==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-DEC-99 1C62 . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.L.QUILLIN,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8744.0 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 . 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 83 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.9 43.5 -1.8 9.1 2 2 A N > - 0 0 65 156,-0.0 4,-2.4 95,-0.0 5,-0.2 -0.925 360.0 -76.2-160.7 179.0 40.3 -0.7 10.6 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.819 125.0 52.4 -53.4 -42.6 38.2 2.4 11.3 4 4 A F H > S+ 0 0 77 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.969 114.9 40.7 -62.2 -50.6 40.3 3.5 14.2 5 5 A E H > S+ 0 0 92 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.817 114.4 54.1 -64.1 -35.2 43.6 3.3 12.2 6 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 3,-0.3 0.946 112.8 40.6 -64.9 -53.2 42.0 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 5,-0.3 0.796 108.9 60.1 -68.9 -26.4 40.7 7.8 10.9 8 8 A R H X S+ 0 0 102 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.857 108.7 48.4 -69.0 -29.4 43.9 8.2 13.0 9 9 A I H < S+ 0 0 86 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.919 114.3 42.2 -69.8 -49.9 45.6 8.5 9.6 10 10 A D H < S+ 0 0 20 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.787 125.8 32.3 -71.1 -32.6 43.3 11.0 8.1 11 11 A E H < S- 0 0 50 -4,-2.2 19,-0.3 -5,-0.2 -2,-0.2 0.698 90.8-154.8 -98.6 -28.6 43.0 13.1 11.2 12 12 A G < - 0 0 24 -4,-1.7 2,-0.4 -5,-0.3 -1,-0.1 -0.233 25.0 -82.6 79.6-177.6 46.3 12.9 12.9 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.980 41.8 175.0-135.1 122.9 46.9 13.4 16.6 14 14 A R E -A 28 0A 125 14,-1.5 14,-2.3 -2,-0.4 4,-0.1 -0.969 19.3-166.0-138.3 125.3 47.3 16.8 18.4 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.5 12,-0.1 2,-0.3 0.527 76.1 57.1 -78.6 -12.3 47.6 17.4 22.2 16 16 A K E S-C 57 0B 101 41,-0.2 12,-0.3 12,-0.1 41,-0.2 -0.864 102.3 -84.7-119.3 153.7 47.0 21.2 22.1 17 17 A I E + 0 0 21 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.310 57.9 172.2 -59.0 138.4 44.1 23.0 20.7 18 18 A Y E -A 26 0A 17 8,-3.1 8,-3.2 -4,-0.1 2,-0.4 -0.779 31.6-107.0-134.8 179.2 44.5 23.5 17.0 19 19 A K E -A 25 0A 120 -2,-0.3 6,-0.3 6,-0.2 13,-0.0 -0.917 31.0-135.0-113.7 137.7 42.5 24.8 14.1 20 20 A D > - 0 0 50 4,-3.9 3,-2.6 -2,-0.4 -1,-0.0 -0.098 39.0 -81.9 -81.6-173.7 41.1 22.5 11.5 21 21 A T T 3 S+ 0 0 103 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.714 133.1 50.3 -53.5 -32.2 41.0 22.8 7.6 22 22 A E T 3 S- 0 0 74 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.238 126.3-101.4 -92.6 3.9 38.0 25.0 8.0 23 23 A G S < S+ 0 0 40 -3,-2.6 2,-0.3 1,-0.3 -2,-0.2 0.577 75.4 144.4 87.7 15.2 39.7 27.2 10.6 24 24 A Y - 0 0 75 1,-0.1 -4,-3.9 -5,-0.0 2,-0.3 -0.713 57.3-105.2-100.7 150.8 37.9 25.6 13.5 25 25 A Y E +AB 19 34A 33 9,-0.6 8,-2.6 11,-0.4 9,-1.6 -0.450 54.4 154.4 -67.4 120.0 39.1 24.9 17.0 26 26 A T E -AB 18 32A 4 -8,-3.2 -8,-3.1 -2,-0.3 2,-0.3 -0.920 22.1-164.4-141.4 161.9 39.7 21.2 17.3 27 27 A I E > - B 0 31A 0 4,-2.1 4,-2.3 -2,-0.3 2,-0.4 -0.998 49.8 -0.8-149.8 161.0 41.8 19.0 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.5 -2,-0.3 2,-0.9 -0.528 123.0 -2.5 71.9-129.2 43.1 15.4 19.5 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -2,-0.4 -17,-0.1 -0.642 129.5 -56.4-100.0 67.9 42.1 13.1 16.8 30 30 A G T 4 S+ 0 0 14 -2,-0.9 2,-1.1 -19,-0.3 -2,-0.2 0.762 82.3 163.2 67.3 33.1 39.9 15.5 15.0 31 31 A H E < -B 27 0A 32 -4,-2.3 -4,-2.1 1,-0.0 2,-0.2 -0.669 31.4-142.8 -85.3 100.6 37.6 16.2 17.9 32 32 A L E -B 26 0A 73 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.391 20.7-178.1 -64.9 131.7 35.9 19.4 16.9 33 33 A L E - 0 0 14 -8,-2.6 2,-0.3 1,-0.3 -7,-0.2 0.886 56.1 -25.5 -99.8 -39.3 35.3 21.7 19.8 34 34 A T E -B 25 0A 29 -9,-1.6 -9,-0.6 2,-0.1 -1,-0.3 -0.960 34.7-133.8-169.6 157.8 33.4 24.7 18.4 35 35 A K S S+ 0 0 146 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.359 76.9 107.8 -94.0 -1.3 32.7 26.8 15.3 36 36 A S S S- 0 0 43 2,-0.1 -11,-0.4 1,-0.1 6,-0.1 -0.514 74.3-131.3 -84.2 148.6 33.2 29.9 17.2 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.476 74.7 106.9 -75.5 -5.2 36.2 32.2 16.8 38 38 A S > - 0 0 44 1,-0.2 4,-2.6 -13,-0.0 5,-0.2 -0.708 53.1-163.7 -90.4 119.1 36.8 32.3 20.5 39 39 A L H > S+ 0 0 72 -2,-0.6 4,-2.9 2,-0.2 -1,-0.2 0.904 95.6 54.5 -63.9 -38.7 39.7 30.5 21.9 40 40 A N H > S+ 0 0 122 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.922 107.0 50.1 -62.5 -40.4 38.1 30.9 25.4 41 41 A A H > S+ 0 0 28 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.954 109.5 49.8 -62.2 -45.6 35.0 29.3 24.1 42 42 A A H X S+ 0 0 0 -4,-2.6 4,-3.5 1,-0.2 -2,-0.2 0.936 110.5 52.9 -59.8 -36.9 37.0 26.5 22.7 43 43 A K H X S+ 0 0 64 -4,-2.9 4,-2.7 2,-0.2 11,-0.2 0.927 108.0 48.7 -63.0 -39.9 38.6 26.2 26.1 44 44 A S H X S+ 0 0 74 -4,-2.8 4,-2.4 2,-0.2 5,-0.3 0.960 112.2 49.1 -61.1 -53.4 35.3 26.0 27.9 45 45 A E H X S+ 0 0 67 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.929 111.4 50.2 -55.2 -47.9 34.1 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-3.5 4,-2.4 1,-0.2 5,-0.3 0.933 110.6 47.8 -58.6 -49.1 37.4 21.4 26.0 47 47 A D H X>S+ 0 0 33 -4,-2.7 4,-1.6 1,-0.2 5,-1.3 0.855 112.6 48.9 -61.1 -35.3 37.2 21.5 29.8 48 48 A K H <5S+ 0 0 147 -4,-2.4 -1,-0.2 -3,-0.2 -2,-0.2 0.866 111.8 49.5 -69.2 -41.9 33.6 20.4 29.8 49 49 A A H <5S+ 0 0 45 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.903 120.4 36.9 -64.6 -36.8 34.3 17.5 27.4 50 50 A I H <5S- 0 0 35 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.681 101.9-124.9 -92.3 -22.0 37.3 16.4 29.6 51 51 A G T <5S+ 0 0 70 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.2 0.771 78.3 68.1 84.5 19.8 36.0 17.0 33.0 52 52 A R S - 0 0 7 -2,-1.0 3,-1.1 -11,-0.2 -1,-0.2 0.749 30.8-143.8 -87.4 -22.7 42.9 21.6 30.8 55 55 A N T 3 S- 0 0 123 1,-0.2 3,-0.1 -12,-0.1 -12,-0.1 0.668 73.9 -58.1 66.2 9.4 44.4 25.0 30.0 56 56 A G T 3 S+ 0 0 6 1,-0.3 -39,-1.8 -13,-0.2 2,-0.4 0.593 117.7 98.8 97.6 2.8 44.1 23.8 26.2 57 57 A V B < -C 16 0B 74 -3,-1.1 2,-0.3 -41,-0.2 -1,-0.3 -0.979 45.5-180.0-125.5 140.3 46.2 20.7 26.6 58 58 A I - 0 0 4 -43,-2.5 2,-0.1 -2,-0.4 -30,-0.1 -0.902 26.6-110.1-135.7 163.3 45.2 17.1 27.0 59 59 A T > - 0 0 57 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.411 34.9-104.3 -85.9 170.9 47.0 13.9 27.3 60 60 A K H > S+ 0 0 113 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.899 120.7 49.0 -58.5 -48.6 47.1 11.1 24.7 61 61 A D H > S+ 0 0 108 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.895 108.3 54.2 -59.5 -44.4 44.6 8.9 26.6 62 62 A E H > S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.953 110.6 47.8 -57.6 -46.8 42.2 11.9 26.9 63 63 A A H X S+ 0 0 1 -4,-2.5 4,-1.5 1,-0.2 -34,-0.4 0.897 110.7 50.3 -59.0 -42.8 42.5 12.3 23.2 64 64 A E H X S+ 0 0 80 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.840 108.3 54.8 -64.7 -35.2 41.9 8.6 22.6 65 65 A K H X S+ 0 0 140 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.953 108.1 45.8 -64.2 -51.7 38.9 8.7 24.9 66 66 A L H X S+ 0 0 6 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.867 112.9 54.0 -56.8 -36.6 37.2 11.5 22.9 67 67 A F H X S+ 0 0 12 -4,-1.5 4,-3.0 -5,-0.3 5,-0.3 0.936 105.6 50.9 -67.3 -42.6 38.1 9.6 19.8 68 68 A N H X S+ 0 0 84 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.933 112.6 46.5 -58.7 -45.9 36.4 6.5 21.0 69 69 A Q H X S+ 0 0 97 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.880 111.9 51.8 -65.2 -40.8 33.3 8.5 21.8 70 70 A D H X S+ 0 0 35 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.904 111.7 45.7 -62.5 -41.8 33.4 10.2 18.4 71 71 A V H X S+ 0 0 6 -4,-3.0 4,-2.1 -5,-0.2 5,-0.2 0.952 113.6 50.1 -65.8 -45.0 33.7 7.0 16.5 72 72 A D H X S+ 0 0 108 -4,-2.6 4,-2.3 -5,-0.3 5,-0.3 0.955 110.9 47.6 -58.3 -43.9 30.9 5.5 18.6 73 73 A A H X S+ 0 0 63 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.894 108.1 58.3 -66.8 -35.2 28.6 8.4 18.0 74 74 A A H X S+ 0 0 9 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.946 109.0 42.5 -58.9 -50.0 29.4 8.2 14.2 75 75 A V H X S+ 0 0 36 -4,-2.1 4,-3.2 1,-0.2 -2,-0.2 0.944 116.2 49.2 -58.1 -49.3 28.2 4.6 13.9 76 76 A R H X S+ 0 0 162 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.894 107.3 53.5 -61.5 -43.0 25.2 5.3 16.0 77 77 A G H X S+ 0 0 13 -4,-2.6 4,-0.9 -5,-0.3 -1,-0.2 0.946 110.3 49.5 -59.6 -38.1 24.4 8.3 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 7,-0.4 0.973 111.0 48.9 -60.9 -51.3 24.5 6.2 10.9 79 79 A L H 3< S+ 0 0 68 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.703 109.7 50.3 -61.9 -26.7 22.3 3.6 12.4 80 80 A R H 3< S+ 0 0 230 -4,-1.9 2,-0.6 -3,-0.2 -1,-0.3 0.507 93.2 95.0 -87.8 -10.0 19.7 6.1 13.6 81 81 A N S+ 0 0 125 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.804 119.2 44.5 -91.8 -29.7 18.8 7.5 4.8 84 84 A L H > S+ 0 0 0 -7,-0.1 4,-2.1 1,-0.1 3,-0.5 0.925 99.3 63.7 -79.7 -42.9 22.0 6.2 6.0 85 85 A K H X S+ 0 0 84 -4,-3.5 4,-3.3 -7,-0.4 5,-0.4 0.907 98.9 52.5 -49.5 -49.6 21.2 2.9 7.6 86 86 A P H > S+ 0 0 57 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.868 111.1 48.6 -59.5 -34.4 20.0 1.0 4.6 87 87 A V H X S+ 0 0 5 -4,-0.6 4,-0.8 -3,-0.5 -2,-0.2 0.945 112.9 46.6 -71.7 -43.2 23.1 1.8 2.7 88 88 A Y H >< S+ 0 0 30 -4,-2.1 3,-1.5 1,-0.3 -1,-0.2 0.949 109.6 52.1 -64.5 -49.0 25.4 0.9 5.4 89 89 A D H 3< S+ 0 0 71 -4,-3.3 -1,-0.3 1,-0.3 -2,-0.2 0.859 107.1 57.3 -59.5 -29.2 23.7 -2.4 6.2 90 90 A S H 3< S+ 0 0 36 -4,-1.2 -1,-0.3 -5,-0.4 -2,-0.2 0.738 95.9 84.3 -78.1 -10.9 24.0 -3.1 2.6 91 91 A L S << S- 0 0 7 -3,-1.5 2,-0.0 -4,-0.8 31,-0.0 -0.524 76.0-114.8 -93.9 163.5 27.7 -2.7 2.5 92 92 A D > - 0 0 57 -2,-0.1 4,-2.5 1,-0.0 5,-0.2 -0.167 43.9 -93.3 -78.1 175.6 30.7 -4.9 3.2 93 93 A A H > S+ 0 0 75 1,-0.2 4,-1.4 2,-0.2 -2,-0.1 0.850 119.9 47.9 -62.2 -46.0 33.0 -4.2 6.0 94 94 A V H > S+ 0 0 26 62,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.933 113.2 48.4 -64.6 -45.1 35.7 -2.2 4.3 95 95 A R H >> S+ 0 0 30 1,-0.2 4,-1.6 2,-0.2 3,-0.8 0.928 105.7 58.6 -62.2 -41.4 33.1 0.1 2.5 96 96 A R H 3X S+ 0 0 73 -4,-2.5 4,-2.7 1,-0.3 -1,-0.2 0.910 100.3 57.8 -52.5 -44.7 31.3 0.7 5.8 97 97 A A H 3X S+ 0 0 7 -4,-1.4 4,-2.2 1,-0.2 -1,-0.3 0.872 103.5 53.2 -54.7 -38.9 34.4 2.1 7.2 98 98 A A H S+ 0 0 63 1,-0.2 4,-3.0 2,-0.2 -1,-0.1 0.803 126.0 53.3 -60.0 -41.3 25.3 12.7 9.4 109 109 A T H > S+ 0 0 118 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.956 109.2 49.4 -62.1 -53.9 23.2 15.3 7.9 110 110 A G H >< S+ 0 0 31 -4,-0.7 3,-1.1 1,-0.2 -2,-0.2 0.906 115.9 40.9 -56.0 -50.0 25.9 16.3 5.5 111 111 A V H >< S+ 0 0 1 -4,-2.3 3,-2.1 1,-0.3 -1,-0.2 0.887 105.2 66.5 -67.7 -34.2 26.5 12.8 4.3 112 112 A A H 3< S+ 0 0 7 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.632 94.1 62.4 -58.4 -15.7 22.8 12.1 4.3 113 113 A G T << S+ 0 0 56 -3,-1.1 2,-1.5 -4,-0.6 3,-0.3 0.416 72.7 92.7 -92.5 2.0 22.5 14.7 1.5 114 114 A F <> + 0 0 46 -3,-2.1 4,-2.6 1,-0.2 5,-0.2 -0.490 53.4 158.9 -89.5 58.1 24.7 12.7 -1.0 115 115 A T H > + 0 0 79 -2,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.921 64.3 47.9 -47.7 -58.2 21.5 11.2 -2.3 116 116 A N H > S+ 0 0 80 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.913 115.1 43.9 -57.9 -44.3 22.7 10.2 -5.6 117 117 A S H > S+ 0 0 1 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.882 109.7 58.2 -72.4 -30.6 26.0 8.5 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.942 109.3 44.3 -64.0 -42.9 24.1 6.9 -1.6 119 119 A R H X S+ 0 0 110 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.935 113.1 49.7 -66.8 -42.5 21.9 5.3 -4.1 120 120 A M H <>S+ 0 0 36 -4,-2.5 5,-2.1 1,-0.2 4,-0.5 0.946 111.1 50.0 -63.3 -40.7 24.7 4.3 -6.4 121 121 A L H ><5S+ 0 0 13 -4,-3.4 3,-1.6 1,-0.2 -1,-0.2 0.939 108.1 53.0 -62.9 -41.4 26.5 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 93 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.879 108.5 50.3 -62.9 -29.7 23.4 0.9 -2.5 123 123 A Q T 3<5S- 0 0 92 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.430 113.5-118.2 -84.3 0.1 23.2 -0.5 -6.1 124 124 A K T < 5 + 0 0 102 -3,-1.6 2,-1.3 -4,-0.5 -3,-0.2 0.732 65.0 147.4 67.3 29.3 26.9 -1.6 -5.9 125 125 A R >< + 0 0 111 -5,-2.1 4,-2.5 1,-0.2 5,-0.2 -0.630 20.6 174.4 -98.4 73.3 27.7 0.7 -8.9 126 126 A W H > + 0 0 51 -2,-1.3 4,-1.7 1,-0.2 -1,-0.2 0.835 68.1 45.4 -51.0 -52.4 31.2 1.4 -7.6 127 127 A D H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.898 113.0 49.5 -68.1 -39.0 32.6 3.5 -10.3 128 128 A E H > S+ 0 0 99 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.909 109.8 51.1 -66.6 -42.1 29.7 5.6 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.933 108.0 53.7 -57.6 -42.3 29.4 6.4 -7.2 130 130 A A H X S+ 0 0 11 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.877 108.0 48.0 -60.7 -41.1 33.0 7.3 -7.1 131 131 A V H < S+ 0 0 94 -4,-1.8 4,-0.5 1,-0.2 3,-0.3 0.938 114.5 48.1 -68.9 -41.4 32.7 9.8 -9.9 132 132 A N H >< S+ 0 0 37 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.862 105.6 56.2 -66.0 -36.1 29.7 11.3 -8.2 133 133 A L H 3< S+ 0 0 7 -4,-2.8 6,-0.3 1,-0.3 -1,-0.2 0.856 102.3 60.1 -65.6 -29.9 31.4 11.5 -4.8 134 134 A A T 3< S+ 0 0 27 -4,-1.3 2,-1.6 -3,-0.3 -1,-0.3 0.618 83.5 79.6 -77.0 -8.7 34.1 13.5 -6.4 135 135 A K S < S+ 0 0 159 -3,-1.1 2,-0.4 -4,-0.5 -1,-0.2 -0.503 80.1 101.1 -92.9 68.4 31.8 16.3 -7.6 136 136 A S S > S- 0 0 17 -2,-1.6 4,-2.1 1,-0.2 5,-0.2 -0.991 83.2-119.6-151.4 159.0 31.6 17.9 -4.2 137 137 A R H > S+ 0 0 148 -2,-0.4 4,-2.5 2,-0.2 5,-0.2 0.913 113.2 63.4 -62.1 -39.5 32.9 20.6 -2.3 138 138 A W H > S+ 0 0 18 1,-0.3 4,-2.6 2,-0.2 8,-0.2 0.943 106.0 44.3 -43.8 -54.6 34.3 17.9 0.1 139 139 A Y H 4 S+ 0 0 57 -6,-0.3 -1,-0.3 1,-0.2 -2,-0.2 0.901 112.5 49.8 -61.7 -42.7 36.5 16.7 -2.5 140 140 A N H < S+ 0 0 111 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.799 114.6 45.4 -69.4 -31.3 37.7 20.1 -3.8 141 141 A Q H < S+ 0 0 99 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.846 133.4 13.9 -78.4 -40.1 38.6 21.3 -0.2 142 142 A T S X S+ 0 0 21 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 -0.703 73.0 160.8-136.5 75.3 40.4 18.1 1.0 143 143 A P H > S+ 0 0 44 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.834 70.5 55.3 -66.4 -36.6 41.1 16.0 -2.2 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.964 115.4 37.2 -66.2 -47.4 43.9 13.8 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.917 117.3 52.7 -67.7 -44.1 41.8 12.6 2.1 146 146 A A H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 5,-0.3 0.943 107.6 53.3 -55.9 -45.6 38.7 12.5 -0.1 147 147 A K H X S+ 0 0 90 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.872 107.7 51.0 -58.6 -39.1 40.6 10.4 -2.7 148 148 A R H X S+ 0 0 71 -4,-1.5 4,-1.6 -5,-0.2 -1,-0.2 0.928 113.1 43.8 -66.3 -41.2 41.6 7.9 -0.1 149 149 A V H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.867 113.3 50.4 -69.6 -38.9 38.1 7.5 1.1 150 150 A I H X S+ 0 0 14 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.900 108.2 52.9 -66.1 -42.6 36.6 7.3 -2.3 151 151 A T H X S+ 0 0 40 -4,-2.1 4,-2.8 -5,-0.3 6,-0.3 0.908 110.8 48.7 -57.5 -43.0 39.1 4.6 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.908 112.0 47.6 -62.3 -47.5 38.1 2.6 -0.4 153 153 A A H < S+ 0 0 8 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.882 116.9 45.4 -61.8 -36.4 34.4 3.0 -1.1 154 154 A R H < S+ 0 0 83 -4,-3.0 -2,-0.2 1,-0.1 -1,-0.2 0.869 123.8 28.1 -76.7 -41.0 35.1 2.1 -4.7 155 155 A T H < S- 0 0 43 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.2 0.611 86.3-134.5 -95.3 -21.3 37.3 -0.9 -4.3 156 156 A G S < S+ 0 0 16 -4,-2.3 -62,-0.3 -5,-0.3 2,-0.2 0.708 73.5 102.3 70.3 20.2 36.3 -2.3 -1.0 157 157 A T S S- 0 0 43 -6,-0.3 3,-0.4 -5,-0.1 -1,-0.2 -0.816 77.7-122.4-127.7 170.6 40.1 -2.7 -0.1 158 158 A W S >> S+ 0 0 40 -2,-0.2 3,-3.1 1,-0.2 4,-0.6 0.281 70.4 121.3 -96.9 15.9 42.6 -0.8 2.1 159 159 A D G >4 + 0 0 91 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.812 68.4 59.0 -49.0 -37.3 45.0 -0.1 -0.7 160 160 A A G 34 S+ 0 0 33 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.657 108.7 44.8 -66.5 -17.3 44.7 3.7 -0.2 161 161 A Y G <4 0 0 19 -3,-3.1 -1,-0.3 -13,-0.1 -2,-0.2 0.436 360.0 360.0-109.1 6.4 45.9 3.4 3.3 162 162 A K << 0 0 179 -3,-1.4 -2,-0.1 -4,-0.6 -3,-0.1 0.690 360.0 360.0-104.4 360.0 48.8 1.0 2.7