==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-JUN-09 3HTG . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.E.BOYCE,D.L.MOBLEY,G.J.ROCKLIN,A.P.GRAVES,K.A.DILL, . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8971.0 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 . 10 6.2 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 . 14 8.6 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 1 0 1 1 2 0 0 1 1 1 0 0 0 0 0 0 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 1 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 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 85 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 144.5 17.1 1.8 9.0 2 2 A N > - 0 0 67 156,-0.0 4,-2.6 95,-0.0 5,-0.2 -0.902 360.0 -81.7-153.1 176.9 20.4 0.9 10.8 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.839 126.5 51.5 -59.6 -35.6 22.4 -2.3 11.2 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.944 112.5 44.1 -67.1 -46.3 20.2 -3.6 14.1 5 5 A E H > S+ 0 0 90 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.886 114.9 51.4 -63.4 -39.0 17.0 -3.2 12.1 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.951 113.5 41.3 -64.7 -52.3 18.6 -4.7 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.845 109.6 60.0 -68.2 -31.2 19.9 -7.8 10.8 8 8 A R H X S+ 0 0 108 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.914 108.5 45.1 -61.4 -40.4 16.7 -8.1 12.8 9 9 A I H < S+ 0 0 83 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.942 117.9 43.2 -63.8 -47.4 14.9 -8.5 9.4 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.818 124.7 32.4 -72.2 -30.4 17.4 -10.9 8.0 11 11 A E H < S- 0 0 40 -4,-2.8 19,-0.4 1,-0.2 -1,-0.2 0.681 92.3-152.2-101.4 -22.0 17.8 -13.1 11.2 12 12 A G < - 0 0 22 -4,-1.9 2,-0.4 -5,-0.3 -1,-0.2 -0.184 22.4 -90.8 73.8-173.1 14.4 -13.0 12.8 13 13 A L + 0 0 44 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.947 44.5 166.4-142.1 117.9 13.7 -13.4 16.5 14 14 A R E -A 28 0A 146 14,-1.8 14,-2.3 -2,-0.4 4,-0.1 -1.000 22.2-159.5-133.9 134.3 13.1 -16.8 18.1 15 15 A L E S+ 0 0 62 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.531 74.1 63.7 -95.6 -5.5 13.2 -17.3 21.9 16 16 A K E S-C 57 0B 142 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.876 101.0 -86.3-115.6 150.8 13.7 -21.1 21.8 17 17 A I E + 0 0 30 39,-2.0 2,-0.3 -2,-0.3 10,-0.2 -0.284 58.7 167.3 -55.6 132.8 16.6 -23.0 20.4 18 18 A Y E -A 26 0A 29 8,-2.6 8,-3.0 6,-0.1 2,-0.5 -0.897 37.9-100.4-139.4 168.4 16.1 -23.6 16.7 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.841 35.0-138.1 -97.6 133.1 18.2 -24.7 13.7 20 20 A D > - 0 0 45 4,-2.7 3,-2.0 -2,-0.5 -1,-0.1 0.032 42.1 -78.3 -73.5-173.7 19.6 -22.0 11.4 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.732 134.5 50.4 -62.5 -24.3 19.7 -22.3 7.6 22 22 A E T 3 S- 0 0 72 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.368 123.1-103.8 -93.6 2.3 22.8 -24.5 7.9 23 23 A G S < S+ 0 0 39 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.578 76.1 138.7 86.9 11.7 21.1 -26.9 10.4 24 24 A Y - 0 0 77 1,-0.1 -4,-2.7 9,-0.0 -1,-0.3 -0.737 61.7-101.6 -99.3 138.6 23.0 -25.4 13.4 25 25 A Y E +A 19 0A 35 11,-0.4 8,-2.8 9,-0.4 9,-1.3 -0.328 54.6 159.9 -60.1 129.7 21.5 -24.7 16.8 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-2.6 6,-0.3 2,-0.3 -0.885 19.0-167.7-145.9 160.7 20.8 -21.0 17.2 27 27 A I E > + B 0 31A 0 4,-1.9 4,-2.3 -2,-0.3 2,-0.2 -0.975 51.5 5.2-149.7 165.0 18.7 -18.8 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.8 -2,-0.3 2,-0.9 -0.419 123.4 -7.9 73.1-130.7 17.5 -15.2 19.5 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.731 129.3 -50.7-106.9 74.8 18.5 -12.9 16.6 30 30 A G T 4 S+ 0 0 14 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.786 83.0 162.3 64.2 30.9 20.8 -15.3 14.8 31 31 A H E < -B 27 0A 30 -4,-2.3 -4,-1.9 -20,-0.1 2,-0.2 -0.715 31.3-145.0 -82.9 102.7 22.9 -16.1 17.8 32 32 A L E -B 26 0A 75 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.511 18.3-176.1 -66.8 130.2 24.8 -19.3 16.7 33 33 A L - 0 0 13 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.866 57.7 -32.9 -93.8 -45.9 25.2 -21.6 19.7 34 34 A T - 0 0 32 -9,-1.3 -9,-0.4 2,-0.1 -1,-0.4 -0.971 34.5-130.4-169.0 157.3 27.3 -24.5 18.3 35 35 A K S S+ 0 0 133 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.452 75.3 115.2 -92.7 -3.4 27.9 -26.5 15.1 36 36 A S - 0 0 38 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.396 67.3-140.8 -64.7 139.3 27.5 -29.7 17.2 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.533 77.1 101.9 -75.6 -4.1 24.6 -31.9 16.4 38 38 A D >> - 0 0 80 1,-0.2 4,-1.6 2,-0.0 3,-0.6 -0.721 60.7-159.2 -86.1 112.7 24.1 -32.5 20.1 39 39 A L H 3> S+ 0 0 66 -2,-0.7 4,-2.5 1,-0.2 5,-0.2 0.844 93.2 59.5 -58.8 -34.7 21.3 -30.4 21.5 40 40 A N H 3> S+ 0 0 112 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.875 102.5 52.4 -61.7 -37.3 22.8 -30.8 25.0 41 41 A A H <> S+ 0 0 31 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.901 109.9 48.9 -63.4 -40.3 25.9 -29.1 23.8 42 42 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.891 109.5 51.9 -63.6 -42.4 23.8 -26.2 22.4 43 43 A K H X S+ 0 0 52 -4,-2.5 4,-2.5 2,-0.2 11,-0.3 0.895 108.7 51.3 -62.7 -39.1 22.0 -25.9 25.8 44 44 A S H X S+ 0 0 69 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.942 109.7 49.1 -62.1 -48.0 25.3 -25.8 27.6 45 45 A E H X S+ 0 0 66 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.898 111.1 51.2 -58.8 -40.0 26.5 -23.0 25.3 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.945 109.3 48.5 -62.1 -48.8 23.3 -21.1 25.9 47 47 A D H X>S+ 0 0 34 -4,-2.5 4,-2.4 1,-0.2 5,-0.9 0.886 113.0 48.9 -59.8 -40.0 23.5 -21.3 29.6 48 48 A K H <5S+ 0 0 143 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.886 111.8 49.5 -63.3 -42.9 27.1 -20.1 29.4 49 49 A A H <5S+ 0 0 40 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.866 121.0 33.4 -65.9 -37.7 26.1 -17.2 27.1 50 50 A I H <5S- 0 0 38 -4,-2.4 -2,-0.2 2,-0.3 -1,-0.2 0.735 101.4-127.9 -92.5 -26.4 23.3 -16.0 29.4 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 -5,-0.3 -3,-0.2 0.731 78.2 74.4 80.6 24.9 24.8 -16.9 32.8 52 52 A R S - 0 0 10 -2,-0.9 3,-1.4 -11,-0.3 -1,-0.2 0.625 31.4-145.8 -94.9 -19.3 17.9 -21.5 30.5 55 55 A N T 3 S- 0 0 106 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.864 74.8 -51.2 39.4 47.9 16.9 -25.0 29.4 56 56 A G T 3 S+ 0 0 6 -13,-0.2 -39,-2.0 1,-0.1 2,-0.4 0.554 118.9 96.7 81.7 10.3 16.8 -23.8 25.8 57 57 A V B < +C 16 0B 71 -3,-1.4 2,-0.3 -41,-0.2 -41,-0.2 -0.997 43.5 176.3-135.8 136.8 14.5 -20.8 26.2 58 58 A I - 0 0 5 -43,-2.5 2,-0.2 -2,-0.4 -30,-0.1 -0.829 27.8-108.3-130.1 169.8 15.4 -17.1 26.7 59 59 A T > - 0 0 68 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.508 33.2-108.4 -90.9 166.6 13.5 -13.7 27.0 60 60 A K H > S+ 0 0 116 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.904 121.0 53.6 -60.1 -40.7 13.4 -11.0 24.4 61 61 A D H > S+ 0 0 125 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.908 109.5 48.6 -62.1 -42.1 15.7 -8.8 26.5 62 62 A E H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.905 110.5 50.5 -63.9 -41.6 18.2 -11.6 26.7 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -34,-0.4 0.912 110.7 49.5 -61.8 -42.1 18.0 -12.1 22.9 64 64 A E H X S+ 0 0 78 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.844 108.0 54.2 -67.4 -33.2 18.6 -8.4 22.4 65 65 A K H X S+ 0 0 135 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.944 109.7 46.0 -65.7 -47.0 21.6 -8.5 24.7 66 66 A L H X S+ 0 0 4 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.897 111.9 53.7 -58.7 -38.6 23.2 -11.3 22.8 67 67 A F H X S+ 0 0 10 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.925 106.9 50.0 -64.0 -45.3 22.4 -9.4 19.6 68 68 A N H X S+ 0 0 90 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.934 114.1 46.1 -56.7 -46.6 24.1 -6.2 20.9 69 69 A Q H X S+ 0 0 100 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.914 112.8 49.7 -63.2 -43.6 27.2 -8.3 21.8 70 70 A D H X S+ 0 0 36 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.889 111.3 47.4 -67.4 -40.3 27.2 -10.1 18.4 71 71 A V H X S+ 0 0 5 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.945 113.6 48.8 -63.3 -46.5 26.9 -6.9 16.3 72 72 A D H X S+ 0 0 106 -4,-2.2 4,-2.7 -5,-0.2 5,-0.2 0.930 112.8 47.6 -56.5 -51.3 29.7 -5.3 18.4 73 73 A A H X S+ 0 0 62 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.872 110.5 52.2 -60.3 -39.4 31.9 -8.3 18.0 74 74 A A H X S+ 0 0 12 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.940 113.0 43.6 -63.7 -49.2 31.3 -8.5 14.2 75 75 A V H X S+ 0 0 37 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.920 115.2 48.4 -59.4 -49.3 32.2 -4.8 13.7 76 76 A R H X S+ 0 0 121 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.898 108.2 55.1 -64.4 -36.3 35.3 -5.1 15.9 77 77 A G H X S+ 0 0 12 -4,-2.4 4,-0.6 -5,-0.2 -1,-0.2 0.909 105.5 53.0 -59.4 -43.3 36.3 -8.2 14.1 78 78 A I H >< S+ 0 0 2 -4,-1.9 3,-1.2 1,-0.2 7,-0.4 0.937 109.1 48.8 -56.2 -46.7 36.2 -6.4 10.8 79 79 A L H 3< S+ 0 0 61 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.806 111.3 50.0 -67.2 -28.0 38.5 -3.7 12.2 80 80 A R H 3< S+ 0 0 183 -4,-1.7 2,-0.6 -5,-0.2 -1,-0.3 0.500 92.1 92.1 -86.6 -4.9 40.9 -6.3 13.5 81 81 A N S+ 0 0 142 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.863 119.4 39.4 -82.0 -38.7 42.0 -7.7 4.8 84 84 A L H > S+ 0 0 17 -6,-0.2 4,-3.0 1,-0.1 5,-0.3 0.865 100.8 69.9 -83.2 -37.4 38.7 -6.3 5.8 85 85 A K H X S+ 0 0 97 -4,-3.1 4,-3.0 -7,-0.4 5,-0.2 0.891 98.9 46.7 -53.8 -50.9 39.6 -3.1 7.6 86 86 A P H > S+ 0 0 58 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.893 116.0 46.3 -61.6 -36.4 40.8 -1.1 4.6 87 87 A V H >X S+ 0 0 8 -4,-0.6 4,-0.8 -3,-0.2 3,-0.5 0.964 113.8 48.0 -67.4 -48.1 37.8 -2.1 2.6 88 88 A Y H >< S+ 0 0 30 -4,-3.0 3,-1.3 1,-0.2 -1,-0.2 0.925 111.1 50.7 -57.1 -47.4 35.4 -1.3 5.4 89 89 A D H 3< S+ 0 0 78 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.786 105.8 57.3 -64.8 -24.8 37.0 2.1 6.1 90 90 A S H << S+ 0 0 36 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.664 94.8 88.8 -75.0 -19.2 36.7 2.9 2.4 91 91 A L S << S- 0 0 7 -3,-1.3 2,-0.1 -4,-0.8 31,-0.0 -0.470 77.6-118.1 -84.9 153.7 32.9 2.4 2.5 92 92 A D > - 0 0 55 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.296 44.5 -92.8 -73.0 170.8 30.1 4.9 3.3 93 93 A A H > S+ 0 0 71 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.827 122.2 49.7 -63.0 -37.2 27.9 4.1 6.3 94 94 A V H > S+ 0 0 28 2,-0.2 4,-1.3 62,-0.2 3,-0.4 0.944 112.5 46.4 -70.1 -47.3 25.2 2.2 4.4 95 95 A R H > S+ 0 0 26 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.859 105.5 61.7 -63.9 -31.1 27.6 -0.1 2.6 96 96 A R H X S+ 0 0 76 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.891 100.6 54.8 -57.7 -38.6 29.4 -0.6 5.9 97 97 A C H X S+ 0 0 17 -4,-1.3 4,-2.7 -3,-0.4 -1,-0.2 0.874 103.7 54.0 -62.5 -39.1 26.2 -2.1 7.2 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.923 109.3 48.8 -59.8 -42.5 26.1 -4.6 4.3 99 99 A A H X S+ 0 0 17 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.914 111.2 48.8 -63.9 -43.1 29.7 -5.7 5.3 100 100 A I H X S+ 0 0 6 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.922 110.8 52.1 -61.8 -42.8 28.7 -6.1 9.0 101 101 A N H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.944 110.4 46.6 -57.6 -50.0 25.6 -8.1 7.9 102 102 A Q H X S+ 0 0 23 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.918 114.0 47.4 -62.2 -43.6 27.7 -10.5 5.7 103 103 A V H X S+ 0 0 19 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.885 109.4 54.8 -63.4 -40.4 30.3 -11.0 8.5 104 104 A F H < S+ 0 0 31 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.924 116.8 37.3 -57.3 -42.7 27.5 -11.6 11.0 105 105 A Q H < S+ 0 0 52 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.916 132.4 23.5 -76.2 -42.5 26.1 -14.3 8.8 106 106 A M H < S- 0 0 69 -4,-2.8 3,-0.3 1,-0.2 4,-0.3 0.607 89.6-144.9-103.5 -22.6 29.4 -15.9 7.5 107 107 A G < - 0 0 38 -4,-2.7 -1,-0.2 -5,-0.3 3,-0.2 -0.255 40.2 -71.9 71.9-167.3 32.1 -15.0 10.0 108 108 A E S > S+ 0 0 73 1,-0.1 3,-1.7 2,-0.1 4,-0.2 0.491 103.1 95.5-104.2 -3.8 35.6 -14.3 8.8 109 109 A T T 3 S+ 0 0 146 -3,-0.3 3,-0.3 1,-0.3 -1,-0.1 0.806 88.2 46.2 -63.6 -30.0 36.9 -17.8 7.7 110 110 A G T >> S+ 0 0 35 -4,-0.3 3,-1.0 -3,-0.2 4,-0.9 0.237 75.5 114.2 -96.7 13.9 36.0 -17.3 4.0 111 111 A V G X4 S+ 0 0 21 -3,-1.7 3,-1.3 1,-0.3 -1,-0.2 0.882 72.1 57.1 -52.1 -45.8 37.4 -13.8 3.6 112 112 A A G >4 S+ 0 0 76 -3,-0.3 3,-1.5 1,-0.3 -1,-0.3 0.842 100.1 60.1 -57.7 -33.3 40.2 -15.0 1.2 113 113 A G G <4 S+ 0 0 64 -3,-1.0 3,-0.4 1,-0.3 -1,-0.3 0.815 103.6 51.0 -62.1 -30.1 37.4 -16.4 -1.1 114 114 A F G S+ 0 0 58 -3,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.882 79.0 44.0 -51.9 -46.3 39.3 -11.3 -2.3 116 116 A N H > S+ 0 0 79 -3,-0.4 4,-2.2 -4,-0.2 -1,-0.2 0.902 113.6 49.4 -70.8 -41.0 38.0 -10.2 -5.7 117 117 A S H > S+ 0 0 1 -4,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.922 111.5 50.7 -60.2 -45.2 34.7 -8.9 -4.4 118 118 A L H X S+ 0 0 29 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.892 108.9 50.5 -61.7 -42.3 36.5 -6.9 -1.7 119 119 A R H X S+ 0 0 120 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.932 110.7 49.4 -61.1 -46.2 38.9 -5.3 -4.2 120 120 A M H <>S+ 0 0 40 -4,-2.2 5,-2.5 1,-0.2 4,-0.4 0.900 111.1 50.0 -62.2 -39.0 35.9 -4.3 -6.4 121 121 A L H ><5S+ 0 0 3 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.928 110.2 49.2 -63.1 -45.6 34.2 -2.8 -3.4 122 122 A Q H 3<5S+ 0 0 94 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.853 110.8 51.3 -63.6 -33.1 37.3 -0.8 -2.4 123 123 A Q T 3<5S- 0 0 85 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.515 111.6-125.1 -76.2 -8.7 37.5 0.4 -6.0 124 124 A K T < 5 + 0 0 97 -3,-1.3 2,-1.3 -4,-0.4 -3,-0.2 0.813 61.4 146.4 63.9 34.0 33.9 1.5 -5.9 125 125 A R >< + 0 0 121 -5,-2.5 4,-2.8 1,-0.2 -1,-0.2 -0.687 22.4 173.6 -95.4 77.1 33.1 -0.6 -8.9 126 126 A W H > + 0 0 50 -2,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.872 67.3 44.8 -66.8 -42.7 29.6 -1.3 -7.5 127 127 A D H > S+ 0 0 118 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.919 116.3 48.4 -67.6 -41.1 27.9 -3.2 -10.3 128 128 A E H > S+ 0 0 109 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.922 111.7 49.8 -62.2 -43.9 31.0 -5.4 -10.9 129 129 A A H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.921 109.5 51.9 -60.2 -44.3 31.2 -6.1 -7.1 130 130 A A H X S+ 0 0 9 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.895 109.4 49.1 -62.5 -42.2 27.6 -7.0 -7.0 131 131 A V H X S+ 0 0 86 -4,-2.2 4,-0.5 1,-0.2 3,-0.3 0.931 113.9 46.5 -59.7 -45.0 28.0 -9.5 -9.9 132 132 A N H >< S+ 0 0 36 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.890 106.5 57.7 -67.8 -38.8 31.0 -11.1 -8.3 133 133 A L H 3< S+ 0 0 1 -4,-2.8 6,-0.4 1,-0.3 -1,-0.2 0.827 101.7 56.7 -61.4 -32.4 29.3 -11.3 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.3 2,-1.8 -3,-0.3 -1,-0.3 0.640 85.5 82.4 -76.6 -15.8 26.5 -13.4 -6.3 135 135 A K S << S+ 0 0 158 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.527 81.6 98.3 -85.0 69.3 29.0 -16.0 -7.7 136 136 A S S > S- 0 0 17 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.997 85.5-118.6-156.4 151.1 29.1 -17.7 -4.3 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.908 115.7 62.2 -56.5 -41.1 27.9 -20.5 -2.1 138 138 A W H > S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.929 106.5 41.8 -49.8 -54.2 26.5 -17.7 0.1 139 139 A Y H 4 S+ 0 0 60 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.931 115.2 50.0 -61.6 -48.2 24.2 -16.4 -2.6 140 140 A N H < S+ 0 0 106 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.879 115.3 42.1 -63.5 -36.0 23.1 -19.8 -3.8 141 141 A Q H < S+ 0 0 111 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.833 132.6 20.3 -81.9 -34.1 22.2 -21.0 -0.3 142 142 A T S X S+ 0 0 19 -4,-2.3 4,-2.7 -5,-0.3 -1,-0.2 -0.579 75.1 158.9-129.6 69.0 20.5 -17.8 0.9 143 143 A P H > S+ 0 0 47 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.863 70.0 51.1 -69.2 -35.5 19.6 -16.0 -2.3 144 144 A D H > S+ 0 0 109 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.945 116.7 40.5 -68.7 -42.4 16.9 -13.7 -1.0 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.926 115.7 50.7 -65.6 -46.4 19.0 -12.4 1.9 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 5,-0.2 0.897 106.7 55.6 -61.3 -38.9 22.1 -12.2 -0.3 147 147 A K H X S+ 0 0 99 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.912 109.1 47.4 -58.4 -42.1 20.1 -10.3 -2.9 148 148 A R H X S+ 0 0 68 -4,-1.6 4,-1.9 2,-0.2 12,-0.2 0.935 114.7 45.1 -64.3 -45.9 19.2 -7.7 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.930 113.9 49.8 -65.9 -42.1 22.8 -7.4 1.1 150 150 A I H X S+ 0 0 7 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.908 108.3 52.5 -63.1 -42.0 24.1 -7.2 -2.5 151 151 A T H X S+ 0 0 29 -4,-2.6 4,-2.7 -5,-0.2 6,-0.4 0.894 108.5 52.0 -59.5 -38.8 21.6 -4.5 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.931 112.3 44.7 -63.2 -45.1 22.8 -2.6 -0.3 153 153 A F H < S+ 0 0 4 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.854 116.0 48.3 -63.0 -37.2 26.5 -2.9 -1.5 154 154 A R H < S+ 0 0 79 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.907 126.7 21.9 -73.5 -40.8 25.5 -2.0 -5.1 155 155 A T H < S- 0 0 50 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.665 83.4-135.3-103.2 -22.7 23.4 1.1 -4.3 156 156 A G S < S+ 0 0 18 -4,-2.4 2,-0.3 -5,-0.3 -62,-0.2 0.784 73.9 107.8 61.7 26.0 24.5 2.4 -0.8 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.833 80.1-122.3-124.5 167.7 20.7 2.8 -0.1 158 158 A W >> + 0 0 49 -2,-0.3 3,-2.2 1,-0.2 4,-0.7 0.116 69.7 124.4 -92.7 20.3 18.3 0.9 2.0 159 159 A D G >4 + 0 0 94 1,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.805 68.9 55.1 -53.0 -35.9 16.0 0.1 -1.0 160 160 A A G 34 S+ 0 0 32 -3,-0.4 -1,-0.3 -12,-0.2 -2,-0.1 0.623 110.6 46.1 -75.1 -11.1 16.1 -3.7 -0.3 161 161 A Y G <4 0 0 17 -3,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.412 360.0 360.0-112.2 -1.8 14.9 -3.3 3.3 162 162 A K << 0 0 188 -4,-0.7 -1,-0.1 -3,-0.6 -2,-0.1 0.633 360.0 360.0 -63.9 360.0 12.0 -0.8 2.6