==== 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(O-GLYCOSYL) 27-APR-93 217L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.BLABER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8621.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 71.0 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 . 6 3.7 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 . 85 52.5 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 77 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 148.5 43.7 -1.8 8.9 2 2 A N > - 0 0 69 95,-0.0 4,-2.5 156,-0.0 5,-0.2 -0.873 360.0 -82.1-146.1 176.4 40.5 -0.8 10.7 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.842 125.0 51.3 -54.8 -40.7 38.3 2.3 11.2 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.943 112.9 44.9 -65.3 -46.6 40.5 3.6 14.1 5 5 A E H > S+ 0 0 98 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.911 113.3 51.5 -62.3 -40.0 43.7 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 3,-0.2 0.950 112.6 43.1 -61.8 -52.4 42.1 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.4 0.847 109.2 58.7 -67.3 -32.4 40.8 7.9 10.9 8 8 A R H X S+ 0 0 102 -4,-2.0 4,-1.8 -5,-0.3 -1,-0.2 0.905 108.3 46.1 -64.6 -34.4 44.0 8.3 12.8 9 9 A I H < S+ 0 0 83 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.931 117.2 44.5 -68.0 -45.1 45.8 8.6 9.4 10 10 A D H < S+ 0 0 19 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.851 125.4 29.3 -69.2 -36.9 43.2 11.0 8.1 11 11 A E H < S- 0 0 44 -4,-2.7 19,-0.3 -5,-0.2 -3,-0.2 0.747 92.5-150.0 -99.4 -25.7 42.9 13.3 11.2 12 12 A G < - 0 0 24 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.197 26.2 -85.9 80.8-176.2 46.4 13.0 12.8 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.975 45.2 172.1-134.5 119.7 47.0 13.4 16.5 14 14 A R E -A 28 0A 148 14,-1.6 14,-2.5 -2,-0.4 4,-0.1 -0.997 16.7-169.2-131.2 126.3 47.4 16.8 18.1 15 15 A L E S+ 0 0 63 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.456 72.4 64.7 -93.1 -4.9 47.5 17.2 21.9 16 16 A K E S-C 57 0B 99 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.885 102.2 -86.7-118.1 146.5 47.3 21.0 21.9 17 17 A I E + 0 0 17 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.309 59.0 169.6 -52.4 132.3 44.2 23.0 20.6 18 18 A Y E -A 26 0A 26 8,-2.8 8,-3.3 -4,-0.1 2,-0.5 -0.866 35.8-105.3-138.7 172.3 44.6 23.6 16.9 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.885 32.1-136.3-102.8 130.4 42.5 24.9 14.0 20 20 A D > - 0 0 49 4,-3.0 3,-1.4 -2,-0.5 -1,-0.1 0.083 43.6 -78.9 -70.8-169.5 41.0 22.4 11.6 21 21 A T T 3 S+ 0 0 111 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.805 134.2 48.6 -64.0 -26.4 41.1 22.9 7.8 22 22 A E T 3 S- 0 0 76 2,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.338 123.6-101.5 -92.5 2.3 38.0 25.3 8.1 23 23 A G S < S+ 0 0 36 -3,-1.4 2,-0.4 1,-0.3 -2,-0.1 0.556 75.6 139.5 89.1 12.3 39.6 27.3 10.9 24 24 A Y - 0 0 81 1,-0.1 -4,-3.0 9,-0.0 -1,-0.3 -0.729 59.5-104.3 -95.6 144.9 37.6 25.7 13.8 25 25 A Y E +AB 19 34A 39 9,-0.8 8,-2.7 11,-0.4 9,-1.4 -0.395 52.5 160.4 -68.7 129.4 39.2 24.9 17.1 26 26 A T E -AB 18 32A 2 -8,-3.3 -8,-2.8 6,-0.3 2,-0.3 -0.894 19.7-162.2-140.4 167.1 39.8 21.2 17.5 27 27 A I E > - B 0 31A 0 4,-2.1 4,-2.4 -2,-0.3 2,-0.2 -0.991 51.2 -1.5-152.4 159.8 41.9 18.8 19.5 28 28 A G E 4 S-A 14 0A 1 -14,-2.5 -14,-1.6 -2,-0.3 2,-0.9 -0.449 123.7 -3.4 69.9-127.5 43.2 15.2 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -2,-0.2 -17,-0.1 -0.707 128.9 -54.7-102.3 71.2 42.1 13.1 16.6 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-0.9 -19,-0.3 -2,-0.2 0.789 82.9 161.5 66.4 33.1 39.8 15.5 14.9 31 31 A H E < -B 27 0A 34 -4,-2.4 -4,-2.1 1,-0.0 2,-0.2 -0.762 33.9-139.9 -86.9 107.8 37.6 16.3 17.9 32 32 A L E -B 26 0A 66 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.423 21.8-178.5 -66.8 128.8 35.8 19.5 17.1 33 33 A L E - 0 0 16 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.919 58.0 -31.8 -92.8 -48.8 35.6 21.8 20.1 34 34 A T E -B 25 0A 29 -9,-1.4 -9,-0.8 2,-0.1 -1,-0.4 -0.970 32.2-136.4-168.2 156.2 33.7 24.8 18.8 35 35 A K S S+ 0 0 131 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.515 73.3 113.1 -97.4 -6.6 33.0 26.9 15.8 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.300 71.8-133.8 -61.9 145.8 33.3 30.0 17.9 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.486 75.7 105.9 -82.1 1.1 36.3 32.1 17.1 38 38 A S > - 0 0 50 1,-0.2 4,-1.8 2,-0.0 5,-0.1 -0.708 57.6-159.1 -86.2 122.3 37.1 32.5 20.7 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.818 95.6 55.8 -66.3 -26.3 40.0 30.5 21.9 40 40 A N H > S+ 0 0 108 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.891 103.5 52.1 -74.8 -33.7 38.7 30.8 25.4 41 41 A A H > S+ 0 0 26 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.872 110.7 50.6 -64.6 -34.5 35.3 29.4 24.4 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.939 108.4 50.5 -65.0 -50.0 37.3 26.5 22.9 43 43 A K H X S+ 0 0 43 -4,-2.3 4,-2.2 1,-0.2 11,-0.2 0.892 109.5 52.7 -54.6 -42.0 39.3 26.0 26.1 44 44 A E H X S+ 0 0 113 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.892 108.9 47.6 -64.0 -41.6 36.1 25.9 28.1 45 45 A E H X S+ 0 0 79 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.846 109.6 54.6 -69.1 -34.6 34.6 23.2 26.0 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 5,-0.3 0.930 106.6 50.1 -63.4 -43.0 37.7 21.2 26.2 47 47 A D H X>S+ 0 0 32 -4,-2.2 4,-2.4 1,-0.2 5,-1.2 0.911 112.4 47.8 -61.6 -40.1 37.6 21.3 30.1 48 48 A K H <5S+ 0 0 142 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.847 111.4 50.7 -68.1 -38.7 34.0 20.2 30.1 49 49 A A H <5S+ 0 0 45 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.860 121.1 33.0 -67.6 -37.5 34.8 17.4 27.6 50 50 A I H <5S- 0 0 37 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.689 101.6-128.2 -91.3 -29.4 37.7 16.1 29.6 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 1,-0.3 -3,-0.2 0.745 76.0 84.5 82.2 26.7 36.4 16.9 33.1 52 52 A R S - 0 0 12 -2,-1.0 3,-1.0 -11,-0.2 -1,-0.2 0.739 35.6-144.7 -98.5 -25.1 43.3 21.8 31.1 55 55 A N T 3 S- 0 0 114 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.887 77.2 -57.9 58.9 31.3 44.6 25.1 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.1 2,-0.4 0.449 112.1 101.1 83.2 2.4 44.5 23.6 26.2 57 57 A V B < -C 16 0B 72 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.980 43.7-178.5-126.9 131.6 46.7 20.6 26.5 58 58 A I - 0 0 4 -43,-2.5 2,-0.1 -2,-0.4 -30,-0.1 -0.782 25.3-112.6-121.3 165.5 45.6 17.0 26.8 59 59 A T > - 0 0 68 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.421 33.3-106.1 -87.9 169.2 47.4 13.6 27.2 60 60 A K H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.911 121.0 53.0 -62.3 -43.3 47.4 10.8 24.6 61 61 A D H > S+ 0 0 119 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.856 108.7 49.7 -59.8 -42.0 45.0 8.7 26.7 62 62 A E H > S+ 0 0 40 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.908 110.0 50.9 -66.3 -37.7 42.6 11.6 26.9 63 63 A A H X S+ 0 0 1 -4,-2.1 4,-1.9 1,-0.2 -34,-0.4 0.893 110.7 49.7 -63.8 -39.5 42.8 12.1 23.1 64 64 A E H X S+ 0 0 69 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.794 107.5 53.8 -70.8 -31.1 42.1 8.4 22.6 65 65 A K H X S+ 0 0 137 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.947 109.5 46.7 -69.9 -43.0 39.1 8.5 25.0 66 66 A L H X S+ 0 0 6 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.916 113.0 52.5 -60.7 -40.7 37.5 11.4 23.0 67 67 A F H X S+ 0 0 13 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.928 107.3 50.2 -61.6 -47.0 38.3 9.3 19.8 68 68 A N H X S+ 0 0 87 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.942 112.9 47.3 -59.0 -43.3 36.6 6.2 21.1 69 69 A Q H X S+ 0 0 98 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.878 112.0 49.8 -64.3 -39.6 33.6 8.3 22.0 70 70 A D H X S+ 0 0 33 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.872 111.3 47.6 -69.1 -35.7 33.5 10.0 18.6 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.929 112.6 49.6 -70.6 -43.0 33.8 6.8 16.6 72 72 A D H X S+ 0 0 87 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.928 110.9 50.4 -60.5 -41.8 31.0 5.2 18.7 73 73 A A H X S+ 0 0 45 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.872 109.0 51.1 -63.1 -39.5 28.9 8.3 18.1 74 74 A A H X S+ 0 0 7 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.936 112.1 46.7 -62.1 -48.6 29.4 8.1 14.3 75 75 A V H X S+ 0 0 35 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.933 113.9 46.2 -61.6 -46.1 28.4 4.4 14.1 76 76 A R H X S+ 0 0 121 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.894 110.4 55.4 -66.1 -35.8 25.3 5.0 16.3 77 77 A G H X S+ 0 0 2 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.935 109.2 47.2 -60.1 -44.6 24.4 8.0 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-0.8 1,-0.2 7,-0.4 0.961 112.6 49.1 -58.0 -51.5 24.5 5.8 11.0 79 79 A L H 3< S+ 0 0 73 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.710 113.1 46.9 -67.4 -22.0 22.4 3.1 12.6 80 80 A R H 3< S+ 0 0 165 -4,-1.6 2,-0.4 -3,-0.2 -1,-0.3 0.590 92.2 93.0 -90.6 -23.6 19.8 5.5 13.7 81 81 A N S+ 0 0 107 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.777 120.0 40.9 -86.3 -34.4 18.8 7.3 5.0 84 84 A L H > S+ 0 0 0 -6,-0.2 4,-2.5 -7,-0.2 5,-0.2 0.852 101.4 65.5 -85.6 -35.8 22.1 6.0 6.2 85 85 A K H X S+ 0 0 85 -4,-2.9 4,-2.9 -7,-0.4 5,-0.2 0.903 99.7 49.5 -54.7 -49.8 21.3 2.8 7.8 86 86 A P H > S+ 0 0 50 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.868 111.7 51.2 -61.7 -31.5 20.1 0.9 4.7 87 87 A V H X S+ 0 0 3 -4,-0.5 4,-0.9 2,-0.2 3,-0.4 0.964 110.6 47.6 -67.5 -49.3 23.2 2.0 2.9 88 88 A Y H >< S+ 0 0 37 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.933 109.8 53.5 -54.3 -48.1 25.5 0.7 5.7 89 89 A D H 3< S+ 0 0 80 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.811 106.9 52.7 -59.1 -31.0 23.6 -2.6 5.9 90 90 A S H 3< S+ 0 0 34 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.701 96.8 88.7 -78.6 -19.6 24.1 -3.1 2.2 91 91 A L S << S- 0 0 5 -3,-1.2 2,-0.1 -4,-0.9 31,-0.0 -0.479 74.5-117.9 -88.4 157.7 27.9 -2.6 2.3 92 92 A D > - 0 0 54 -2,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.236 44.3 -92.6 -76.9 167.3 30.8 -4.9 2.9 93 93 A A H > S+ 0 0 79 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.832 122.0 47.1 -55.5 -39.0 33.2 -4.3 5.9 94 94 A V H > S+ 0 0 26 2,-0.2 4,-1.6 62,-0.2 3,-0.3 0.938 113.5 46.7 -72.3 -46.4 35.7 -2.1 4.1 95 95 A R H > S+ 0 0 26 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.854 106.4 60.3 -67.3 -28.2 33.2 0.1 2.5 96 96 A R H X S+ 0 0 77 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.921 101.6 53.5 -61.1 -43.5 31.4 0.4 5.8 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.6 -3,-0.3 -2,-0.2 0.902 106.2 54.3 -57.0 -42.4 34.6 1.9 7.3 98 98 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.907 108.2 47.6 -60.8 -39.6 34.6 4.5 4.5 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.913 109.9 52.7 -70.4 -40.0 31.0 5.6 5.3 100 100 A I H X S+ 0 0 8 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.910 106.7 54.5 -57.3 -44.3 31.9 5.8 9.0 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.929 108.1 47.7 -53.3 -48.3 34.9 8.1 8.0 102 102 A M H X S+ 0 0 3 -4,-2.0 4,-3.1 1,-0.2 5,-0.4 0.903 112.0 49.4 -61.1 -43.1 32.6 10.5 6.2 103 103 A V H X S+ 0 0 7 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.879 109.1 53.0 -65.2 -37.5 30.1 10.6 9.1 104 104 A F H < S+ 0 0 30 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.934 117.0 38.5 -60.7 -43.4 32.9 11.3 11.5 105 105 A Q H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.922 132.4 21.0 -73.5 -48.7 34.1 14.2 9.4 106 106 A M H X S- 0 0 55 -4,-3.1 4,-0.5 -5,-0.2 -3,-0.2 0.529 103.5-115.6-104.2 -13.4 30.8 15.7 8.3 107 107 A G H X - 0 0 31 -4,-2.1 4,-2.3 -5,-0.4 5,-0.2 0.071 32.7 -78.9 93.0 152.5 28.2 14.6 10.7 108 108 A E H > S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.920 129.7 47.1 -54.2 -51.8 25.1 12.3 10.3 109 109 A T H > S+ 0 0 115 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.894 110.0 52.4 -62.4 -40.5 23.1 15.1 8.8 110 110 A G H >< S+ 0 0 32 -4,-0.5 3,-1.6 1,-0.2 4,-0.3 0.975 112.4 43.8 -62.2 -52.6 25.8 16.2 6.3 111 111 A V H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.879 104.7 62.4 -61.8 -36.9 26.3 12.8 4.9 112 112 A A H 3< S+ 0 0 10 -4,-2.1 -1,-0.3 1,-0.3 3,-0.2 0.714 93.5 68.6 -61.4 -17.6 22.6 12.0 4.7 113 113 A G T << S+ 0 0 52 -3,-1.6 2,-1.4 -4,-0.6 3,-0.3 0.674 75.7 82.5 -74.2 -16.9 22.6 15.0 2.2 114 114 A F <> + 0 0 40 -3,-2.0 4,-2.5 -4,-0.3 5,-0.2 -0.278 57.2 155.8 -83.7 49.5 24.5 13.1 -0.4 115 115 A T H > + 0 0 69 -2,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.844 66.1 46.9 -42.2 -58.2 21.3 11.4 -1.7 116 116 A N H > S+ 0 0 107 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.922 114.7 44.7 -56.6 -50.1 22.4 10.6 -5.1 117 117 A S H > S+ 0 0 3 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.885 110.6 55.7 -64.9 -40.4 25.8 9.1 -4.2 118 118 A L H X S+ 0 0 11 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.906 107.0 49.7 -58.8 -42.1 24.3 7.1 -1.4 119 119 A R H X S+ 0 0 172 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.925 109.6 51.7 -62.8 -43.0 21.8 5.5 -3.8 120 120 A M H <>S+ 0 0 36 -4,-1.9 5,-2.5 1,-0.2 -2,-0.2 0.908 110.7 48.8 -61.3 -41.6 24.7 4.6 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.926 108.6 51.4 -65.0 -45.0 26.5 3.0 -3.3 122 122 A Q H 3<5S+ 0 0 88 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.909 111.0 49.6 -61.6 -33.2 23.6 1.0 -2.3 123 123 A Q T 3<5S- 0 0 82 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.415 114.7-119.6 -82.4 0.7 23.2 -0.2 -5.9 124 124 A K T < 5 + 0 0 102 -3,-1.8 2,-1.2 1,-0.2 -3,-0.2 0.784 62.8 147.3 63.2 36.3 26.9 -1.1 -5.9 125 125 A R >< + 0 0 104 -5,-2.5 4,-2.5 1,-0.2 -1,-0.2 -0.693 18.5 171.7 -99.6 72.7 27.7 1.3 -8.8 126 126 A W H > + 0 0 48 -2,-1.2 4,-2.6 1,-0.2 -1,-0.2 0.892 69.5 45.0 -53.5 -52.9 31.2 2.0 -7.5 127 127 A D H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.918 114.3 49.1 -65.1 -41.4 32.5 4.0 -10.4 128 128 A E H > S+ 0 0 104 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.902 111.6 49.2 -63.8 -41.7 29.5 6.1 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.950 109.3 53.5 -59.5 -46.2 29.4 6.9 -7.0 130 130 A A H X S+ 0 0 11 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.855 109.8 47.3 -56.9 -42.0 33.1 7.8 -7.1 131 131 A V H < S+ 0 0 92 -4,-1.8 4,-0.2 1,-0.2 -1,-0.2 0.899 113.8 47.3 -68.8 -42.1 32.5 10.3 -10.0 132 132 A N H >< S+ 0 0 43 -4,-2.1 3,-1.5 -5,-0.2 4,-0.2 0.904 107.8 54.4 -67.2 -41.8 29.5 11.9 -8.3 133 133 A L H >< S+ 0 0 3 -4,-2.8 3,-1.7 1,-0.3 6,-0.5 0.868 99.9 64.7 -58.1 -36.8 31.2 12.2 -4.8 134 134 A A T 3< S+ 0 0 32 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.580 88.9 66.3 -68.7 -6.8 34.0 14.1 -6.5 135 135 A K T < S+ 0 0 140 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.568 84.6 104.8 -87.4 -5.2 31.8 17.0 -7.5 136 136 A S S <> S- 0 0 22 -3,-1.7 4,-2.1 -4,-0.2 5,-0.2 -0.277 82.1-120.3 -78.2 163.3 31.2 18.0 -3.9 137 137 A R H > S+ 0 0 147 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.914 115.1 62.0 -60.9 -39.8 32.5 20.8 -1.8 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.932 106.0 43.2 -49.9 -51.6 33.9 18.1 0.4 139 139 A Y H 4 S+ 0 0 53 -6,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.917 115.3 48.9 -62.1 -48.4 36.1 16.8 -2.4 140 140 A N H < S+ 0 0 99 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.880 115.5 42.7 -64.7 -35.7 37.2 20.3 -3.5 141 141 A Q H < S+ 0 0 104 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.836 132.1 20.5 -77.6 -39.5 38.1 21.5 0.0 142 142 A T S X S+ 0 0 21 -4,-2.2 4,-2.7 -5,-0.3 5,-0.2 -0.490 73.1 159.1-130.5 63.8 39.9 18.3 1.2 143 143 A P H > + 0 0 48 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.831 68.8 54.8 -60.1 -38.7 40.9 16.5 -2.0 144 144 A N H > S+ 0 0 115 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.953 116.6 38.1 -64.9 -43.5 43.7 14.2 -0.6 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.941 115.9 51.5 -69.8 -46.7 41.5 12.8 2.1 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-2.9 -8,-0.2 5,-0.2 0.925 107.7 54.0 -57.8 -42.0 38.3 12.7 -0.0 147 147 A K H X S+ 0 0 96 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.2 0.907 107.9 50.1 -58.5 -41.7 40.3 10.8 -2.7 148 148 A R H X S+ 0 0 67 -4,-1.6 4,-1.6 -5,-0.2 -1,-0.2 0.945 113.6 45.1 -59.5 -46.7 41.4 8.2 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.937 114.3 48.8 -62.7 -45.6 37.8 7.7 1.0 150 150 A I H X S+ 0 0 13 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.920 108.8 52.7 -61.7 -43.4 36.5 7.6 -2.6 151 151 A T H X S+ 0 0 36 -4,-2.7 4,-2.7 -5,-0.2 6,-0.4 0.851 107.0 52.9 -58.8 -37.2 39.1 5.0 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.899 111.8 46.0 -65.6 -41.2 38.0 2.8 -0.7 153 153 A F H < S+ 0 0 0 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.909 114.0 49.0 -67.0 -41.3 34.5 3.0 -1.9 154 154 A R H < S+ 0 0 106 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.912 126.9 22.0 -63.2 -46.5 35.6 2.3 -5.5 155 155 A T H < S- 0 0 46 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.707 84.4-135.3 -96.7 -29.9 37.7 -0.7 -4.7 156 156 A G S < S+ 0 0 17 -4,-2.6 2,-0.3 -5,-0.3 -62,-0.2 0.737 73.2 105.0 76.1 17.7 36.6 -2.1 -1.4 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.775 78.9-123.2-124.6 171.8 40.3 -2.4 -0.4 158 158 A W S > S+ 0 0 39 -2,-0.3 3,-2.1 1,-0.2 4,-0.3 0.126 72.1 120.5 -99.3 17.9 42.5 -0.5 1.9 159 159 A D G > + 0 0 99 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.777 65.3 60.2 -54.5 -32.0 45.0 0.3 -0.8 160 160 A A G 3 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.668 109.6 45.0 -72.7 -11.2 44.7 4.1 -0.6 161 161 A Y G < 0 0 20 -3,-2.1 -1,-0.2 -13,-0.1 -2,-0.2 0.333 360.0 360.0-110.3 1.2 45.9 3.8 3.0 162 162 A K < 0 0 182 -3,-1.0 -2,-0.2 -4,-0.3 -3,-0.1 0.880 360.0 360.0 -91.9 360.0 48.7 1.4 2.4