==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JUL-06 2HUK . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR D.R.BANATAO,D.CASCIO,T.O.YEATES . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8902.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.0 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 7.3 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 . 13 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 51.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 2 0 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 0 105 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 164.7 -17.1 23.4 12.0 2 2 A N > - 0 0 72 156,-0.1 4,-1.9 1,-0.1 3,-0.2 -0.971 360.0 -90.1-161.3 173.1 -20.0 21.2 12.9 3 3 A I H > S+ 0 0 34 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.807 118.3 58.1 -65.9 -32.9 -21.6 17.8 12.3 4 4 A F H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.944 110.1 43.5 -61.2 -47.6 -23.7 18.9 9.3 5 5 A E H > S+ 0 0 58 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.875 112.5 54.5 -65.6 -38.3 -20.6 20.1 7.4 6 6 A M H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.921 114.0 39.5 -57.9 -50.3 -18.7 16.9 8.5 7 7 A L H X>S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-1.1 0.864 109.6 59.8 -75.8 -29.7 -21.5 14.6 7.1 8 8 A R H X5S+ 0 0 98 -4,-2.6 4,-0.7 -5,-0.3 -1,-0.2 0.920 113.4 39.4 -57.2 -42.0 -21.9 16.8 4.1 9 9 A I H <5S+ 0 0 53 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.912 123.4 38.9 -69.3 -47.4 -18.2 16.1 3.3 10 10 A D H <5S+ 0 0 18 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.802 132.4 21.5 -79.7 -30.2 -18.2 12.4 4.3 11 11 A E H <5S- 0 0 44 -4,-2.7 -3,-0.2 -5,-0.2 19,-0.2 0.681 102.6-122.5-114.0 -26.6 -21.5 11.3 3.0 12 12 A G << - 0 0 15 -5,-1.1 2,-0.4 -4,-0.7 -3,-0.1 -0.150 11.1-115.0 99.8 155.7 -22.5 13.8 0.3 13 13 A L - 0 0 37 16,-0.1 2,-0.4 -5,-0.1 16,-0.2 -0.958 26.4-174.1-134.3 118.4 -25.5 16.1 -0.1 14 14 A R E -A 28 0A 129 14,-2.2 14,-2.6 -2,-0.4 4,-0.1 -0.925 14.1-164.1-114.5 137.1 -28.0 15.6 -3.0 15 15 A L E S+ 0 0 79 -2,-0.4 43,-2.6 12,-0.2 2,-0.4 0.497 74.6 61.2 -96.0 -5.8 -30.8 18.1 -3.6 16 16 A K E S-C 57 0B 140 41,-0.2 41,-0.2 12,-0.1 40,-0.1 -0.960 96.9 -95.7-126.3 137.6 -32.8 15.8 -5.9 17 17 A I E + 0 0 17 39,-2.0 2,-0.3 -2,-0.4 10,-0.2 -0.234 51.5 168.3 -48.6 133.5 -34.3 12.4 -5.0 18 18 A Y E -A 26 0A 67 8,-3.0 8,-3.2 6,-0.1 2,-0.4 -0.894 35.7-106.4-137.6 175.4 -32.1 9.5 -6.0 19 19 A K E -A 25 0A 128 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.887 30.9-136.4-102.2 134.0 -31.9 5.7 -5.3 20 20 A D > - 0 0 53 4,-2.5 3,-1.8 -2,-0.4 -1,-0.1 -0.068 44.0 -78.5 -71.9-174.6 -29.3 4.4 -3.0 21 21 A T T 3 S+ 0 0 155 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.595 135.2 49.7 -70.8 -8.5 -27.2 1.1 -3.7 22 22 A E T 3 S- 0 0 145 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.402 124.2-105.0-102.4 3.8 -30.2 -1.1 -2.7 23 23 A G S < S+ 0 0 36 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.472 71.8 143.8 87.9 10.1 -32.6 1.0 -4.9 24 24 A Y - 0 0 62 1,-0.1 -4,-2.5 -5,-0.1 -1,-0.3 -0.645 56.8-104.2 -91.8 137.6 -34.4 3.0 -2.2 25 25 A Y E +AB 19 34A 30 9,-0.5 8,-2.8 11,-0.4 9,-1.0 -0.327 51.4 163.9 -60.9 130.4 -35.4 6.6 -2.7 26 26 A T E +AB 18 32A 3 -8,-3.2 -8,-3.0 6,-0.3 2,-0.3 -0.919 13.8 173.2-148.2 154.7 -33.1 9.0 -0.8 27 27 A I E > + B 0 31A 0 4,-1.4 4,-2.1 -2,-0.3 -12,-0.2 -0.958 52.6 19.9-157.1 172.9 -32.3 12.7 -0.8 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-2.2 -2,-0.3 2,-1.0 -0.425 126.5 -9.6 67.2-141.0 -30.2 15.2 1.3 29 29 A I T 4 S- 0 0 3 34,-0.3 -16,-0.1 -16,-0.2 -1,-0.1 -0.794 127.9 -53.0 -91.0 88.1 -27.5 13.5 3.3 30 30 A G T 4 S+ 0 0 30 -2,-1.0 2,-0.9 1,-0.2 -2,-0.2 0.802 85.1 169.0 42.1 38.8 -28.5 9.8 2.9 31 31 A H E < -B 27 0A 27 -4,-2.1 -4,-1.4 1,-0.0 2,-0.4 -0.677 28.4-142.8 -80.0 109.0 -32.0 10.6 4.0 32 32 A L E -B 26 0A 71 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.524 19.3-177.6 -69.9 124.2 -34.2 7.5 3.3 33 33 A L E - 0 0 11 -8,-2.8 2,-0.3 -2,-0.4 -1,-0.2 0.889 60.9 -22.6 -90.5 -42.8 -37.6 8.7 2.2 34 34 A T E -B 25 0A 29 -9,-1.0 -9,-0.5 2,-0.1 -1,-0.3 -0.972 38.9-135.9-161.1 150.5 -39.4 5.3 1.7 35 35 A K S S+ 0 0 132 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.557 76.7 108.5 -84.1 -6.5 -38.8 1.7 1.1 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.422 73.9-134.5 -64.4 138.8 -41.6 1.7 -1.5 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.514 77.4 107.6 -69.8 -1.3 -40.7 1.4 -5.2 38 38 A S > - 0 0 49 1,-0.2 4,-2.0 2,-0.1 5,-0.1 -0.654 56.6-161.7 -79.6 117.0 -43.2 4.3 -5.9 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.892 96.2 57.1 -61.9 -38.7 -41.5 7.6 -6.7 40 40 A N H > S+ 0 0 114 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.905 104.2 50.2 -56.0 -41.4 -44.8 9.2 -5.8 41 41 A A H > S+ 0 0 24 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.943 110.4 51.0 -61.0 -45.9 -44.7 7.6 -2.3 42 42 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.935 112.0 46.7 -57.9 -48.9 -41.1 9.0 -2.0 43 43 A K H X S+ 0 0 40 -4,-2.9 4,-2.6 1,-0.2 11,-0.3 0.903 109.6 53.4 -59.3 -42.3 -42.3 12.5 -3.0 44 44 A S H X S+ 0 0 61 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.860 110.6 47.0 -61.3 -37.8 -45.3 12.4 -0.6 45 45 A E H X S+ 0 0 71 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.886 112.7 49.7 -67.8 -42.1 -43.0 11.5 2.4 46 46 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.3 0.913 109.4 51.6 -63.2 -43.7 -40.6 14.3 1.4 47 47 A D H X>S+ 0 0 35 -4,-2.6 4,-2.4 1,-0.2 5,-0.9 0.884 109.8 49.7 -60.9 -41.2 -43.5 16.8 1.1 48 48 A K H <5S+ 0 0 159 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.874 111.9 48.9 -63.7 -43.2 -44.8 15.9 4.6 49 49 A A H <5S+ 0 0 31 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.870 124.0 27.4 -70.1 -42.0 -41.3 16.2 6.1 50 50 A I H <5S- 0 0 21 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.714 101.4-123.2-100.1 -13.3 -40.4 19.6 4.7 51 51 A G T <5S+ 0 0 63 -4,-2.4 2,-0.3 -5,-0.3 -3,-0.2 0.904 74.0 92.7 77.8 42.5 -44.0 21.2 4.3 52 52 A R S - 0 0 8 -2,-1.3 3,-1.3 -11,-0.3 -1,-0.2 0.695 31.0-145.3 -81.2 -22.5 -41.4 19.7 -3.5 55 55 A N T 3 S- 0 0 119 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.802 74.1 -57.8 47.4 36.6 -41.7 17.4 -6.6 56 56 A G T 3 S+ 0 0 4 1,-0.2 -39,-2.0 -13,-0.2 2,-0.4 0.600 116.3 109.8 78.2 16.0 -38.6 15.7 -5.3 57 57 A V B < +C 16 0B 72 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.990 40.2 170.9-130.6 124.1 -36.4 18.8 -5.3 58 58 A I - 0 0 7 -43,-2.6 2,-0.2 -2,-0.4 -30,-0.1 -0.797 27.8-116.2-127.4 170.1 -35.1 20.6 -2.1 59 59 A T > - 0 0 70 -2,-0.3 4,-2.1 1,-0.1 3,-0.2 -0.592 36.2-104.7 -99.1 165.2 -32.8 23.3 -1.0 60 60 A K H > S+ 0 0 79 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.881 121.4 55.3 -57.1 -40.3 -29.7 22.9 1.2 61 61 A D H > S+ 0 0 114 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.858 108.2 48.9 -62.5 -37.1 -31.5 24.4 4.2 62 62 A E H > S+ 0 0 31 2,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.874 109.8 51.6 -69.4 -38.1 -34.2 21.7 3.8 63 63 A A H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -34,-0.3 0.898 109.3 51.1 -59.0 -40.4 -31.5 19.0 3.6 64 64 A E H X S+ 0 0 62 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.882 108.3 51.6 -67.1 -39.3 -30.0 20.4 6.8 65 65 A K H X S+ 0 0 98 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.937 112.2 44.7 -61.4 -48.1 -33.5 20.2 8.4 66 66 A L H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.908 112.9 53.8 -59.4 -46.4 -33.9 16.5 7.4 67 67 A F H X S+ 0 0 2 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.912 105.2 52.7 -50.1 -49.9 -30.3 16.0 8.5 68 68 A N H X S+ 0 0 73 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.877 109.3 49.1 -59.5 -39.6 -31.0 17.5 12.0 69 69 A Q H X S+ 0 0 76 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.863 110.6 51.2 -64.0 -40.6 -34.0 15.1 12.4 70 70 A D H X S+ 0 0 36 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.875 109.5 49.8 -63.9 -39.7 -31.7 12.1 11.3 71 71 A V H X S+ 0 0 17 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.952 109.8 50.7 -60.2 -50.6 -29.1 13.2 13.9 72 72 A D H X S+ 0 0 92 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.891 113.6 46.3 -55.7 -40.9 -31.8 13.3 16.6 73 73 A A H X S+ 0 0 44 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.885 111.4 51.5 -66.2 -41.0 -32.9 9.8 15.6 74 74 A A H X S+ 0 0 11 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.905 111.0 47.3 -64.8 -41.7 -29.4 8.6 15.5 75 75 A V H X S+ 0 0 26 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.923 111.4 50.3 -68.0 -41.3 -28.8 9.9 19.0 76 76 A R H X S+ 0 0 159 -4,-2.4 4,-1.3 -5,-0.2 -1,-0.2 0.875 110.4 51.9 -61.2 -36.0 -32.0 8.3 20.3 77 77 A G H < S+ 0 0 12 -4,-2.2 4,-0.3 1,-0.2 -2,-0.2 0.902 111.3 46.7 -65.2 -41.8 -30.8 5.1 18.7 78 78 A I H >< S+ 0 0 0 -4,-2.3 3,-1.3 1,-0.2 7,-0.5 0.917 110.3 51.5 -62.4 -46.8 -27.6 5.3 20.5 79 79 A L H 3< S+ 0 0 83 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.733 109.5 51.4 -66.2 -27.2 -29.2 6.2 23.9 80 80 A R T 3< S+ 0 0 207 -4,-1.3 2,-0.7 -5,-0.2 -1,-0.3 0.504 95.4 85.7 -80.5 -14.4 -31.4 3.1 23.6 81 81 A N X> - 0 0 33 -3,-1.3 4,-3.0 -4,-0.3 3,-1.6 -0.826 63.9-157.1-103.4 110.6 -28.5 0.8 22.8 82 82 A A T 34 S+ 0 0 79 -2,-0.7 -1,-0.1 1,-0.3 -4,-0.1 0.730 94.9 53.5 -55.8 -26.1 -26.7 -0.6 25.9 83 83 A K T 34 S+ 0 0 132 2,-0.1 -1,-0.3 1,-0.1 4,-0.2 0.676 120.0 30.0 -79.2 -20.2 -23.5 -1.1 23.8 84 84 A L T <> S+ 0 0 0 -3,-1.6 4,-2.7 -6,-0.4 5,-0.2 0.727 103.2 74.1-113.4 -29.9 -23.3 2.5 22.5 85 85 A K H X S+ 0 0 81 -4,-3.0 4,-2.8 -7,-0.5 5,-0.3 0.911 94.8 51.0 -56.1 -51.4 -24.8 4.6 25.3 86 86 A P H > S+ 0 0 41 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.924 115.1 41.1 -60.3 -43.3 -21.9 4.3 27.7 87 87 A V H > S+ 0 0 5 -4,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.937 115.6 51.5 -63.3 -49.7 -19.2 5.4 25.1 88 88 A Y H >< S+ 0 0 23 -4,-2.7 3,-0.9 1,-0.2 -3,-0.2 0.951 109.5 49.4 -50.4 -51.9 -21.5 8.1 23.7 89 89 A D H 3< S+ 0 0 82 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.837 111.3 51.4 -59.7 -33.9 -22.2 9.6 27.2 90 90 A S H 3< S+ 0 0 36 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.731 94.3 90.7 -75.3 -25.7 -18.5 9.6 27.9 91 91 A L S << S- 0 0 5 -4,-1.3 2,-0.1 -3,-0.9 31,-0.0 -0.432 76.1-118.8 -78.4 144.5 -17.4 11.4 24.7 92 92 A D > - 0 0 55 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.263 43.9 -93.7 -63.0 167.0 -17.0 15.2 24.2 93 93 A A H > S+ 0 0 78 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.856 123.3 49.8 -65.1 -38.8 -19.2 16.7 21.5 94 94 A V H > S+ 0 0 29 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.918 113.0 46.5 -65.5 -48.6 -16.7 16.5 18.6 95 95 A R H > S+ 0 0 26 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.851 107.9 57.0 -65.1 -35.9 -16.0 12.8 19.3 96 96 A R H X S+ 0 0 77 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.899 103.1 55.2 -55.4 -42.2 -19.7 12.1 19.6 97 97 A A H X S+ 0 0 5 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.891 105.3 52.4 -58.9 -38.3 -20.1 13.6 16.1 98 98 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.884 109.9 48.2 -61.2 -41.6 -17.5 11.0 14.9 99 99 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.927 112.0 48.6 -67.0 -40.9 -19.5 8.2 16.5 100 100 A I H X S+ 0 0 7 -4,-2.6 4,-3.2 2,-0.2 -2,-0.2 0.895 106.1 58.2 -65.9 -38.9 -22.8 9.5 14.9 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.957 107.3 47.3 -52.9 -49.4 -20.9 9.7 11.5 102 102 A M H X S+ 0 0 4 -4,-2.0 4,-2.7 2,-0.2 5,-0.5 0.895 109.4 53.4 -60.7 -41.7 -20.2 5.9 11.9 103 103 A V H X S+ 0 0 15 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.925 108.0 51.8 -59.2 -41.1 -23.9 5.3 12.8 104 104 A F H < S+ 0 0 39 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.903 115.6 41.0 -59.7 -38.5 -24.8 7.2 9.5 105 105 A Q H < S+ 0 0 57 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.879 136.4 7.7 -75.0 -42.0 -22.5 5.0 7.5 106 106 A M H X S- 0 0 53 -4,-2.7 4,-0.7 -5,-0.2 -3,-0.2 0.456 98.3-117.5-130.4 -3.9 -23.1 1.6 8.9 107 107 A G H X - 0 0 30 -4,-2.0 4,-2.3 -5,-0.5 5,-0.2 0.087 41.1 -70.1 79.0 163.2 -26.0 1.8 11.4 108 108 A E H > S+ 0 0 64 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.874 132.9 52.8 -58.1 -44.3 -26.1 1.1 15.1 109 109 A T H > S+ 0 0 127 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.891 109.8 49.8 -58.3 -44.4 -25.6 -2.7 14.7 110 110 A G H >< S+ 0 0 26 -4,-0.7 3,-0.9 2,-0.2 4,-0.3 0.951 114.7 43.1 -58.2 -48.5 -22.5 -2.0 12.6 111 111 A V H >< S+ 0 0 0 -4,-2.3 3,-1.9 1,-0.3 -2,-0.2 0.909 106.2 59.5 -71.7 -43.3 -21.1 0.4 15.2 112 112 A A H 3< S+ 0 0 14 -4,-3.1 -1,-0.3 1,-0.2 -2,-0.2 0.680 92.0 74.3 -52.6 -19.8 -21.9 -1.8 18.2 113 113 A G T << S+ 0 0 57 -3,-0.9 2,-1.6 -4,-0.7 3,-0.3 0.750 77.4 77.8 -66.8 -22.4 -19.7 -4.5 16.5 114 114 A F <> + 0 0 42 -3,-1.9 4,-2.6 -4,-0.3 5,-0.3 -0.310 56.0 155.6 -88.8 58.5 -16.5 -2.5 17.5 115 115 A T H > S+ 0 0 82 -2,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.858 70.7 42.5 -53.6 -48.7 -16.4 -3.6 21.1 116 116 A N H > S+ 0 0 86 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.909 115.5 48.5 -69.4 -43.6 -12.7 -3.1 21.7 117 117 A S H > S+ 0 0 3 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.905 111.7 49.4 -61.4 -46.6 -12.5 0.3 19.9 118 118 A L H X S+ 0 0 10 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.871 111.0 50.0 -60.7 -40.9 -15.5 1.7 21.7 119 119 A R H X S+ 0 0 98 -4,-1.8 4,-1.9 -5,-0.3 -2,-0.2 0.923 109.6 51.7 -64.4 -41.3 -14.1 0.5 25.1 120 120 A M H <>S+ 0 0 12 -4,-2.3 5,-3.1 2,-0.2 -2,-0.2 0.915 111.3 47.3 -60.0 -42.4 -10.8 2.2 24.2 121 121 A L H ><5S+ 0 0 1 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.921 109.3 53.4 -62.9 -47.7 -12.7 5.5 23.4 122 122 A Q H 3<5S+ 0 0 88 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.878 109.7 48.9 -51.4 -39.0 -14.6 5.2 26.7 123 123 A Q T 3<5S- 0 0 102 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.429 114.5-120.4 -84.4 1.0 -11.3 4.9 28.4 124 124 A K T < 5 + 0 0 102 -3,-1.7 2,-1.6 1,-0.2 -3,-0.2 0.732 64.1 147.0 63.1 27.6 -10.0 8.0 26.6 125 125 A R >< + 0 0 129 -5,-3.1 4,-2.8 1,-0.2 -1,-0.2 -0.590 18.3 168.6 -92.8 71.4 -7.2 5.9 25.1 126 126 A W H > + 0 0 52 -2,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.860 67.3 45.9 -60.0 -45.5 -7.4 8.0 21.9 127 127 A D H > S+ 0 0 115 -3,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 115.8 46.3 -67.4 -40.1 -4.1 6.8 20.1 128 128 A E H > S+ 0 0 87 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.903 111.8 50.6 -69.7 -43.6 -4.9 3.2 20.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.931 112.0 49.0 -56.2 -47.5 -8.5 3.5 19.7 130 130 A A H X S+ 0 0 6 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.891 112.3 46.4 -62.6 -44.7 -7.3 5.1 16.5 131 131 A C H X S+ 0 0 80 -4,-2.4 4,-0.6 2,-0.2 -1,-0.2 0.918 113.1 51.3 -63.1 -42.3 -4.7 2.5 15.7 132 132 A N H >< S+ 0 0 47 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.881 110.9 47.0 -62.8 -41.5 -7.3 -0.2 16.5 133 133 A L H >< S+ 0 0 2 -4,-2.5 3,-1.6 1,-0.2 6,-0.5 0.829 102.5 63.5 -69.4 -31.5 -9.9 1.2 14.2 134 134 A A H 3< S+ 0 0 39 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.693 97.9 58.4 -67.7 -17.1 -7.3 1.6 11.4 135 135 A K T << S+ 0 0 166 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.355 88.9 110.3 -87.0 1.8 -7.0 -2.2 11.4 136 136 A S S <> S- 0 0 17 -3,-1.6 4,-1.7 1,-0.1 5,-0.1 -0.290 79.3-123.3 -82.2 159.2 -10.6 -2.7 10.6 137 137 A R H > S+ 0 0 185 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.877 113.8 62.0 -60.4 -39.0 -12.4 -4.0 7.6 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.6 2,-0.2 8,-0.2 0.941 103.4 48.6 -49.9 -50.9 -14.3 -0.6 7.7 139 139 A Y H 4 S+ 0 0 51 -6,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.892 112.2 48.0 -58.5 -47.2 -11.0 1.3 7.2 140 140 A N H < S+ 0 0 116 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.847 114.1 47.5 -62.6 -35.9 -10.1 -1.0 4.2 141 141 A Q H < S+ 0 0 119 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.916 133.1 12.0 -73.1 -42.2 -13.5 -0.6 2.6 142 142 A T S X S+ 0 0 48 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 -0.650 73.2 165.5-136.7 69.0 -13.8 3.3 2.9 143 143 A P H > S+ 0 0 40 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.817 71.3 54.6 -65.7 -33.2 -10.3 4.5 3.9 144 144 A N H > S+ 0 0 109 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.961 116.0 38.5 -64.0 -52.1 -10.8 8.3 3.1 145 145 A R H > S+ 0 0 27 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.913 117.3 49.7 -60.6 -49.4 -13.9 8.5 5.3 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.905 108.2 53.9 -62.5 -38.9 -12.5 6.2 8.0 147 147 A K H X S+ 0 0 84 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.911 110.6 46.2 -60.8 -42.3 -9.2 8.1 8.2 148 148 A R H X S+ 0 0 50 -4,-1.6 4,-1.6 2,-0.2 12,-0.2 0.913 115.0 46.3 -66.2 -44.3 -11.0 11.4 8.8 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.908 112.6 50.5 -62.4 -44.5 -13.3 9.9 11.4 150 150 A I H X S+ 0 0 7 -4,-3.0 4,-3.3 1,-0.2 -2,-0.2 0.912 108.1 52.1 -63.8 -39.6 -10.4 8.2 13.1 151 151 A T H X S+ 0 0 28 -4,-2.5 4,-2.9 -5,-0.2 6,-0.4 0.867 108.7 52.9 -59.2 -36.5 -8.5 11.5 13.2 152 152 A T H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 5,-0.3 0.924 111.7 43.6 -65.0 -49.8 -11.6 13.1 14.8 153 153 A F H < S+ 0 0 1 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.910 116.4 50.1 -56.0 -46.0 -11.6 10.3 17.5 154 154 A R H < S+ 0 0 98 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.933 126.5 20.1 -61.6 -47.1 -7.8 10.7 17.9 155 155 A T H < S- 0 0 50 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.644 85.9-134.2-101.8 -21.9 -7.6 14.5 18.3 156 156 A G S < S+ 0 0 16 -4,-2.3 2,-0.3 -5,-0.3 -62,-0.2 0.765 74.5 104.5 62.8 28.1 -11.1 15.6 19.4 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.809 81.8-120.9-129.1 167.9 -10.8 18.3 16.7 158 158 A W S > S+ 0 0 53 -2,-0.3 3,-2.0 1,-0.2 4,-0.3 0.061 71.4 123.0 -92.2 17.6 -12.2 18.9 13.3 159 159 A D G > + 0 0 108 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.773 61.9 65.3 -55.2 -31.4 -8.7 19.1 11.7 160 160 A A G 3 S+ 0 0 27 -3,-0.3 -1,-0.3 1,-0.2 3,-0.2 0.727 104.8 46.5 -61.5 -20.9 -9.3 16.3 9.2 161 161 A Y G X S+ 0 0 6 -3,-2.0 3,-1.6 1,-0.2 -1,-0.2 0.369 80.1 106.2-104.5 -0.3 -12.0 18.6 7.5 162 162 A K T < S+ 0 0 166 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.1 0.847 88.1 32.6 -51.9 -46.7 -9.9 21.8 7.4 163 163 A N T 3 0 0 142 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.247 360.0 360.0 -98.2 11.8 -9.1 21.7 3.6 164 164 A L < 0 0 121 -3,-1.6 -3,-0.1 0, 0.0 -155,-0.1 -0.504 360.0 360.0-109.4 360.0 -12.4 20.1 2.5