==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 20-JUN-94 161L . 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) . 8678.0 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 . 7 4.3 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 . 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 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,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 154.0 43.5 -1.8 9.1 2 2 A N > - 0 0 69 156,-0.0 4,-2.7 95,-0.0 3,-0.2 -0.907 360.0 -80.1-153.0 177.8 40.3 -0.7 10.7 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.819 124.3 50.7 -52.2 -41.0 38.2 2.3 11.2 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.924 113.4 43.6 -65.7 -46.2 40.3 3.7 14.0 5 5 A E H > S+ 0 0 97 -3,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.891 113.6 53.9 -65.3 -38.6 43.6 3.4 12.2 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.940 112.6 40.4 -62.1 -52.4 41.9 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 5,-0.4 0.841 109.3 61.1 -67.9 -29.0 40.6 7.9 10.8 8 8 A R H X S+ 0 0 98 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.916 108.4 45.1 -65.0 -34.1 43.9 8.3 12.8 9 9 A I H < S+ 0 0 87 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.955 116.4 45.3 -69.7 -47.1 45.7 8.6 9.4 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.852 125.4 29.5 -66.0 -36.1 43.0 11.0 8.0 11 11 A E H < S- 0 0 46 -4,-2.8 19,-0.3 1,-0.2 -1,-0.2 0.747 91.9-151.6 -99.0 -27.2 42.8 13.3 11.1 12 12 A G < - 0 0 24 -4,-1.9 2,-0.4 -5,-0.4 -1,-0.2 -0.287 26.6 -88.4 79.4-175.6 46.3 13.1 12.7 13 13 A L + 0 0 37 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.982 43.1 173.5-137.8 125.1 46.8 13.5 16.5 14 14 A R E -A 28 0A 142 14,-1.6 14,-2.9 -2,-0.4 4,-0.1 -0.997 18.2-164.0-135.7 128.1 47.3 16.9 18.1 15 15 A L E S+ 0 0 58 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.380 73.6 62.8 -95.9 2.4 47.4 17.4 21.8 16 16 A K E S-C 57 0B 146 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.919 100.9 -86.1-122.4 151.3 47.0 21.1 21.8 17 17 A I E + 0 0 30 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.275 58.9 169.3 -53.4 135.2 44.0 23.1 20.5 18 18 A Y E -A 26 0A 23 8,-2.8 8,-3.3 -4,-0.1 2,-0.4 -0.864 35.9-103.4-142.8 170.7 44.4 23.7 16.8 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.855 34.0-139.4-100.5 133.6 42.4 25.0 13.8 20 20 A D > - 0 0 50 4,-2.8 3,-2.3 -2,-0.4 -1,-0.1 -0.119 41.6 -77.2 -80.5-171.3 41.0 22.5 11.4 21 21 A T T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.746 134.7 47.0 -58.3 -25.6 40.9 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 0.353 124.1-101.8 -95.3 -2.0 37.9 25.1 7.9 23 23 A G S < S+ 0 0 37 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.629 75.8 139.2 90.3 14.2 39.5 27.2 10.6 24 24 A Y - 0 0 77 1,-0.1 -4,-2.8 9,-0.0 -1,-0.3 -0.734 59.8-103.3 -99.2 145.5 37.6 25.7 13.6 25 25 A Y E +AB 19 34A 37 9,-0.7 8,-2.8 11,-0.4 9,-1.4 -0.415 53.7 156.4 -67.0 127.8 39.1 24.9 16.9 26 26 A T E -AB 18 32A 3 -8,-3.3 -8,-2.8 6,-0.3 2,-0.3 -0.881 19.6-167.7-141.9 170.1 39.7 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.0 -2,-0.3 2,-0.2 -0.974 51.4 9.8-156.8 164.1 41.9 18.9 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.9 -14,-1.6 -2,-0.3 2,-0.9 -0.513 122.8 -10.3 73.8-134.2 43.0 15.3 19.5 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -2,-0.2 -17,-0.1 -0.740 128.3 -50.0-103.3 75.4 42.1 13.1 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.737 83.4 160.0 69.4 27.7 39.7 15.5 14.8 31 31 A H E < -B 27 0A 32 -4,-2.0 -4,-1.6 1,-0.0 -1,-0.2 -0.678 32.3-144.6 -85.9 103.6 37.6 16.3 17.7 32 32 A L E -B 26 0A 71 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.426 18.0-176.7 -66.7 129.0 35.8 19.6 16.9 33 33 A L E - 0 0 15 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.878 57.8 -29.6 -93.3 -45.9 35.3 21.8 19.9 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.954 34.5-134.2-170.0 153.4 33.4 24.7 18.6 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.453 75.0 111.1 -91.6 -6.4 32.7 26.8 15.5 36 36 A S S S- 0 0 45 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.373 72.6-131.5 -69.0 146.6 33.0 30.0 17.6 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.369 75.2 106.0 -81.3 5.0 36.1 32.1 16.8 38 38 A S > - 0 0 48 1,-0.2 4,-1.6 -13,-0.0 5,-0.1 -0.802 57.4-158.8 -96.5 127.1 36.9 32.4 20.4 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.863 97.3 52.1 -66.3 -37.3 39.8 30.6 21.9 40 40 A N H > S+ 0 0 119 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.922 106.0 54.6 -67.1 -38.1 38.3 30.8 25.3 41 41 A A H > S+ 0 0 32 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.886 110.1 47.5 -59.1 -36.2 35.1 29.5 24.0 42 42 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.873 110.4 51.9 -70.8 -39.1 37.1 26.5 22.7 43 43 A K H X S+ 0 0 58 -4,-2.7 4,-2.3 2,-0.2 11,-0.3 0.894 108.3 51.1 -65.7 -37.7 38.9 26.1 26.0 44 44 A S H X S+ 0 0 72 -4,-2.9 4,-2.3 -5,-0.2 5,-0.2 0.921 110.4 48.1 -66.0 -40.1 35.7 26.0 27.8 45 45 A E H X S+ 0 0 67 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.903 110.6 54.3 -66.8 -37.3 34.3 23.3 25.5 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.4 0.934 107.9 46.8 -63.9 -43.8 37.4 21.4 26.0 47 47 A D H X>S+ 0 0 35 -4,-2.3 4,-2.4 1,-0.2 5,-0.8 0.905 112.2 50.5 -65.3 -39.1 37.3 21.4 29.8 48 48 A K H <5S+ 0 0 144 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.847 111.4 48.8 -67.1 -32.6 33.7 20.4 29.8 49 49 A A H <5S+ 0 0 43 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.883 121.1 34.5 -74.3 -34.2 34.5 17.6 27.4 50 50 A I H <5S- 0 0 39 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.720 101.7-127.4 -90.5 -31.0 37.4 16.3 29.4 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 -5,-0.4 -3,-0.2 0.737 75.3 76.8 88.8 20.7 36.2 17.0 32.8 52 52 A R S - 0 0 9 -2,-1.0 3,-1.3 -11,-0.3 -1,-0.2 0.720 30.9-144.1 -89.8 -25.7 42.9 21.8 30.7 55 55 A N T 3 S- 0 0 129 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.850 73.9 -63.6 61.6 24.8 44.5 25.0 29.8 56 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-1.7 1,-0.2 2,-0.4 0.489 114.9 100.7 78.8 4.5 44.1 23.8 26.1 57 57 A V B < -C 16 0B 65 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.970 46.5-177.7-122.5 140.1 46.4 20.8 26.3 58 58 A I - 0 0 4 -43,-2.3 2,-0.2 -2,-0.4 -30,-0.1 -0.811 25.3-109.0-130.5 168.3 45.3 17.1 26.8 59 59 A T > - 0 0 64 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.478 31.4-107.4 -90.6 168.2 47.0 13.9 27.1 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.947 121.5 49.8 -59.0 -48.7 47.3 11.0 24.6 61 61 A D H > S+ 0 0 124 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.874 109.3 51.6 -56.9 -40.5 44.9 8.9 26.6 62 62 A E H > S+ 0 0 35 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.904 109.6 50.2 -65.3 -41.4 42.4 11.8 26.8 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -34,-0.4 0.915 110.7 50.1 -62.5 -41.6 42.6 12.2 23.0 64 64 A E H X S+ 0 0 79 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.818 107.1 54.4 -67.5 -30.3 42.0 8.5 22.5 65 65 A K H X S+ 0 0 136 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.932 109.3 46.5 -69.2 -43.5 39.0 8.6 24.8 66 66 A L H X S+ 0 0 3 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.906 112.2 53.5 -60.3 -40.5 37.4 11.5 22.8 67 67 A F H X S+ 0 0 13 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.938 106.4 50.6 -63.2 -45.9 38.2 9.5 19.7 68 68 A N H X S+ 0 0 89 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.928 112.8 46.2 -57.3 -44.2 36.5 6.4 21.0 69 69 A Q H X S+ 0 0 98 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.902 112.2 51.2 -66.7 -38.8 33.3 8.3 21.8 70 70 A D H X S+ 0 0 36 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.888 111.5 46.1 -65.2 -39.9 33.3 10.1 18.5 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.934 114.5 48.4 -67.6 -44.9 33.6 6.8 16.5 72 72 A D H X S+ 0 0 90 -4,-2.4 4,-2.9 -5,-0.3 5,-0.3 0.940 111.4 50.7 -62.0 -42.8 30.9 5.2 18.6 73 73 A A H X S+ 0 0 42 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.917 108.6 50.4 -62.0 -43.1 28.7 8.2 18.1 74 74 A A H X S+ 0 0 10 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.935 111.4 49.0 -61.4 -45.9 29.2 8.2 14.3 75 75 A V H X S+ 0 0 34 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.938 114.1 45.9 -59.2 -47.0 28.3 4.5 14.1 76 76 A R H X S+ 0 0 120 -4,-2.9 4,-1.4 -5,-0.2 -1,-0.2 0.913 109.0 54.5 -67.3 -33.4 25.3 5.0 16.2 77 77 A G H X S+ 0 0 4 -4,-2.6 4,-0.9 -5,-0.3 3,-0.2 0.924 108.3 49.8 -63.9 -40.2 24.2 8.1 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.2 7,-0.4 0.942 110.1 51.8 -59.9 -45.6 24.3 6.1 10.9 79 79 A L H 3< S+ 0 0 63 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.734 111.9 45.0 -69.0 -22.7 22.2 3.4 12.5 80 80 A R H 3< S+ 0 0 174 -4,-1.4 2,-0.5 -3,-0.2 -1,-0.3 0.556 92.0 96.6 -92.5 -15.3 19.6 5.7 13.6 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.6 -7,-0.2 3,-0.3 0.824 100.3 70.1 -86.3 -37.8 22.1 6.0 6.1 85 85 A K H X S+ 0 0 78 -4,-2.5 4,-3.0 -7,-0.4 5,-0.2 0.883 98.0 48.4 -48.1 -51.0 21.2 2.9 7.8 86 86 A P H > S+ 0 0 51 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.855 112.4 50.5 -64.2 -31.8 20.0 1.0 4.7 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-1.0 -3,-0.3 3,-0.4 0.968 112.1 46.1 -68.4 -50.4 23.2 2.0 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.6 3,-0.9 1,-0.3 -1,-0.2 0.922 110.9 53.3 -56.0 -45.1 25.4 0.8 5.7 89 89 A D H 3< S+ 0 0 77 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.824 107.9 51.9 -63.2 -31.6 23.4 -2.4 6.1 90 90 A S H 3< S+ 0 0 38 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.683 96.8 86.6 -79.7 -15.6 23.9 -3.1 2.5 91 91 A L S << S- 0 0 6 -4,-1.0 31,-0.0 -3,-0.9 2,-0.0 -0.489 74.1-116.7 -89.0 158.4 27.7 -2.6 2.4 92 92 A D > - 0 0 55 -2,-0.1 4,-1.9 1,-0.0 5,-0.2 -0.204 44.2 -89.0 -77.0 175.2 30.7 -5.0 3.1 93 93 A A H > S+ 0 0 80 1,-0.2 4,-1.6 2,-0.2 -2,-0.1 0.875 122.5 46.0 -56.0 -49.1 33.2 -4.4 6.0 94 94 A V H > S+ 0 0 25 62,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.925 114.0 47.3 -63.8 -48.2 35.7 -2.2 4.3 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.839 104.2 61.0 -64.3 -31.7 33.1 0.0 2.7 96 96 A R H X S+ 0 0 83 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.929 102.9 53.8 -58.7 -41.5 31.2 0.5 6.0 97 97 A A H X S+ 0 0 6 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.880 103.9 54.0 -60.3 -41.3 34.4 2.0 7.3 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.888 109.4 49.2 -60.7 -38.8 34.5 4.5 4.4 99 99 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.913 109.0 51.5 -68.3 -38.8 30.9 5.6 5.3 100 100 A I H X S+ 0 0 8 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.949 106.8 55.0 -62.6 -39.8 31.8 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.952 108.4 48.6 -57.9 -46.8 34.8 8.1 7.9 102 102 A M H X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 5,-0.4 0.911 111.8 47.6 -61.2 -45.0 32.6 10.5 5.9 103 103 A V H X S+ 0 0 9 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.911 109.9 53.9 -65.7 -35.7 30.1 10.8 8.8 104 104 A F H < S+ 0 0 30 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.923 116.5 38.9 -61.9 -42.4 32.9 11.5 11.3 105 105 A Q H < S+ 0 0 59 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.945 134.4 16.7 -71.5 -52.8 34.2 14.3 9.0 106 106 A M H X S- 0 0 56 -4,-2.9 4,-0.5 -5,-0.2 -3,-0.2 0.460 103.3-116.6-106.3 -4.9 30.9 15.9 7.8 107 107 A G H X - 0 0 31 -4,-2.2 4,-2.2 -5,-0.4 5,-0.2 0.178 33.8 -78.8 82.0 155.7 28.2 14.7 10.1 108 108 A E H > S+ 0 0 55 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.853 127.5 52.1 -60.1 -42.5 25.3 12.6 9.4 109 109 A T H > S+ 0 0 120 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.939 109.3 52.6 -62.4 -41.9 23.1 15.2 8.0 110 110 A G H >< S+ 0 0 31 -4,-0.5 3,-0.7 1,-0.2 -2,-0.2 0.950 113.7 40.7 -57.9 -50.6 25.9 16.2 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.2 3,-2.3 1,-0.2 -1,-0.2 0.882 106.5 63.4 -67.2 -35.1 26.4 12.7 4.3 112 112 A A H 3< S+ 0 0 10 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.788 92.6 68.3 -61.1 -21.2 22.6 12.1 4.2 113 113 A G T << S+ 0 0 56 -4,-1.1 2,-1.5 -3,-0.7 -1,-0.3 0.600 75.4 86.0 -74.8 -5.1 22.6 14.9 1.6 114 114 A F <> + 0 0 40 -3,-2.3 4,-2.7 1,-0.2 5,-0.3 -0.338 54.5 159.4 -91.6 59.2 24.5 12.7 -1.0 115 115 A T H > + 0 0 99 -2,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.869 67.0 44.3 -50.6 -52.2 21.4 11.2 -2.2 116 116 A A H > S+ 0 0 25 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.892 114.5 47.7 -62.0 -46.5 22.6 10.0 -5.6 117 117 A S H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.874 111.1 53.5 -61.6 -40.6 25.9 8.6 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.915 110.5 46.0 -62.7 -41.9 24.0 6.8 -1.5 119 119 A R H X S+ 0 0 134 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.2 0.925 112.3 50.9 -69.1 -36.8 21.7 5.2 -3.9 120 120 A M H <>S+ 0 0 21 -4,-2.1 5,-2.2 2,-0.2 4,-0.4 0.885 110.8 48.9 -67.8 -39.6 24.6 4.3 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-3.0 3,-1.6 1,-0.2 -1,-0.2 0.931 108.2 53.2 -65.4 -42.3 26.4 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 93 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.891 109.4 49.8 -59.9 -33.4 23.4 0.8 -2.3 123 123 A Q T 3<5S- 0 0 95 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.523 113.0-121.3 -81.4 -3.8 23.1 -0.5 -5.8 124 124 A K T < 5 + 0 0 99 -3,-1.6 2,-1.1 -4,-0.4 -3,-0.2 0.815 62.9 146.0 64.5 35.8 26.8 -1.5 -5.8 125 125 A R >< + 0 0 113 -5,-2.2 4,-2.6 1,-0.2 5,-0.2 -0.687 21.1 173.5-100.3 73.8 27.6 0.7 -8.8 126 126 A W H > S+ 0 0 49 -2,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.876 70.0 45.0 -55.4 -47.8 31.1 1.5 -7.5 127 127 A D H > S+ 0 0 112 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.907 114.2 49.6 -68.6 -38.4 32.5 3.4 -10.4 128 128 A E H > S+ 0 0 111 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.921 111.3 49.0 -65.0 -44.2 29.4 5.5 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 -2,-0.2 0.923 107.4 56.2 -62.2 -42.6 29.3 6.4 -7.1 130 130 A A H X S+ 0 0 10 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.881 108.4 46.3 -58.1 -39.3 32.9 7.4 -7.1 131 131 A V H X S+ 0 0 88 -4,-1.6 4,-0.6 1,-0.2 -1,-0.2 0.904 114.6 47.1 -71.8 -38.0 32.4 9.9 -9.8 132 132 A N H >< S+ 0 0 46 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.887 107.0 57.4 -68.1 -37.6 29.4 11.3 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.2 6,-0.3 1,-0.2 -1,-0.2 0.847 100.5 59.1 -60.5 -34.6 31.1 11.5 -4.9 134 134 A A H 3< S+ 0 0 27 -4,-1.3 2,-1.8 -5,-0.2 -1,-0.2 0.645 84.3 82.5 -71.4 -15.0 33.8 13.7 -6.5 135 135 A K S << S+ 0 0 159 -3,-1.2 2,-0.3 -4,-0.6 -1,-0.2 -0.545 79.7 96.7 -88.5 73.5 31.3 16.4 -7.5 136 136 A S S > S- 0 0 16 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.998 84.7-117.1-158.8 154.0 31.3 18.0 -4.2 137 137 A R H > S+ 0 0 147 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.905 114.8 62.4 -55.4 -43.5 32.6 20.7 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.945 106.3 42.1 -49.0 -52.8 34.0 17.9 0.1 139 139 A Y H 4 S+ 0 0 61 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.888 114.5 51.5 -67.7 -35.9 36.2 16.6 -2.6 140 140 A N H < S+ 0 0 108 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.817 115.4 40.2 -71.2 -30.2 37.3 20.1 -3.8 141 141 A Q H < S+ 0 0 107 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.827 131.7 21.8 -87.8 -35.0 38.3 21.3 -0.3 142 142 A T S X S+ 0 0 21 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 -0.522 73.9 159.5-129.2 69.9 40.0 18.2 1.0 143 143 A P H > + 0 0 50 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.825 68.1 53.3 -65.4 -37.7 40.9 16.3 -2.1 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.936 115.4 39.7 -67.9 -42.1 43.5 14.0 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.926 115.3 53.0 -66.5 -45.3 41.4 12.6 2.0 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-3.4 1,-0.2 5,-0.2 0.922 107.8 52.4 -52.8 -47.8 38.3 12.5 -0.3 147 147 A K H X S+ 0 0 104 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.879 107.5 51.7 -60.1 -38.2 40.3 10.5 -2.8 148 148 A R H X S+ 0 0 68 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.936 114.3 42.3 -64.9 -43.6 41.4 8.0 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.920 113.8 51.4 -68.2 -43.7 37.7 7.5 0.9 150 150 A I H X S+ 0 0 14 -4,-3.4 4,-2.2 1,-0.2 -1,-0.2 0.897 108.1 52.2 -60.0 -40.1 36.5 7.4 -2.6 151 151 A T H X S+ 0 0 36 -4,-2.4 4,-2.4 -5,-0.2 5,-0.4 0.838 106.4 55.5 -62.0 -36.5 39.1 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.893 110.5 43.4 -67.6 -39.7 37.9 2.7 -0.6 153 153 A F H < S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.906 115.2 50.1 -72.4 -35.6 34.3 2.7 -1.8 154 154 A R H < S+ 0 0 101 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.924 126.3 22.0 -64.9 -45.4 35.4 2.0 -5.4 155 155 A T H < S- 0 0 47 -4,-2.4 -3,-0.2 2,-0.2 -2,-0.2 0.680 86.6-137.0 -95.7 -31.9 37.6 -0.9 -4.6 156 156 A G S < S+ 0 0 15 -4,-2.0 2,-0.3 -5,-0.4 -62,-0.2 0.726 71.8 98.9 76.4 19.4 36.5 -2.3 -1.3 157 157 A T S S- 0 0 49 -6,-0.3 3,-0.3 -5,-0.1 -1,-0.3 -0.777 81.6-117.2-128.5 172.7 40.1 -2.7 -0.1 158 158 A W S >> S+ 0 0 40 -2,-0.3 3,-2.9 1,-0.2 4,-0.5 0.213 71.4 123.7 -96.4 13.6 42.3 -0.6 2.0 159 159 A D G >4 + 0 0 98 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.799 64.6 61.1 -45.2 -37.4 44.8 0.1 -0.7 160 160 A A G 34 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.676 107.0 48.4 -68.1 -15.0 44.6 3.8 -0.4 161 161 A Y G <4 0 0 19 -3,-2.9 -1,-0.2 -13,-0.1 -2,-0.2 0.499 360.0 360.0-104.2 -4.5 45.8 3.6 3.1 162 162 A K << 0 0 184 -3,-1.0 -2,-0.1 -4,-0.5 -3,-0.1 0.809 360.0 360.0-102.0 360.0 48.9 1.2 2.8