==== 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 07-OCT-97 234L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.A.LIPSCOMB,D.L.DREW,N.GASSNER,W.A.BAASE,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8592.0 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 . 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 . 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 2 1 0 1 2 0 0 1 1 1 0 0 0 0 0 1 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 78 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 147.1 43.4 -2.0 9.2 2 2 A N > - 0 0 69 156,-0.0 4,-3.0 95,-0.0 5,-0.2 -0.924 360.0 -81.4-151.2 178.3 40.2 -0.7 10.8 3 3 A I H > S+ 0 0 27 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.844 123.7 51.1 -54.5 -41.9 38.1 2.4 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.928 114.0 41.8 -64.4 -49.0 40.2 3.6 14.2 5 5 A E H > S+ 0 0 97 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.881 114.8 53.7 -64.9 -41.0 43.5 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.931 112.7 40.6 -60.3 -51.4 41.9 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.2 5,-0.4 0.834 109.8 59.8 -68.5 -29.4 40.6 7.8 10.8 8 8 A R H X S+ 0 0 98 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.882 107.5 47.7 -66.4 -30.1 43.8 8.3 12.9 9 9 A I H < S+ 0 0 89 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.915 116.2 43.0 -74.3 -41.2 45.6 8.5 9.6 10 10 A D H < S+ 0 0 21 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.797 124.2 32.7 -75.3 -30.3 43.1 11.0 8.2 11 11 A E H < S- 0 0 46 -4,-2.8 19,-0.3 1,-0.2 -3,-0.2 0.702 92.4-152.0 -99.1 -25.2 42.7 13.2 11.2 12 12 A G < - 0 0 25 -4,-1.5 2,-0.4 -5,-0.4 -1,-0.2 -0.253 24.3 -86.0 77.9-174.1 46.2 13.1 12.8 13 13 A L + 0 0 37 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.975 44.5 169.6-138.3 119.0 46.7 13.5 16.5 14 14 A R E -A 28 0A 141 14,-1.7 14,-2.2 -2,-0.4 4,-0.1 -0.996 20.0-164.1-134.5 127.6 47.2 16.9 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.1 12,-0.2 2,-0.3 0.351 73.1 61.6 -90.6 2.3 47.2 17.5 21.9 16 16 A K E S-C 57 0B 91 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.938 100.6 -84.7-127.3 148.7 46.7 21.3 21.9 17 17 A I E + 0 0 14 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.245 58.7 170.3 -52.5 139.7 43.8 23.2 20.5 18 18 A Y E -A 26 0A 26 8,-3.1 8,-3.1 -4,-0.1 2,-0.5 -0.885 35.4-102.2-144.2 173.4 44.2 23.8 16.8 19 19 A K E -A 25 0A 127 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.874 33.8-142.5-102.0 132.8 42.3 25.0 13.8 20 20 A D > - 0 0 48 4,-2.7 3,-1.7 -2,-0.5 -1,-0.1 -0.065 41.6 -79.2 -79.1-172.1 40.9 22.5 11.4 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.735 134.3 48.0 -61.5 -22.6 40.8 22.8 7.6 22 22 A E T 3 S- 0 0 80 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.423 123.7-103.5 -95.0 -4.8 37.6 25.0 7.9 23 23 A G S < S+ 0 0 34 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.558 75.1 139.6 92.3 14.7 39.3 27.2 10.6 24 24 A Y - 0 0 77 1,-0.1 -4,-2.7 -5,-0.0 -1,-0.3 -0.766 60.7 -99.5 -99.7 147.2 37.4 25.7 13.6 25 25 A Y E +AB 19 34A 34 9,-0.7 8,-3.0 11,-0.4 9,-1.4 -0.327 54.9 158.6 -61.3 122.5 38.8 24.9 17.0 26 26 A T E -AB 18 32A 3 -8,-3.1 -8,-3.1 6,-0.3 2,-0.3 -0.856 18.0-168.0-138.6 169.4 39.5 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.4 4,-2.5 -2,-0.3 -12,-0.2 -0.973 49.5 2.2-157.0 164.6 41.6 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.2 -14,-1.7 -2,-0.3 2,-0.9 -0.343 124.1 -3.7 60.8-123.6 43.0 15.4 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.617 128.0 -55.3-105.2 73.2 41.9 13.2 16.8 30 30 A G T 4 S+ 0 0 13 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.769 82.5 161.9 66.3 30.1 39.7 15.6 14.8 31 31 A H E < -B 27 0A 31 -4,-2.5 -4,-1.4 -20,-0.1 -1,-0.2 -0.700 33.0-141.5 -85.3 104.5 37.4 16.3 17.8 32 32 A L E -B 26 0A 72 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.365 21.4-179.0 -63.9 129.0 35.6 19.5 16.8 33 33 A L E - 0 0 15 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.851 57.8 -23.1 -98.3 -43.3 35.1 21.7 19.8 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.937 33.7-141.5-167.7 151.3 33.3 24.7 18.4 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.511 73.9 108.5 -89.2 -12.4 32.4 26.6 15.3 36 36 A S S S- 0 0 44 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.362 74.8-129.9 -68.0 148.9 32.6 29.8 17.2 37 37 A P S S+ 0 0 123 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.518 76.8 105.3 -74.9 -8.0 35.5 32.1 16.6 38 38 A S > - 0 0 47 1,-0.2 4,-1.9 2,-0.0 5,-0.1 -0.640 55.4-161.1 -84.2 122.7 36.2 32.5 20.3 39 39 A L H > S+ 0 0 69 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.836 96.3 55.3 -68.7 -25.1 39.2 30.6 21.8 40 40 A N H > S+ 0 0 118 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.919 104.2 51.6 -73.2 -38.4 37.7 31.0 25.1 41 41 A A H > S+ 0 0 33 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.913 111.2 50.3 -59.5 -40.9 34.5 29.3 24.0 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.902 110.2 48.3 -62.5 -46.7 36.8 26.5 22.7 43 43 A K H X S+ 0 0 51 -4,-2.4 4,-2.2 2,-0.2 11,-0.2 0.870 111.3 51.4 -65.6 -35.8 38.6 26.2 26.0 44 44 A S H X S+ 0 0 75 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.959 111.2 46.3 -67.6 -45.0 35.3 26.1 27.8 45 45 A E H X S+ 0 0 72 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.935 111.4 53.9 -61.6 -44.1 33.9 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 5,-0.3 0.938 108.7 47.0 -57.4 -45.2 37.2 21.5 26.0 47 47 A D H X>S+ 0 0 32 -4,-2.2 4,-2.1 1,-0.2 5,-1.5 0.917 112.1 50.8 -62.7 -39.7 37.1 21.6 29.8 48 48 A K H <5S+ 0 0 139 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.857 110.3 49.2 -64.6 -38.7 33.5 20.5 29.7 49 49 A A H <5S+ 0 0 44 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.861 119.7 37.4 -68.4 -35.4 34.3 17.5 27.4 50 50 A I H <5S- 0 0 34 -4,-2.1 -2,-0.2 2,-0.3 -1,-0.2 0.663 102.7-127.2 -90.4 -27.0 37.2 16.4 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.2 0.831 77.2 74.2 80.2 29.9 35.8 17.1 32.9 52 52 A R S - 0 0 9 -2,-1.0 3,-0.9 -11,-0.2 -1,-0.2 0.766 33.3-142.1 -87.5 -32.4 42.6 21.9 30.8 55 55 A N T 3 S- 0 0 117 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.923 75.2 -60.0 64.0 40.5 44.1 25.2 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.1 2,-0.4 0.544 117.4 103.1 61.9 14.5 43.8 24.0 26.1 57 57 A V B < +C 16 0B 68 -3,-0.9 2,-0.2 -41,-0.2 -41,-0.2 -0.982 43.0 175.1-130.5 131.1 46.0 20.9 26.6 58 58 A I - 0 0 7 -43,-2.1 2,-0.2 -2,-0.4 -30,-0.1 -0.728 28.2-107.8-122.9 175.2 45.1 17.3 27.0 59 59 A T > - 0 0 58 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.608 31.7-107.9 -99.9 167.2 46.9 14.0 27.2 60 60 A K H > S+ 0 0 112 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.895 122.4 51.9 -57.9 -42.1 47.1 11.2 24.6 61 61 A D H > S+ 0 0 127 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.890 109.3 50.2 -62.4 -39.5 44.8 9.0 26.8 62 62 A E H > S+ 0 0 37 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.917 109.7 50.6 -64.3 -43.8 42.3 11.9 26.9 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -34,-0.4 0.867 110.4 50.4 -58.7 -41.5 42.4 12.3 23.1 64 64 A E H X S+ 0 0 72 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.868 107.3 52.7 -67.8 -36.9 41.8 8.7 22.7 65 65 A K H X S+ 0 0 138 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.929 109.8 48.4 -64.7 -46.4 38.8 8.7 25.0 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.933 110.8 54.7 -58.4 -38.4 37.3 11.6 22.9 67 67 A F H X S+ 0 0 13 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.906 106.5 47.2 -62.5 -46.6 38.1 9.5 19.9 68 68 A N H X S+ 0 0 87 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.921 111.8 51.4 -61.4 -42.6 36.3 6.4 21.0 69 69 A Q H X S+ 0 0 92 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.937 111.2 48.9 -59.3 -44.2 33.3 8.4 22.0 70 70 A D H X S+ 0 0 35 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.810 110.2 48.6 -65.1 -36.5 33.3 10.1 18.6 71 71 A V H X S+ 0 0 7 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.926 112.3 50.6 -70.9 -41.9 33.6 6.9 16.6 72 72 A D H X S+ 0 0 87 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.934 109.8 49.3 -58.3 -46.2 30.7 5.4 18.7 73 73 A A H X S+ 0 0 47 -4,-2.4 4,-3.2 -5,-0.2 5,-0.2 0.887 108.8 53.2 -61.8 -40.5 28.5 8.5 18.1 74 74 A A H X S+ 0 0 9 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.954 110.6 45.7 -60.3 -48.0 29.1 8.3 14.3 75 75 A V H X S+ 0 0 30 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.949 115.4 48.8 -58.4 -49.6 28.1 4.7 14.1 76 76 A R H X S+ 0 0 95 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.901 107.9 52.1 -58.8 -43.2 25.1 5.4 16.2 77 77 A G H < S+ 0 0 5 -4,-3.2 4,-0.5 1,-0.2 -1,-0.2 0.865 111.1 49.8 -61.5 -35.1 24.1 8.5 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.3 -5,-0.2 7,-0.5 0.965 109.8 50.4 -66.2 -49.2 24.3 6.2 11.0 79 79 A L H 3< S+ 0 0 68 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.826 112.3 46.6 -59.9 -34.7 22.1 3.5 12.6 80 80 A R T 3< S+ 0 0 178 -4,-2.1 2,-0.6 -5,-0.2 -1,-0.3 0.519 93.1 97.7 -86.4 -4.9 19.5 6.0 13.6 81 81 A N <> - 0 0 20 -3,-1.3 4,-3.7 -4,-0.5 -4,-0.0 -0.737 62.2-152.8 -93.8 121.0 19.4 7.7 10.3 82 82 A A T 4 S+ 0 0 86 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.0 0.755 98.8 41.6 -58.2 -27.5 16.7 6.6 7.9 83 83 A K T 4 S+ 0 0 121 2,-0.1 4,-0.4 3,-0.1 -1,-0.2 0.811 122.1 40.4 -87.9 -33.4 18.8 7.6 4.8 84 84 A L T >> S+ 0 0 0 -7,-0.2 4,-2.4 -6,-0.2 3,-0.9 0.895 100.7 66.9 -82.3 -46.8 22.0 6.2 6.2 85 85 A K H 3X S+ 0 0 85 -4,-3.7 4,-2.6 -7,-0.5 5,-0.2 0.890 100.0 49.1 -44.2 -49.7 21.0 3.0 7.9 86 86 A P H 3> S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.841 112.2 49.2 -65.8 -29.0 20.0 1.1 4.8 87 87 A V H <> S+ 0 0 2 -3,-0.9 4,-1.0 -4,-0.4 3,-0.3 0.965 111.0 47.8 -72.7 -50.9 23.1 2.0 3.0 88 88 A Y H >< S+ 0 0 28 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.883 111.1 52.9 -52.6 -43.5 25.4 1.0 5.8 89 89 A D H 3< S+ 0 0 72 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.844 106.2 53.2 -64.1 -36.2 23.5 -2.3 6.1 90 90 A S H 3< S+ 0 0 39 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.639 97.8 88.1 -73.8 -14.2 23.9 -3.1 2.5 91 91 A L S << S- 0 0 7 -4,-1.0 2,-0.1 -3,-0.7 31,-0.0 -0.521 75.5-114.4 -90.5 161.8 27.7 -2.6 2.5 92 92 A D > - 0 0 57 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.235 44.3 -93.6 -76.3 168.0 30.7 -4.9 3.3 93 93 A A H > S+ 0 0 85 1,-0.2 4,-1.2 2,-0.2 -2,-0.1 0.857 122.2 48.1 -54.0 -42.9 32.9 -4.3 6.3 94 94 A V H > S+ 0 0 27 1,-0.2 4,-1.3 62,-0.2 3,-0.4 0.934 112.1 46.9 -65.4 -51.1 35.5 -2.2 4.4 95 95 A R H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.797 105.4 60.3 -65.8 -28.1 33.1 0.0 2.7 96 96 A R H X S+ 0 0 78 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.894 102.5 53.6 -64.7 -36.4 31.1 0.6 6.0 97 97 A A H X S+ 0 0 6 -4,-1.2 4,-2.1 -3,-0.4 -1,-0.2 0.860 104.4 55.0 -66.7 -35.3 34.3 2.0 7.4 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-2.0 1,-0.2 -1,-0.2 0.886 108.9 48.1 -64.0 -35.7 34.4 4.4 4.5 99 99 A L H X S+ 0 0 1 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.877 108.5 53.1 -70.7 -34.1 30.9 5.6 5.3 100 100 A I H X S+ 0 0 9 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.939 106.8 54.0 -64.2 -40.0 31.8 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.928 108.7 47.1 -57.0 -53.0 34.8 8.2 7.9 102 102 A M H X S+ 0 0 3 -4,-2.0 4,-3.1 1,-0.2 5,-0.4 0.912 113.0 50.7 -57.5 -43.4 32.6 10.5 5.8 103 103 A V H X S+ 0 0 8 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.917 109.1 50.5 -61.4 -42.1 30.1 10.7 8.7 104 104 A F H < S+ 0 0 33 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.921 119.7 36.5 -61.5 -42.6 32.8 11.6 11.2 105 105 A Q H < S+ 0 0 53 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.907 130.1 26.5 -76.9 -45.6 34.1 14.3 9.0 106 106 A L H < S- 0 0 57 -4,-3.1 4,-0.4 -5,-0.2 -3,-0.2 0.619 103.5-116.9 -97.0 -23.0 31.0 15.7 7.5 107 107 A G X - 0 0 29 -4,-2.3 4,-2.5 -5,-0.4 5,-0.2 0.071 31.6 -83.0 92.3 150.2 28.2 15.0 10.0 108 108 A E H > S+ 0 0 59 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.898 129.6 48.8 -53.1 -46.9 25.2 12.8 9.6 109 109 A T H > S+ 0 0 123 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.888 109.4 52.0 -63.1 -44.6 23.2 15.5 8.0 110 110 A G H 4 S+ 0 0 33 -4,-0.4 3,-0.5 2,-0.2 -2,-0.2 0.929 115.2 41.6 -61.8 -48.1 26.0 16.4 5.5 111 111 A V H >< S+ 0 0 1 -4,-2.5 3,-2.8 1,-0.2 -2,-0.2 0.936 105.3 62.8 -66.7 -45.2 26.3 12.7 4.4 112 112 A A H 3< S+ 0 0 13 -4,-3.1 -1,-0.2 1,-0.3 3,-0.2 0.785 96.7 64.9 -50.6 -23.0 22.6 12.1 4.3 113 113 A G T 3< S+ 0 0 55 -4,-0.8 2,-0.9 -3,-0.5 3,-0.3 0.598 73.7 86.2 -81.0 -7.2 22.5 14.7 1.6 114 114 A F X> + 0 0 44 -3,-2.8 4,-2.8 1,-0.2 3,-0.8 -0.177 56.0 157.5 -87.3 45.8 24.6 12.8 -0.9 115 115 A T H 3> + 0 0 74 -2,-0.9 4,-2.1 1,-0.3 -1,-0.2 0.799 65.2 47.3 -34.5 -54.4 21.4 11.2 -2.0 116 116 A N H 3> S+ 0 0 86 -3,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.895 114.4 45.7 -63.7 -41.3 22.5 10.2 -5.5 117 117 A S H <> S+ 0 0 1 -3,-0.8 4,-3.0 2,-0.2 5,-0.2 0.900 110.8 55.3 -68.8 -37.6 25.8 8.7 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.919 108.5 47.7 -58.3 -45.7 24.0 6.9 -1.5 119 119 A R H X S+ 0 0 122 -4,-2.1 4,-1.5 -5,-0.3 -1,-0.2 0.905 111.3 49.6 -63.4 -39.3 21.7 5.4 -4.0 120 120 A M H <>S+ 0 0 25 -4,-1.6 5,-2.1 2,-0.2 4,-0.5 0.887 110.6 52.0 -67.7 -46.1 24.6 4.3 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-3.0 3,-1.9 1,-0.2 -2,-0.2 0.953 107.3 52.7 -61.9 -42.0 26.4 2.8 -3.2 122 122 A Q H 3<5S+ 0 0 94 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.894 108.6 49.0 -59.8 -36.2 23.3 0.8 -2.4 123 123 A Q T 3<5S- 0 0 88 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.477 112.1-120.2 -81.9 -2.2 23.1 -0.6 -5.8 124 124 A K T < 5 + 0 0 102 -3,-1.9 2,-1.3 -4,-0.5 -3,-0.2 0.776 62.7 147.7 65.9 30.4 26.8 -1.6 -5.7 125 125 A R >< + 0 0 113 -5,-2.1 4,-2.4 1,-0.2 5,-0.2 -0.662 20.1 172.5 -94.3 75.1 27.5 0.6 -8.7 126 126 A W H > + 0 0 50 -2,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.870 68.1 45.5 -53.7 -54.2 31.1 1.4 -7.5 127 127 A D H > S+ 0 0 113 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.910 115.7 49.5 -64.1 -38.8 32.7 3.3 -10.3 128 128 A E H > S+ 0 0 104 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.913 109.9 48.8 -67.8 -41.4 29.6 5.4 -10.7 129 129 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.881 108.1 56.4 -63.7 -36.8 29.3 6.3 -7.1 130 130 A A H X S+ 0 0 12 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.918 108.4 46.7 -62.0 -42.7 33.0 7.2 -7.1 131 131 A V H X S+ 0 0 88 -4,-1.8 4,-0.6 1,-0.2 3,-0.4 0.909 114.2 47.2 -64.9 -47.3 32.5 9.7 -9.9 132 132 A N H >< S+ 0 0 44 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.902 106.9 55.7 -63.9 -40.0 29.4 11.2 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.9 6,-0.4 1,-0.2 -1,-0.2 0.824 101.7 61.3 -62.6 -26.8 31.1 11.5 -4.8 134 134 A A H 3< S+ 0 0 28 -4,-1.0 2,-1.9 -3,-0.4 -1,-0.2 0.695 84.6 78.1 -73.2 -21.4 33.8 13.6 -6.5 135 135 A K S << S+ 0 0 162 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.541 81.5 94.6 -87.0 73.3 31.5 16.2 -7.7 136 136 A S S > S- 0 0 19 -2,-1.9 4,-1.8 1,-0.1 5,-0.1 -0.996 84.9-114.7-159.9 157.2 31.3 17.9 -4.3 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-3.5 1,-0.2 5,-0.3 0.832 113.4 64.3 -63.4 -36.3 32.7 20.6 -2.3 138 138 A W H > S+ 0 0 13 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.957 105.6 42.6 -51.9 -49.0 34.1 17.9 0.0 139 139 A Y H 4 S+ 0 0 57 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.911 115.7 50.6 -64.5 -41.8 36.3 16.5 -2.7 140 140 A N H < S+ 0 0 108 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.876 115.5 40.1 -66.6 -38.3 37.3 20.0 -3.8 141 141 A Q H < S+ 0 0 107 -4,-3.5 -2,-0.2 1,-0.2 -1,-0.2 0.870 132.9 21.2 -82.1 -35.4 38.2 21.3 -0.4 142 142 A T S X S+ 0 0 23 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 -0.595 72.4 161.6-131.2 70.4 40.0 18.1 0.9 143 143 A P H > S+ 0 0 49 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.877 70.0 51.8 -59.1 -44.1 40.9 16.2 -2.2 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.948 115.5 41.5 -63.8 -47.7 43.6 13.9 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 3,-0.4 0.947 115.3 50.3 -61.9 -50.3 41.4 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.3 5,-0.3 0.908 107.9 54.3 -56.0 -42.1 38.4 12.4 -0.3 147 147 A K H X S+ 0 0 95 -4,-2.8 4,-1.8 1,-0.2 -1,-0.3 0.860 107.5 51.1 -60.3 -37.3 40.4 10.4 -2.8 148 148 A R H X S+ 0 0 71 -4,-1.5 4,-1.5 -3,-0.4 12,-0.2 0.940 113.9 42.9 -66.0 -45.5 41.3 8.0 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.907 113.5 51.0 -61.6 -47.5 37.7 7.5 1.0 150 150 A I H X S+ 0 0 12 -4,-3.2 4,-2.0 1,-0.2 -1,-0.2 0.843 108.6 52.6 -63.0 -36.2 36.4 7.3 -2.5 151 151 A T H X S+ 0 0 33 -4,-1.8 4,-2.6 -5,-0.3 6,-0.4 0.844 105.8 54.1 -68.2 -32.6 39.0 4.7 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.920 110.3 46.3 -65.9 -43.0 37.9 2.6 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.874 114.6 48.5 -66.3 -36.2 34.3 2.7 -1.7 154 154 A R H < S+ 0 0 105 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.925 124.3 26.8 -71.9 -41.5 35.4 1.9 -5.3 155 155 A T H < S- 0 0 47 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.639 84.7-137.7 -97.4 -21.1 37.6 -1.0 -4.4 156 156 A G S < S+ 0 0 16 -4,-2.6 2,-0.2 -5,-0.3 -62,-0.2 0.702 74.0 101.0 67.8 15.1 36.3 -2.4 -1.2 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.771 81.0-120.5-124.1 174.6 40.0 -2.7 -0.1 158 158 A W S >> S+ 0 0 44 -2,-0.2 3,-2.9 1,-0.2 4,-0.6 0.280 70.0 122.9 -98.5 11.8 42.4 -0.7 2.1 159 159 A D G >4 + 0 0 94 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.769 67.4 58.5 -43.2 -37.6 44.9 -0.0 -0.7 160 160 A A G 34 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.521 108.1 47.3 -73.8 -9.1 44.7 3.8 -0.3 161 161 A Y G <4 0 0 20 -3,-2.9 -1,-0.2 -13,-0.1 -2,-0.2 0.459 360.0 360.0-112.3 -3.0 45.8 3.5 3.3 162 162 A K << 0 0 179 -3,-0.9 -2,-0.2 -4,-0.6 -3,-0.1 0.824 360.0 360.0-101.6 360.0 48.7 1.2 2.7