==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 25-JAN-91 6LZM . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.A.BELL,K.WILSON,X.-J.ZHANG,H.R.FABER,H.NICHOLSON, . 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) . 116 71.6 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 . 10 6.2 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 1 0 1 2 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,-0.2 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 149.4 43.6 -2.0 9.1 2 2 A N > - 0 0 69 95,-0.0 4,-2.5 1,-0.0 5,-0.2 -0.787 360.0 -88.2-133.5 175.2 40.6 -0.8 11.0 3 3 A I H > S+ 0 0 20 -2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.822 123.0 52.1 -52.4 -43.4 38.4 2.4 11.4 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.919 111.2 45.5 -63.9 -46.0 40.7 3.8 14.1 5 5 A E H > S+ 0 0 100 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.913 113.6 50.6 -65.4 -42.4 43.8 3.4 12.1 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 3,-0.3 0.952 114.0 42.6 -57.8 -56.1 42.2 4.9 9.0 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.826 108.8 58.9 -65.2 -32.2 40.8 7.9 10.8 8 8 A R H X S+ 0 0 102 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.876 108.2 47.1 -64.7 -31.4 44.1 8.4 12.7 9 9 A I H < S+ 0 0 87 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.929 116.3 44.5 -71.6 -43.9 45.8 8.7 9.3 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.805 125.5 27.8 -73.0 -31.1 43.2 11.1 8.0 11 11 A E H < S- 0 0 42 -4,-2.5 19,-0.4 -5,-0.2 -1,-0.2 0.634 89.9-153.0-108.4 -17.6 42.9 13.4 11.1 12 12 A G < - 0 0 24 -4,-1.6 2,-0.4 -5,-0.3 -1,-0.1 -0.071 26.3 -87.1 68.2-172.1 46.4 13.1 12.7 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.985 41.7 174.9-140.8 127.2 46.8 13.7 16.4 14 14 A R E -A 28 0A 144 14,-1.3 14,-2.0 -2,-0.4 4,-0.1 -1.000 18.8-162.4-134.6 130.4 47.4 17.0 18.2 15 15 A L E S+ 0 0 69 -2,-0.4 43,-2.9 12,-0.2 2,-0.3 0.399 75.4 61.2 -92.6 -0.7 47.5 17.6 21.9 16 16 A K E S-C 57 0B 98 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.919 101.4 -85.2-126.7 145.4 47.0 21.4 21.8 17 17 A I E + 0 0 17 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.188 59.5 171.8 -48.3 140.5 43.8 23.3 20.5 18 18 A Y E -A 26 0A 26 8,-3.2 8,-3.5 -4,-0.1 2,-0.4 -0.913 34.2-105.7-147.4 170.5 44.2 23.8 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.868 32.1-137.3-104.4 138.9 42.3 24.9 13.9 20 20 A D > - 0 0 47 4,-2.7 3,-2.1 -2,-0.4 -1,-0.1 -0.159 41.5 -81.3 -79.2-175.2 41.0 22.5 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.825 134.4 49.7 -56.9 -30.6 41.0 22.8 7.6 22 22 A E T 3 S- 0 0 80 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.510 123.0-104.9 -86.7 -8.2 37.9 25.0 7.9 23 23 A G S < S+ 0 0 34 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.513 73.8 141.2 94.4 10.4 39.4 27.2 10.6 24 24 A Y - 0 0 79 1,-0.1 -4,-2.7 -5,-0.0 -1,-0.3 -0.649 60.5-100.3 -90.9 147.1 37.4 25.6 13.5 25 25 A Y E +AB 19 34A 35 9,-0.9 8,-3.1 11,-0.4 9,-1.5 -0.423 54.3 163.4 -66.9 124.2 38.8 24.9 17.0 26 26 A T E -AB 18 32A 2 -8,-3.5 -8,-3.2 6,-0.2 2,-0.3 -0.871 18.9-169.6-139.1 162.5 39.7 21.2 17.3 27 27 A I E > - B 0 31A 0 4,-1.3 4,-2.0 -2,-0.3 -12,-0.2 -0.965 53.4 -2.2-150.6 160.0 41.8 19.0 19.6 28 28 A G E 4 S-A 14 0A 0 -14,-2.0 -14,-1.3 -2,-0.3 2,-0.9 -0.312 122.3 -5.4 63.6-130.8 43.1 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 -0.648 127.6 -52.2-103.8 75.3 42.0 13.2 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.796 83.7 161.1 66.9 27.5 39.7 15.4 14.8 31 31 A H E < -B 27 0A 31 -4,-2.0 -4,-1.3 1,-0.0 -1,-0.2 -0.681 33.0-143.3 -85.5 101.2 37.5 16.2 17.8 32 32 A L E +B 26 0A 72 -2,-1.1 -6,-0.2 -6,-0.2 3,-0.1 -0.366 22.2 179.0 -61.8 131.4 35.7 19.4 16.8 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.881 56.9 -20.4 -99.7 -46.9 35.3 21.7 19.8 34 34 A T E -B 25 0A 26 -9,-1.5 -9,-0.9 2,-0.1 -1,-0.4 -0.973 31.5-145.9-162.9 150.6 33.4 24.7 18.5 35 35 A K S S+ 0 0 133 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.517 73.0 111.7 -94.0 -10.6 32.6 26.6 15.4 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.386 74.0-130.6 -66.8 139.9 32.8 29.8 17.4 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.637 77.7 104.4 -64.1 -16.9 35.7 32.2 16.7 38 38 A S > - 0 0 48 1,-0.2 4,-1.3 2,-0.1 3,-0.3 -0.604 57.3-160.9 -82.3 121.9 36.5 32.4 20.3 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-2.0 1,-0.3 -1,-0.2 0.703 98.0 55.9 -64.9 -20.1 39.4 30.6 21.6 40 40 A N H > S+ 0 0 116 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.871 100.1 54.0 -83.2 -35.3 37.8 30.9 24.9 41 41 A A H > S+ 0 0 31 -3,-0.3 4,-1.6 1,-0.2 -2,-0.2 0.829 112.4 49.2 -61.5 -30.0 34.6 29.3 23.9 42 42 A A H X S+ 0 0 0 -4,-1.3 4,-3.5 2,-0.2 -2,-0.2 0.892 107.6 50.3 -75.2 -47.1 37.0 26.4 22.8 43 43 A K H X S+ 0 0 48 -4,-2.0 4,-2.5 2,-0.2 11,-0.3 0.906 113.1 48.6 -60.3 -39.2 38.9 26.2 26.0 44 44 A S H X S+ 0 0 71 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.904 111.1 48.8 -68.4 -43.4 35.6 26.0 27.9 45 45 A E H X S+ 0 0 66 -4,-1.6 4,-2.8 -5,-0.2 -2,-0.2 0.952 110.5 53.3 -63.3 -43.0 34.2 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-3.5 4,-2.5 1,-0.2 5,-0.3 0.947 108.9 47.5 -55.8 -49.4 37.5 21.5 26.1 47 47 A D H X>S+ 0 0 38 -4,-2.5 4,-3.1 1,-0.2 5,-1.0 0.914 112.0 49.8 -60.0 -41.8 37.1 21.6 29.9 48 48 A K H <5S+ 0 0 141 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.915 111.8 49.2 -60.5 -43.2 33.6 20.5 29.7 49 49 A A H <5S+ 0 0 45 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.905 122.1 32.8 -63.6 -40.0 34.6 17.6 27.4 50 50 A I H <5S- 0 0 40 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.766 99.4-131.5 -87.4 -33.1 37.4 16.5 29.6 51 51 A G T <5S+ 0 0 56 -4,-3.1 2,-0.3 1,-0.3 -3,-0.2 0.847 77.5 74.4 79.4 35.6 35.9 17.4 33.0 52 52 A R S - 0 0 19 -2,-0.9 3,-0.9 -11,-0.3 -1,-0.2 0.762 31.5-146.5 -95.0 -31.5 42.9 21.8 30.6 55 55 A N T 3 S- 0 0 123 1,-0.2 -2,-0.1 -12,-0.2 -12,-0.1 0.958 75.3 -53.0 57.8 51.7 44.1 25.2 29.5 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.475 120.1 95.2 67.1 6.3 43.9 24.1 25.8 57 57 A V B < +C 16 0B 69 -3,-0.9 2,-0.3 -41,-0.2 -41,-0.2 -0.958 45.7 178.1-133.7 142.6 46.1 21.0 26.2 58 58 A I - 0 0 5 -43,-2.9 2,-0.1 -2,-0.4 -30,-0.1 -0.904 27.6-108.3-135.5 165.7 45.4 17.3 26.7 59 59 A T > - 0 0 74 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.355 35.4-107.3 -85.3 169.2 47.2 14.0 27.1 60 60 A K H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.848 120.4 54.5 -63.6 -35.0 47.3 11.2 24.5 61 61 A D H > S+ 0 0 125 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.866 108.6 48.1 -65.0 -42.6 45.0 9.1 26.7 62 62 A E H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.876 110.5 52.1 -66.1 -38.5 42.5 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -34,-0.4 0.911 110.9 47.3 -63.7 -41.4 42.8 12.3 23.0 64 64 A E H X S+ 0 0 69 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.769 108.2 55.4 -71.0 -28.0 42.1 8.6 22.6 65 65 A K H X S+ 0 0 132 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.933 108.9 46.0 -69.4 -44.9 39.2 8.6 24.9 66 66 A L H X S+ 0 0 5 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.890 111.4 54.9 -62.1 -37.8 37.5 11.4 22.9 67 67 A F H X S+ 0 0 11 -4,-1.7 4,-2.3 2,-0.2 5,-0.3 0.947 105.9 50.3 -63.5 -48.7 38.4 9.4 19.8 68 68 A N H X S+ 0 0 93 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.918 112.8 47.7 -56.1 -43.9 36.6 6.2 21.1 69 69 A Q H X S+ 0 0 94 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.870 111.3 50.3 -64.3 -39.9 33.5 8.3 22.0 70 70 A D H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.890 111.7 45.3 -68.6 -40.0 33.4 10.0 18.6 71 71 A V H X S+ 0 0 7 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.929 114.6 49.7 -68.4 -44.9 33.7 6.8 16.5 72 72 A D H X S+ 0 0 88 -4,-2.0 4,-2.9 -5,-0.3 5,-0.3 0.967 112.9 46.8 -57.4 -49.4 31.1 5.1 18.7 73 73 A A H X S+ 0 0 43 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.906 111.1 52.4 -59.5 -42.0 28.8 8.1 18.3 74 74 A A H X S+ 0 0 10 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.955 112.6 44.5 -60.1 -50.2 29.4 8.1 14.5 75 75 A V H X S+ 0 0 33 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.940 113.4 49.3 -59.7 -50.2 28.5 4.5 14.2 76 76 A R H X S+ 0 0 118 -4,-2.9 4,-0.9 1,-0.2 -1,-0.2 0.836 109.9 54.4 -59.3 -32.1 25.3 4.8 16.5 77 77 A G H X S+ 0 0 4 -4,-2.2 4,-0.6 -5,-0.3 3,-0.4 0.903 107.5 47.4 -68.6 -42.5 24.3 7.8 14.4 78 78 A I H >< S+ 0 0 0 -4,-1.8 3,-0.9 1,-0.2 7,-0.5 0.932 111.4 52.5 -61.5 -45.5 24.4 5.9 11.1 79 79 A L H 3< S+ 0 0 74 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.671 113.2 43.9 -67.7 -18.5 22.5 3.0 12.8 80 80 A R H 3< S+ 0 0 174 -4,-0.9 2,-0.5 -3,-0.4 -1,-0.2 0.358 94.4 96.1-100.7 -12.3 19.7 5.5 13.9 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.9 -7,-0.2 3,-0.4 0.865 101.1 69.0 -91.6 -44.5 22.2 5.9 6.3 85 85 A K H X S+ 0 0 82 -4,-2.7 4,-3.0 -7,-0.5 5,-0.2 0.868 100.7 47.6 -43.3 -51.7 21.3 2.7 8.0 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.838 112.4 49.1 -65.4 -35.2 20.2 0.9 4.8 87 87 A V H > S+ 0 0 4 -3,-0.4 4,-0.9 -4,-0.4 3,-0.3 0.955 113.1 48.4 -66.6 -49.3 23.2 2.0 2.9 88 88 A Y H >< S+ 0 0 36 -4,-2.9 3,-1.5 1,-0.2 -3,-0.2 0.943 109.9 50.8 -54.0 -50.6 25.4 0.8 5.8 89 89 A D H 3< S+ 0 0 78 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.803 107.8 55.5 -60.2 -29.8 23.6 -2.5 6.0 90 90 A S H 3< S+ 0 0 33 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.662 94.9 85.9 -78.7 -17.1 24.1 -3.0 2.4 91 91 A L S << S- 0 0 7 -3,-1.5 31,-0.0 -4,-0.9 30,-0.0 -0.537 75.2-115.6 -90.6 162.7 27.8 -2.6 2.3 92 92 A D > - 0 0 56 -2,-0.2 4,-1.7 1,-0.1 5,-0.2 -0.178 45.7 -90.8 -81.2 171.7 30.7 -4.9 2.9 93 93 A A H > S+ 0 0 72 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.869 121.1 45.0 -58.5 -43.0 33.1 -4.4 5.8 94 94 A V H > S+ 0 0 27 62,-0.2 4,-1.2 1,-0.2 3,-0.5 0.937 113.5 49.1 -66.7 -49.3 35.7 -2.1 4.2 95 95 A R H > S+ 0 0 24 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.763 104.5 60.5 -63.0 -27.9 33.2 0.1 2.5 96 96 A R H X S+ 0 0 78 -4,-1.7 4,-2.2 1,-0.2 -1,-0.3 0.899 100.8 55.0 -64.9 -37.5 31.3 0.4 5.8 97 97 A C H X S+ 0 0 20 -4,-1.3 4,-2.4 -3,-0.5 -2,-0.2 0.906 104.4 54.9 -58.9 -40.0 34.5 1.9 7.3 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.835 106.9 48.7 -62.7 -38.4 34.5 4.5 4.5 99 99 A L H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.887 110.3 52.0 -72.8 -33.7 30.9 5.6 5.3 100 100 A I H X S+ 0 0 7 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.953 106.5 55.0 -65.1 -40.4 31.9 5.9 9.0 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.959 108.6 46.6 -54.3 -53.6 34.9 8.1 7.9 102 102 A M H X S+ 0 0 3 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.886 111.9 50.6 -57.3 -44.1 32.6 10.5 6.1 103 103 A V H X S+ 0 0 10 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.911 108.8 52.6 -64.5 -37.4 30.1 10.7 9.0 104 104 A F H < S+ 0 0 30 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.940 116.9 38.3 -62.7 -44.6 33.0 11.4 11.4 105 105 A Q H < S+ 0 0 54 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.842 133.0 19.7 -75.1 -40.6 34.3 14.3 9.3 106 106 A M H X S- 0 0 52 -4,-2.6 4,-0.6 -5,-0.3 -3,-0.2 0.504 101.2-114.3-120.6 8.0 31.1 15.8 8.1 107 107 A G H X - 0 0 32 -4,-2.3 4,-2.1 -5,-0.3 5,-0.1 0.138 35.1 -81.5 76.2 155.8 28.3 14.7 10.4 108 108 A E H > S+ 0 0 52 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.833 127.5 54.1 -57.8 -45.5 25.2 12.6 9.7 109 109 A T H > S+ 0 0 120 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.931 106.8 49.7 -61.4 -48.0 23.4 15.4 8.2 110 110 A G H >< S+ 0 0 30 -4,-0.6 3,-0.9 1,-0.2 -2,-0.2 0.948 114.9 43.7 -55.6 -52.9 26.1 16.2 5.8 111 111 A V H >< S+ 0 0 1 -4,-2.1 3,-2.8 1,-0.3 -2,-0.2 0.913 105.9 59.4 -60.1 -47.4 26.4 12.7 4.6 112 112 A A H 3< S+ 0 0 15 -4,-3.3 -1,-0.3 1,-0.3 -2,-0.2 0.737 97.1 67.1 -56.1 -19.5 22.7 12.2 4.4 113 113 A G T << S+ 0 0 57 -4,-1.1 2,-0.9 -3,-0.9 -1,-0.3 0.569 76.9 82.6 -76.4 -10.1 22.8 15.1 1.9 114 114 A F <> + 0 0 42 -3,-2.8 4,-2.5 1,-0.2 3,-0.5 -0.209 58.3 157.0 -91.2 51.8 24.7 13.0 -0.6 115 115 A T H > + 0 0 73 -2,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.821 66.0 44.3 -40.0 -57.4 21.4 11.4 -1.8 116 116 A N H > S+ 0 0 86 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.865 114.6 47.6 -64.8 -39.9 22.5 10.3 -5.3 117 117 A S H > S+ 0 0 1 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.834 110.2 54.0 -69.0 -39.2 25.8 8.9 -4.2 118 118 A L H X S+ 0 0 11 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.928 108.0 49.9 -59.8 -43.3 24.2 7.0 -1.4 119 119 A R H X S+ 0 0 121 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.892 110.9 49.8 -62.1 -39.6 21.7 5.5 -3.9 120 120 A M H <>S+ 0 0 23 -4,-1.7 5,-2.6 2,-0.2 -1,-0.2 0.811 109.3 50.0 -71.8 -32.6 24.5 4.4 -6.1 121 121 A L H ><5S+ 0 0 1 -4,-1.9 3,-2.0 3,-0.2 -2,-0.2 0.924 108.7 54.2 -71.8 -40.7 26.5 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 91 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.924 109.9 46.1 -56.7 -40.6 23.4 1.0 -2.4 123 123 A Q T 3<5S- 0 0 85 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.402 114.0-121.5 -80.4 -0.5 23.1 -0.4 -5.9 124 124 A K T < 5 + 0 0 98 -3,-2.0 2,-1.3 1,-0.2 -3,-0.2 0.773 60.6 149.1 64.7 31.6 26.7 -1.2 -5.9 125 125 A R >< + 0 0 112 -5,-2.6 4,-2.2 1,-0.2 5,-0.2 -0.721 20.0 175.4 -95.8 81.2 27.6 0.9 -8.8 126 126 A W H > + 0 0 52 -2,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.877 69.1 44.2 -56.1 -52.5 31.1 1.6 -7.6 127 127 A D H > S+ 0 0 113 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.877 116.4 47.6 -65.5 -39.5 32.7 3.6 -10.4 128 128 A E H > S+ 0 0 107 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.896 110.8 49.8 -73.7 -36.2 29.6 5.7 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 -9,-0.2 -2,-0.2 0.884 108.8 55.7 -64.5 -37.0 29.3 6.5 -7.2 130 130 A A H X S+ 0 0 12 -4,-2.0 4,-1.2 1,-0.2 -2,-0.2 0.919 107.5 47.3 -60.9 -45.4 33.0 7.4 -7.2 131 131 A V H X S+ 0 0 88 -4,-1.8 4,-0.6 1,-0.2 3,-0.3 0.906 114.7 47.2 -62.8 -42.5 32.5 10.0 -9.9 132 132 A N H >< S+ 0 0 41 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.884 105.9 56.7 -70.6 -39.1 29.5 11.4 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-2.8 6,-0.3 1,-0.2 -1,-0.2 0.875 102.1 58.7 -58.7 -35.2 31.1 11.7 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.2 2,-1.8 -3,-0.3 -1,-0.2 0.681 85.4 79.7 -70.5 -19.4 33.9 13.8 -6.3 135 135 A K S << S+ 0 0 157 -3,-0.9 2,-0.3 -4,-0.6 -1,-0.2 -0.541 80.7 98.1 -87.4 68.5 31.5 16.5 -7.5 136 136 A S S > S- 0 0 17 -2,-1.8 4,-2.0 1,-0.1 5,-0.2 -0.991 85.2-116.4-152.3 157.9 31.3 18.0 -4.1 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.7 1,-0.2 5,-0.3 0.912 115.6 62.5 -59.9 -41.6 32.6 20.8 -2.0 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.911 105.1 45.1 -49.7 -47.9 34.1 18.1 0.2 139 139 A Y H 4 S+ 0 0 61 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.900 115.6 46.6 -66.0 -44.3 36.2 16.8 -2.7 140 140 A N H < S+ 0 0 107 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.896 116.1 44.7 -66.3 -39.2 37.3 20.3 -3.7 141 141 A Q H < S+ 0 0 104 -4,-3.7 -2,-0.2 1,-0.2 -3,-0.2 0.912 131.4 17.6 -73.3 -42.8 38.1 21.4 -0.1 142 142 A T S X S+ 0 0 20 -4,-2.3 4,-2.6 -5,-0.3 -1,-0.2 -0.621 73.6 165.6-128.4 70.6 40.0 18.2 1.1 143 143 A P H > S+ 0 0 52 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.829 70.5 50.4 -60.8 -39.6 41.0 16.5 -2.1 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.887 116.0 41.0 -68.5 -40.8 43.6 14.0 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.6 -3,-0.2 5,-0.3 0.927 115.1 51.4 -68.8 -49.0 41.4 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -8,-0.2 5,-0.3 0.940 109.6 52.2 -53.3 -44.5 38.3 12.6 -0.2 147 147 A K H X S+ 0 0 90 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.881 108.8 49.4 -60.5 -38.1 40.4 10.7 -2.8 148 148 A R H X S+ 0 0 67 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.953 115.1 42.2 -65.7 -48.7 41.4 8.2 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.909 114.7 52.3 -64.7 -41.3 37.8 7.6 1.1 150 150 A I H X S+ 0 0 13 -4,-2.9 4,-1.9 -5,-0.3 -1,-0.2 0.862 108.1 50.3 -64.7 -39.1 36.5 7.6 -2.5 151 151 A T H X S+ 0 0 35 -4,-2.0 4,-2.7 -5,-0.3 6,-0.3 0.855 106.2 56.5 -66.6 -34.1 39.0 4.9 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.926 110.1 45.3 -61.7 -42.4 38.0 2.8 -0.6 153 153 A F H < S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.880 114.1 49.3 -67.6 -40.6 34.4 3.0 -1.9 154 154 A R H < S+ 0 0 112 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.919 125.8 22.7 -68.8 -44.0 35.4 2.2 -5.4 155 155 A T H < S- 0 0 43 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.648 84.5-135.7 -98.9 -25.3 37.6 -0.8 -4.6 156 156 A G S < S+ 0 0 15 -4,-2.4 -62,-0.2 -5,-0.3 2,-0.2 0.683 72.9 99.1 73.2 15.7 36.5 -2.2 -1.4 157 157 A T S S- 0 0 49 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.751 81.0-116.4-123.8 176.0 40.2 -2.6 -0.2 158 158 A W S > S+ 0 0 35 -2,-0.2 3,-2.0 1,-0.2 4,-0.3 0.157 73.6 120.0 -98.3 16.5 42.6 -0.5 1.9 159 159 A D G > + 0 0 97 1,-0.3 3,-1.9 2,-0.2 -1,-0.2 0.853 67.2 59.3 -50.8 -42.1 45.0 0.2 -0.9 160 160 A A G 3 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.690 110.8 44.7 -61.9 -21.3 44.6 4.0 -0.6 161 161 A Y G < 0 0 20 -3,-2.0 -1,-0.3 -13,-0.1 -2,-0.2 0.325 360.0 360.0-104.8 2.2 45.8 3.7 3.0 162 162 A K < 0 0 169 -3,-1.9 -2,-0.2 -4,-0.3 -3,-0.2 0.693 360.0 360.0-112.9 360.0 48.6 1.5 2.3