.6 61.3 -47.6 -40.0 45.0 0.3 -0.8 160 160 A A G 34 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.731 113.6 38.1 -62.5 -17.6 44.6 4.1 -0.5 161 161 A Y G <4 0 0 19 -3,-2.4 -1,-0.3 -13,-0.1 -2,-0.2 0.545 360.0 360.0-108.1 -13.1 45.8 3.8 3.0 162 162 A K << 0 0 175 -4,-1.3 -3,-0.1 -3,-0.7 -2,-0.1 0.959 360.0 360.0 -85.0 360.0 48.5 1.1 2.6