==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-NOV-05 2F32 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.S.YOUSEF,N.BISCHOFF,C.M.DYER,W.A.BAASE,B.W.MATTHEWS . 175 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9686.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 71.4 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 . 13 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 1.1 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 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 52.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 0 1 2 1 0 0 0 1 1 0 0 0 0 1 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 0 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 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 59 0, 0.0 2,-0.3 0, 0.0 168,-0.0 0.000 360.0 360.0 360.0 147.3 40.3 -38.5 -40.9 2 2 A N > - 0 0 68 167,-0.0 4,-2.6 106,-0.0 5,-0.2 -0.904 360.0 -79.8-156.8 176.0 41.3 -35.2 -42.6 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.829 126.2 52.0 -58.2 -33.6 39.6 -31.9 -43.2 4 4 A F H > S+ 0 0 77 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.962 113.2 42.4 -67.9 -49.6 37.6 -33.1 -46.1 5 5 A E H > S+ 0 0 100 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.865 114.6 53.5 -63.9 -37.2 36.2 -36.1 -44.3 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.951 112.7 40.9 -63.5 -50.7 35.6 -34.0 -41.2 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.4 0.834 108.9 61.2 -69.4 -28.5 33.6 -31.3 -43.0 8 8 A R H X S+ 0 0 104 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.924 107.8 45.6 -63.1 -39.4 31.8 -33.9 -45.0 9 9 A I H < S+ 0 0 48 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.948 117.2 42.7 -66.1 -48.0 30.5 -35.3 -41.7 10 10 A D H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.791 123.4 35.0 -70.9 -30.5 29.6 -31.8 -40.3 11 11 A E H < S- 0 0 35 -4,-2.8 19,-0.4 -5,-0.2 -1,-0.2 0.691 93.3-155.2 -97.0 -24.0 28.0 -30.4 -43.4 12 12 A G < - 0 0 23 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.199 24.0 -86.7 75.1-174.0 26.4 -33.5 -44.9 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.943 44.3 170.3-140.5 115.5 25.6 -33.9 -48.6 14 14 A R E -A 28 0A 138 14,-2.0 14,-2.5 -2,-0.4 4,-0.1 -0.991 19.9-161.8-128.7 134.4 22.4 -32.6 -50.2 15 15 A L E S+ 0 0 70 -2,-0.4 54,-2.4 12,-0.2 2,-0.3 0.466 75.0 58.4 -94.9 -1.3 21.9 -32.5 -54.0 16 16 A K E S-C 68 0B 150 52,-0.2 52,-0.2 12,-0.1 12,-0.1 -0.925 99.3 -88.7-126.7 148.6 19.0 -30.1 -54.0 17 17 A I E + 0 0 27 50,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.298 54.0 168.9 -56.5 137.2 18.9 -26.6 -52.6 18 18 A Y E -A 26 0A 32 8,-2.7 8,-3.3 -4,-0.1 2,-0.5 -0.887 35.6-107.6-142.9 171.8 17.8 -26.5 -48.9 19 19 A K E -A 25 0A 103 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.920 30.0-148.0-108.8 125.6 17.8 -23.9 -46.1 20 20 A D > - 0 0 43 4,-2.6 3,-2.0 -2,-0.5 4,-0.1 -0.261 38.0 -89.1 -82.8 177.5 20.3 -24.2 -43.3 21 21 A T T 3 S+ 0 0 105 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.778 126.0 57.8 -60.9 -25.7 19.6 -23.2 -39.7 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.309 122.4-102.9 -86.1 10.7 20.8 -19.7 -40.3 23 23 A G S < S+ 0 0 14 -3,-2.0 13,-2.9 1,-0.2 2,-0.5 0.688 75.0 141.3 79.0 18.5 18.3 -19.2 -43.1 24 24 A Y E - B 0 35A 74 11,-0.2 -4,-2.6 -4,-0.1 2,-0.3 -0.823 56.3-124.9 -99.6 133.1 20.7 -19.6 -45.9 25 25 A Y E +AB 19 34A 20 9,-2.7 8,-3.1 -2,-0.5 9,-0.9 -0.579 47.1 171.8 -68.4 132.4 19.8 -21.4 -49.1 26 26 A T E -AB 18 32A 2 -8,-3.3 -8,-2.7 -2,-0.3 2,-0.3 -0.900 16.9-176.5-141.5 161.9 22.6 -24.0 -49.3 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.3 -2,-0.3 2,-0.2 -0.974 50.3 8.7-157.3 164.1 23.5 -27.0 -51.4 28 28 A G E 4 S-A 14 0A 1 -14,-2.5 -14,-2.0 -2,-0.3 2,-0.8 -0.421 123.4 -10.8 70.1-127.0 26.1 -29.8 -51.7 29 29 A I T 4 S- 0 0 5 45,-0.4 -1,-0.2 -2,-0.2 -17,-0.1 -0.727 128.2 -49.1-109.7 77.8 28.5 -30.0 -48.8 30 30 A G T 4 S+ 0 0 8 -2,-0.8 2,-0.9 -19,-0.4 -2,-0.2 0.756 84.0 161.6 69.0 23.6 27.8 -26.8 -47.0 31 31 A H E < -B 27 0A 30 -4,-2.3 -4,-1.8 -20,-0.1 -1,-0.2 -0.698 30.8-144.7 -82.2 109.8 28.0 -24.6 -50.1 32 32 A L E +B 26 0A 74 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.497 24.7 172.7 -74.0 135.4 26.2 -21.3 -49.1 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.820 53.1 -38.6-106.2 -64.8 24.2 -19.6 -51.9 34 34 A T E -B 25 0A 30 -9,-0.9 -9,-2.7 -11,-0.0 -1,-0.4 -0.956 61.2 -87.1-157.2 168.4 22.1 -16.7 -50.6 35 35 A K E -B 24 0A 137 -2,-0.3 -11,-0.2 -11,-0.2 -12,-0.1 -0.672 39.3-136.3 -85.6 140.0 20.0 -15.6 -47.6 36 36 A S - 0 0 19 -13,-2.9 3,-0.1 -2,-0.3 10,-0.1 -0.510 20.7-111.7 -90.4 162.9 16.3 -16.5 -47.6 37 37 A P - 0 0 35 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.061 50.0 -62.7 -77.7-165.1 13.5 -14.0 -46.6 38 38 A S - 0 0 72 1,-0.1 8,-0.0 4,-0.0 -15,-0.0 -0.419 45.1-110.9 -80.1 157.0 11.3 -14.2 -43.5 39 39 A I S S+ 0 0 149 1,-0.2 -1,-0.1 -2,-0.1 7,-0.0 0.795 125.5 35.3 -56.8 -22.8 8.9 -17.2 -43.0 40 40 A N S S+ 0 0 135 6,-0.0 -1,-0.2 3,-0.0 6,-0.1 0.918 82.7 122.7 -92.2 -63.5 6.3 -14.4 -43.7 41 41 A A S S- 0 0 17 4,-0.1 5,-0.3 2,-0.1 0, 0.0 0.421 80.9 -64.6 -6.6 116.5 8.0 -12.2 -46.3 42 42 A A > - 0 0 46 3,-0.1 4,-2.1 1,-0.1 5,-0.1 0.575 37.8-113.6 -10.5 150.5 5.6 -12.0 -49.3 43 43 A K H > S+ 0 0 179 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.829 120.7 49.0 -61.9 -32.9 4.6 -14.9 -51.5 44 44 A S H >> S+ 0 0 56 2,-0.2 4,-2.0 1,-0.2 3,-0.6 0.974 105.8 52.7 -70.7 -58.9 6.5 -13.0 -54.2 45 45 A E H 3> S+ 0 0 95 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.862 104.3 60.3 -43.5 -45.6 9.7 -12.3 -52.3 46 46 A L H 3X S+ 0 0 80 -4,-2.1 4,-1.8 -5,-0.3 -1,-0.2 0.928 107.6 42.3 -50.3 -54.1 9.9 -16.0 -51.6 47 47 A D H S+ 0 0 41 -4,-2.7 4,-2.8 1,-0.2 5,-1.4 0.879 111.5 50.4 -59.8 -40.8 24.1 -21.9 -61.9 59 59 A K H <5S+ 0 0 142 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.874 111.5 48.1 -65.4 -36.7 26.9 -19.3 -61.9 60 60 A A H <5S+ 0 0 40 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.883 121.4 35.5 -72.1 -38.6 29.0 -21.4 -59.5 61 61 A I H <5S- 0 0 37 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.732 101.3-130.0 -86.5 -28.0 28.5 -24.6 -61.6 62 62 A G T <5S+ 0 0 66 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.827 74.9 85.0 79.6 31.8 28.5 -22.9 -65.0 63 63 A A S - 0 0 18 -2,-1.3 3,-1.5 -11,-0.2 -1,-0.2 0.692 35.2-148.1 -91.5 -19.1 20.9 -26.6 -62.8 66 66 A N T 3 S- 0 0 106 1,-0.2 3,-0.1 -12,-0.1 -12,-0.1 0.784 75.5 -54.3 50.2 30.5 17.5 -25.6 -61.7 67 67 A G T 3 S+ 0 0 3 -13,-0.2 -50,-1.6 1,-0.2 2,-0.4 0.593 117.6 102.0 87.6 10.3 18.6 -26.2 -58.1 68 68 A V B < +C 16 0B 86 -3,-1.5 2,-0.3 -52,-0.2 -52,-0.2 -0.997 42.5 174.5-131.9 131.3 19.8 -29.8 -58.5 69 69 A I - 0 0 5 -54,-2.4 2,-0.2 -2,-0.4 -41,-0.1 -0.826 28.0-109.9-129.6 168.1 23.4 -30.9 -58.8 70 70 A T > - 0 0 73 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.486 32.7-107.7 -93.7 168.0 25.3 -34.2 -59.0 71 71 A K H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.929 121.4 53.4 -59.9 -45.4 27.5 -35.7 -56.3 72 72 A D H > S+ 0 0 124 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.868 109.5 48.7 -57.7 -37.9 30.6 -34.9 -58.5 73 73 A E H > S+ 0 0 59 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.908 109.1 52.1 -69.3 -41.6 29.5 -31.2 -58.7 74 74 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -45,-0.4 0.915 110.5 49.0 -60.2 -42.7 28.9 -31.0 -55.0 75 75 A E H X S+ 0 0 79 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.844 108.6 53.5 -66.9 -31.3 32.5 -32.3 -54.4 76 76 A K H X S+ 0 0 131 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.950 110.7 45.3 -67.9 -48.2 33.9 -29.8 -56.9 77 77 A L H X S+ 0 0 2 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.903 112.8 53.9 -59.8 -37.5 32.2 -26.9 -55.1 78 78 A F H X S+ 0 0 13 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.938 106.1 49.6 -63.0 -47.5 33.5 -28.5 -51.8 79 79 A N H X S+ 0 0 85 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.927 113.5 47.5 -58.0 -45.5 37.1 -28.6 -53.0 80 80 A Q H X S+ 0 0 97 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.928 113.1 48.8 -60.4 -44.9 36.9 -25.0 -54.0 81 81 A D H X S+ 0 0 36 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.856 110.6 48.5 -67.0 -37.1 35.3 -24.0 -50.8 82 82 A V H X S+ 0 0 5 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.961 112.9 49.2 -67.6 -46.5 37.9 -25.8 -48.6 83 83 A D H X S+ 0 0 105 -4,-2.3 4,-2.9 -5,-0.3 -2,-0.2 0.912 111.2 50.1 -57.6 -41.9 40.7 -24.2 -50.5 84 84 A A H X S+ 0 0 53 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.879 108.3 52.5 -62.8 -39.9 39.1 -20.9 -50.1 85 85 A A H X S+ 0 0 8 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.932 113.7 42.5 -63.2 -46.8 38.7 -21.3 -46.4 86 86 A V H X S+ 0 0 33 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.933 113.0 53.4 -65.3 -47.0 42.4 -22.2 -46.0 87 87 A R H X S+ 0 0 168 -4,-2.9 4,-1.5 -5,-0.3 -2,-0.2 0.915 109.2 50.4 -53.9 -44.0 43.5 -19.4 -48.3 88 88 A G H X S+ 0 0 4 -4,-2.5 4,-0.9 2,-0.2 -1,-0.2 0.907 106.9 52.2 -62.9 -44.0 41.5 -17.0 -46.2 89 89 A I H >< S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.2 7,-0.4 0.956 109.6 51.0 -55.9 -49.2 43.0 -18.1 -43.0 90 90 A L H 3< S+ 0 0 78 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.792 111.5 47.1 -61.9 -28.2 46.5 -17.5 -44.5 91 91 A R H 3< S+ 0 0 171 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.3 0.529 93.4 92.8 -90.4 -6.5 45.6 -14.0 -45.7 92 92 A N S+ 0 0 127 2,-0.1 4,-0.7 3,-0.1 -1,-0.2 0.822 118.2 41.4 -91.8 -36.1 44.6 -12.6 -36.9 95 95 A L H > S+ 0 0 0 -6,-0.2 4,-2.9 -7,-0.2 5,-0.3 0.845 102.2 66.7 -82.0 -34.7 44.0 -16.2 -38.0 96 96 A K H X S+ 0 0 94 -4,-2.7 4,-3.2 -7,-0.4 5,-0.3 0.926 100.2 48.2 -56.6 -48.2 47.4 -16.9 -39.7 97 97 A P H > S+ 0 0 57 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.890 115.0 46.1 -60.7 -38.1 49.5 -16.8 -36.6 98 98 A V H X S+ 0 0 4 -4,-0.7 4,-1.1 2,-0.2 3,-0.3 0.966 113.7 48.8 -66.5 -49.9 47.1 -19.0 -34.7 99 99 A Y H >< S+ 0 0 33 -4,-2.9 3,-0.9 1,-0.3 -1,-0.2 0.918 111.3 49.7 -52.9 -49.6 46.9 -21.5 -37.6 100 100 A D H 3< S+ 0 0 77 -4,-3.2 -1,-0.3 -5,-0.3 -2,-0.2 0.817 107.6 55.4 -64.2 -26.6 50.7 -21.6 -38.0 101 101 A S H 3< S+ 0 0 31 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.730 96.6 86.5 -77.1 -19.9 51.0 -22.3 -34.3 102 102 A L S << S- 0 0 6 -4,-1.1 2,-0.1 -3,-0.9 31,-0.0 -0.411 77.2-117.1 -86.6 156.6 48.7 -25.3 -34.3 103 103 A D > - 0 0 58 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.327 45.2 -92.2 -76.8 172.3 49.3 -29.0 -35.1 104 104 A A H > S+ 0 0 80 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.804 123.1 48.7 -57.8 -39.1 47.6 -30.6 -38.1 105 105 A V H > S+ 0 0 25 62,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.930 113.5 45.8 -71.5 -44.2 44.5 -31.9 -36.3 106 106 A R H > S+ 0 0 24 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.859 107.1 59.8 -68.3 -29.7 43.8 -28.6 -34.6 107 107 A R H X S+ 0 0 82 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.911 103.4 52.5 -61.5 -38.8 44.4 -26.7 -37.9 108 108 A A H X S+ 0 0 5 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.871 105.0 54.9 -63.6 -39.2 41.5 -28.8 -39.3 109 109 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.918 109.7 46.4 -61.3 -42.3 39.3 -27.6 -36.5 110 110 A L H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.918 111.2 51.0 -69.0 -38.2 40.1 -24.0 -37.3 111 111 A I H X S+ 0 0 7 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.936 107.7 55.5 -61.7 -39.6 39.5 -24.6 -41.0 112 112 A N H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.929 108.2 47.2 -57.6 -48.3 36.1 -26.2 -40.0 113 113 A M H X S+ 0 0 2 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.927 112.7 48.5 -61.1 -44.1 35.1 -23.1 -38.1 114 114 A V H X S+ 0 0 7 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.875 109.0 53.9 -64.3 -36.8 36.1 -20.8 -40.9 115 115 A F H < S+ 0 0 27 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.902 115.8 40.0 -62.3 -42.7 34.2 -22.9 -43.4 116 116 A Q H < S+ 0 0 45 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.932 132.8 18.1 -73.9 -46.0 31.1 -22.6 -41.3 117 117 A M H < S- 0 0 56 -4,-2.9 4,-0.4 -5,-0.2 -3,-0.2 0.421 104.3-114.1-110.0 -1.7 31.2 -19.0 -40.2 118 118 A G X - 0 0 31 -4,-2.3 4,-2.0 -5,-0.3 5,-0.2 0.225 35.4 -76.5 80.9 151.7 33.6 -17.3 -42.6 119 119 A E H > S+ 0 0 37 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.884 127.3 47.8 -51.1 -53.4 37.0 -15.7 -41.9 120 120 A T H > S+ 0 0 121 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.875 109.6 55.5 -64.4 -32.3 35.8 -12.5 -40.3 121 121 A G H >4 S+ 0 0 31 -4,-0.4 3,-0.6 -3,-0.2 -1,-0.2 0.940 112.6 39.9 -63.0 -47.1 33.5 -14.3 -38.0 122 122 A V H >< S+ 0 0 1 -4,-2.0 3,-2.4 1,-0.2 -2,-0.2 0.880 107.3 62.4 -71.4 -35.1 36.2 -16.6 -36.6 123 123 A A H 3< S+ 0 0 7 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.724 95.4 66.6 -62.7 -17.9 38.8 -13.8 -36.5 124 124 A G T << S+ 0 0 49 -4,-0.7 2,-2.3 -3,-0.6 -1,-0.3 0.616 73.0 86.9 -78.4 -13.9 36.3 -12.3 -34.0 125 125 A F <> + 0 0 38 -3,-2.4 4,-2.7 1,-0.2 5,-0.3 -0.376 57.1 161.2 -81.8 61.7 36.9 -15.0 -31.4 126 126 A T H > + 0 0 73 -2,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.868 65.7 43.7 -52.5 -48.0 39.7 -12.9 -30.1 127 127 A N H > S+ 0 0 81 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.911 114.9 48.4 -69.8 -41.7 40.1 -14.4 -26.6 128 128 A S H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.931 109.3 53.7 -63.6 -43.3 39.7 -18.1 -27.8 129 129 A L H X S+ 0 0 12 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.922 109.4 49.1 -59.2 -41.6 42.3 -17.5 -30.6 130 130 A R H X S+ 0 0 109 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.932 110.5 49.2 -62.5 -45.8 44.7 -16.2 -28.0 131 131 A M H <>S+ 0 0 27 -4,-2.3 5,-2.6 1,-0.2 4,-0.3 0.901 111.1 51.1 -61.7 -38.5 44.1 -19.2 -25.7 132 132 A L H ><5S+ 0 0 2 -4,-2.8 3,-1.5 1,-0.2 -2,-0.2 0.935 108.8 50.4 -62.5 -45.3 44.7 -21.6 -28.7 133 133 A Q H 3<5S+ 0 0 90 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.812 111.3 49.2 -61.9 -29.9 47.9 -19.8 -29.5 134 134 A Q T 3<5S- 0 0 93 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.433 113.1-122.6 -86.9 -2.6 49.0 -20.3 -25.9 135 135 A K T < 5 + 0 0 102 -3,-1.5 2,-1.4 -4,-0.3 -3,-0.2 0.817 62.0 147.6 61.4 35.1 48.0 -23.9 -26.0 136 136 A R >< + 0 0 117 -5,-2.6 4,-2.5 1,-0.2 5,-0.2 -0.610 19.8 172.2 -95.8 70.2 45.6 -23.5 -23.1 137 137 A W H > + 0 0 49 -2,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.880 68.1 45.9 -52.2 -51.9 43.3 -26.1 -24.6 138 138 A D H > S+ 0 0 94 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.920 114.9 47.8 -63.7 -41.8 40.7 -26.5 -21.8 139 139 A E H > S+ 0 0 94 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.903 111.6 50.7 -63.9 -41.2 40.4 -22.7 -21.3 140 140 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.919 109.3 51.8 -62.2 -41.6 40.0 -22.3 -25.1 141 141 A A H X S+ 0 0 10 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.911 110.4 47.8 -60.5 -44.4 37.3 -25.0 -25.1 142 142 A V H < S+ 0 0 87 -4,-2.3 4,-0.5 1,-0.2 3,-0.2 0.933 114.7 46.2 -64.0 -43.8 35.4 -23.3 -22.3 143 143 A N H >< S+ 0 0 43 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.890 107.0 57.2 -66.3 -40.6 35.6 -19.9 -24.0 144 144 A L H 3< S+ 0 0 2 -4,-2.9 6,-0.4 1,-0.2 -1,-0.2 0.822 101.0 58.5 -60.3 -32.2 34.6 -21.2 -27.4 145 145 A A T 3< S+ 0 0 29 -4,-1.3 2,-1.8 -3,-0.2 -1,-0.2 0.659 85.1 80.5 -74.2 -15.0 31.3 -22.6 -26.0 146 146 A K S < S+ 0 0 158 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.538 81.4 98.6 -90.2 68.8 30.2 -19.2 -24.8 147 147 A S S > S- 0 0 16 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.991 84.7-119.2-153.2 158.0 29.0 -18.2 -28.2 148 148 A R H > S+ 0 0 150 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.881 115.4 64.1 -62.7 -37.0 26.0 -18.0 -30.5 149 149 A W H > S+ 0 0 16 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.951 106.3 40.3 -48.1 -56.4 27.9 -20.5 -32.6 150 150 A Y H 4 S+ 0 0 66 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.924 114.1 51.9 -64.3 -44.6 27.7 -23.1 -29.9 151 151 A N H < S+ 0 0 117 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.847 113.8 44.9 -62.9 -33.1 24.1 -22.4 -28.9 152 152 A Q H < S+ 0 0 75 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.831 132.4 15.6 -80.3 -37.8 22.9 -22.7 -32.5 153 153 A T S X S+ 0 0 34 -4,-2.1 4,-2.8 -5,-0.3 -1,-0.2 -0.511 74.9 160.7-135.7 69.6 24.8 -25.9 -33.6 154 154 A P H > S+ 0 0 50 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.833 70.6 52.6 -61.6 -39.8 25.9 -27.4 -30.3 155 155 A N H > S+ 0 0 117 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.938 116.5 40.0 -65.9 -42.4 26.5 -31.0 -31.4 156 156 A R H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.932 115.8 51.4 -68.8 -45.1 28.8 -29.8 -34.2 157 157 A A H X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.2 5,-0.3 0.913 107.1 54.6 -57.4 -42.4 30.4 -27.1 -32.1 158 158 A K H X S+ 0 0 90 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.870 107.6 49.4 -61.6 -35.6 31.1 -29.8 -29.4 159 159 A R H X S+ 0 0 55 -4,-1.4 4,-1.6 -3,-0.3 12,-0.2 0.923 114.2 44.9 -69.0 -42.9 33.0 -31.9 -31.9 160 160 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 5,-0.2 0.941 114.5 48.4 -65.7 -45.8 35.1 -29.0 -33.1 161 161 A I H X S+ 0 0 14 -4,-3.2 4,-2.6 1,-0.2 -1,-0.2 0.896 109.8 52.5 -61.4 -39.5 35.8 -27.9 -29.6 162 162 A T H X S+ 0 0 45 -4,-2.3 4,-2.7 -5,-0.3 6,-0.4 0.863 106.7 54.1 -64.5 -33.2 36.7 -31.4 -28.5 163 163 A T H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.905 110.8 44.5 -68.3 -39.7 39.1 -31.5 -31.5 164 164 A F H < S+ 0 0 1 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.877 114.3 52.2 -69.2 -37.4 40.8 -28.3 -30.2 165 165 A R H < S+ 0 0 135 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.935 124.6 21.5 -66.1 -44.3 40.8 -29.7 -26.7 166 166 A T H < S- 0 0 63 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.671 85.5-133.7 -99.7 -23.5 42.4 -33.0 -27.4 167 167 A G S < S+ 0 0 17 -4,-2.3 2,-0.3 -5,-0.3 -62,-0.2 0.706 74.8 104.4 73.5 15.1 44.3 -32.6 -30.7 168 168 A T S S- 0 0 50 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.794 80.9-120.7-123.2 167.7 42.8 -36.0 -31.8 169 169 A W S > S+ 0 0 41 -2,-0.3 3,-2.1 1,-0.2 4,-0.4 0.132 71.5 123.0 -92.6 18.3 40.0 -37.1 -34.1 170 170 A D G > + 0 0 118 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.805 65.7 58.3 -47.6 -40.3 38.1 -38.7 -31.3 171 171 A A G 3 S+ 0 0 24 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.648 108.6 47.0 -69.5 -13.1 34.9 -36.7 -31.8 172 172 A Y G X S+ 0 0 2 -3,-2.1 3,-1.2 -13,-0.1 2,-0.4 0.342 82.3 111.3-111.2 4.6 34.6 -37.9 -35.4 173 173 A K T < S+ 0 0 99 -3,-1.0 -3,-0.0 -4,-0.4 0, 0.0 -0.681 84.2 21.8 -84.6 133.0 35.2 -41.7 -34.9 174 174 A N T 3 0 0 173 -2,-0.4 -1,-0.3 0, 0.0 -4,-0.0 0.549 360.0 360.0 85.6 11.7 32.1 -43.8 -35.6 175 175 A L < 0 0 115 -3,-1.2 -2,-0.2 0, 0.0 -3,-0.1 0.617 360.0 360.0-122.1 360.0 30.8 -40.9 -37.6