==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-DEC-99 1C6P . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.L.QUILLIN,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8846.0 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 . 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 . 9 5.6 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 65 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 153.7 43.4 -1.9 9.1 2 2 A N > - 0 0 68 1,-0.0 4,-3.0 156,-0.0 5,-0.2 -0.937 360.0 -80.5-155.5 177.8 40.2 -0.7 10.7 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.850 125.4 49.3 -54.3 -40.6 38.0 2.3 11.2 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.947 114.0 43.1 -66.6 -47.7 40.1 3.6 14.1 5 5 A E H > S+ 0 0 93 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.891 113.7 54.8 -62.7 -38.8 43.4 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.943 111.8 40.9 -59.5 -55.0 41.8 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.4 0.868 108.9 60.0 -64.4 -34.0 40.6 7.8 10.9 8 8 A R H X S+ 0 0 103 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.873 107.7 48.1 -62.4 -32.8 43.8 8.2 12.9 9 9 A I H < S+ 0 0 83 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.933 116.1 41.7 -72.6 -46.7 45.6 8.5 9.6 10 10 A D H < S+ 0 0 21 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.842 123.7 34.2 -71.1 -34.1 43.2 11.0 8.1 11 11 A E H < S- 0 0 45 -4,-2.9 19,-0.3 1,-0.2 -3,-0.2 0.706 91.4-150.4 -95.4 -25.0 42.7 13.2 11.2 12 12 A G < - 0 0 23 -4,-1.5 2,-0.3 -5,-0.4 -1,-0.2 -0.353 23.0 -91.1 79.8-170.3 46.2 13.1 12.8 13 13 A L + 0 0 35 16,-0.1 2,-0.4 -2,-0.1 16,-0.2 -0.922 42.5 172.9-144.6 116.3 46.6 13.6 16.5 14 14 A R E -A 28 0A 141 14,-1.9 14,-2.6 -2,-0.3 4,-0.1 -0.996 19.7-162.2-129.9 132.6 47.2 17.0 18.2 15 15 A L E S+ 0 0 64 -2,-0.4 43,-2.6 12,-0.2 2,-0.3 0.512 74.4 60.8 -88.2 -11.8 47.3 17.5 21.9 16 16 A K E S-C 57 0B 143 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.869 101.8 -85.9-112.7 153.5 46.8 21.4 21.9 17 17 A I E + 0 0 30 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.291 58.6 169.8 -57.5 136.6 43.8 23.2 20.5 18 18 A Y E -A 26 0A 25 8,-3.2 8,-3.1 -4,-0.1 2,-0.4 -0.851 35.6-104.1-140.8 173.0 44.2 23.8 16.8 19 19 A K E -A 25 0A 118 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.874 34.6-137.8-103.0 138.9 42.1 24.9 13.8 20 20 A D > - 0 0 49 4,-2.8 3,-1.9 -2,-0.4 -1,-0.1 -0.060 42.5 -76.7 -79.5-170.0 40.9 22.3 11.3 21 21 A T T 3 S+ 0 0 107 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.763 135.0 49.7 -61.1 -25.5 40.8 22.6 7.6 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.459 122.1-104.8 -90.7 -0.5 37.7 24.9 7.9 23 23 A G S < S+ 0 0 38 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.602 75.8 140.5 85.2 19.1 39.4 27.2 10.5 24 24 A Y - 0 0 70 1,-0.1 -4,-2.8 13,-0.0 -1,-0.3 -0.786 60.5-100.9 -97.4 145.0 37.3 25.7 13.4 25 25 A Y E +AB 19 34A 37 9,-0.7 8,-3.2 11,-0.4 9,-1.4 -0.381 54.5 158.5 -65.4 127.1 38.8 24.9 16.9 26 26 A T E -AB 18 32A 3 -8,-3.1 -8,-3.2 6,-0.3 2,-0.3 -0.910 20.7-167.1-141.8 162.9 39.6 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.0 -2,-0.3 -12,-0.2 -0.966 53.3 1.1-148.9 163.8 41.8 19.1 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.9 -2,-0.3 2,-0.9 -0.400 122.6 -2.4 69.9-132.3 42.9 15.4 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.641 128.0 -55.3 -97.0 64.7 41.9 13.1 16.7 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.779 82.8 162.2 70.8 28.5 39.7 15.5 14.8 31 31 A H E < -B 27 0A 30 -4,-2.0 -4,-1.8 1,-0.0 -1,-0.2 -0.684 31.3-144.6 -85.6 104.8 37.4 16.3 17.7 32 32 A L E -B 26 0A 69 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.402 17.2-174.1 -67.6 130.9 35.7 19.5 16.7 33 33 A L E - 0 0 14 -8,-3.2 2,-0.3 1,-0.3 -7,-0.2 0.886 57.9 -27.0 -93.1 -44.9 35.2 21.8 19.7 34 34 A T E -B 25 0A 29 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.3 -0.957 36.1-133.9-168.9 149.7 33.1 24.6 18.3 35 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.525 76.1 111.0 -87.1 -4.2 32.3 26.5 15.1 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.351 71.8-134.2 -75.3 146.2 32.7 29.7 17.1 37 37 A P S S+ 0 0 125 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.284 74.6 105.9 -83.5 20.6 35.6 32.0 16.4 38 38 A S > - 0 0 49 1,-0.1 4,-2.0 -13,-0.0 5,-0.2 -0.872 55.5-160.7-104.7 123.1 36.3 32.5 20.1 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.4 1,-0.2 -1,-0.1 0.858 96.6 54.8 -65.2 -33.5 39.3 30.7 21.6 40 40 A N H > S+ 0 0 121 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.892 105.4 50.5 -64.7 -43.8 37.7 31.1 25.0 41 41 A A H > S+ 0 0 31 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.924 110.5 50.1 -60.2 -44.0 34.6 29.4 23.9 42 42 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.913 110.1 50.5 -61.5 -43.0 36.6 26.5 22.5 43 43 A K H X S+ 0 0 60 -4,-2.4 4,-2.5 2,-0.2 11,-0.2 0.921 109.9 50.8 -61.6 -40.0 38.5 26.3 25.8 44 44 A S H X S+ 0 0 73 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.945 111.0 47.0 -62.2 -52.0 35.2 26.2 27.7 45 45 A E H X S+ 0 0 65 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.865 111.5 54.3 -59.8 -34.5 33.8 23.4 25.4 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.930 108.2 46.6 -66.7 -43.2 37.1 21.5 25.9 47 47 A D H X>S+ 0 0 33 -4,-2.5 4,-2.3 1,-0.2 5,-1.3 0.905 112.0 51.9 -63.6 -37.3 37.0 21.6 29.7 48 48 A K H <5S+ 0 0 143 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.869 110.9 48.0 -64.1 -42.9 33.3 20.5 29.5 49 49 A A H <5S+ 0 0 46 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.871 120.6 36.3 -66.6 -38.9 34.2 17.5 27.3 50 50 A I H <5S- 0 0 36 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.756 101.9-125.7 -87.0 -34.3 37.2 16.4 29.4 51 51 A G T <5S+ 0 0 65 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.747 76.2 68.7 92.9 23.1 35.9 17.1 32.9 52 52 A R S - 0 0 8 -2,-0.9 3,-1.0 -11,-0.2 -1,-0.2 0.714 34.3-142.3 -93.6 -24.9 42.7 21.8 30.8 55 55 A N T 3 S- 0 0 120 1,-0.2 -2,-0.1 -3,-0.1 3,-0.1 0.887 72.6 -59.6 64.0 35.4 44.0 25.1 29.8 56 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.544 117.4 100.1 70.2 10.1 43.7 24.0 26.1 57 57 A V B < -C 16 0B 64 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.991 46.8-179.8-129.7 136.0 46.0 21.0 26.4 58 58 A I - 0 0 4 -43,-2.6 2,-0.2 -2,-0.4 -30,-0.1 -0.819 25.5-109.0-128.6 167.4 45.1 17.3 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.502 31.8-108.2 -91.6 167.8 46.8 14.0 27.2 60 60 A K H > S+ 0 0 115 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.908 120.7 51.2 -58.5 -45.1 47.1 11.2 24.7 61 61 A D H > S+ 0 0 125 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.927 109.6 50.6 -57.9 -44.6 44.7 9.0 26.7 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.930 109.2 50.5 -64.1 -43.1 42.2 11.9 26.9 63 63 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -34,-0.4 0.924 110.6 50.0 -59.2 -42.0 42.4 12.3 23.1 64 64 A E H X S+ 0 0 81 -4,-2.5 4,-3.3 1,-0.2 -1,-0.2 0.873 107.5 53.8 -66.2 -36.4 41.8 8.6 22.5 65 65 A K H X S+ 0 0 141 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.946 109.8 46.7 -63.8 -43.8 38.8 8.7 24.8 66 66 A L H X S+ 0 0 6 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.922 112.2 52.8 -58.3 -43.3 37.3 11.5 22.9 67 67 A F H X S+ 0 0 12 -4,-2.6 4,-3.0 2,-0.2 5,-0.4 0.945 107.0 50.0 -59.9 -49.5 38.1 9.6 19.7 68 68 A N H X S+ 0 0 88 -4,-3.3 4,-2.3 1,-0.2 5,-0.2 0.934 112.3 48.5 -55.8 -42.9 36.4 6.4 20.9 69 69 A Q H X S+ 0 0 99 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.905 112.2 50.2 -63.6 -37.8 33.2 8.4 21.9 70 70 A D H X S+ 0 0 35 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.869 110.1 47.2 -70.7 -36.8 33.3 10.1 18.5 71 71 A V H X S+ 0 0 6 -4,-3.0 4,-2.2 2,-0.2 5,-0.2 0.956 113.8 49.1 -64.5 -49.0 33.5 7.0 16.5 72 72 A D H X S+ 0 0 100 -4,-2.3 4,-2.4 -5,-0.4 5,-0.3 0.942 110.4 50.5 -53.9 -46.8 30.8 5.4 18.5 73 73 A A H X S+ 0 0 60 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.3 0.882 106.5 55.6 -62.1 -38.1 28.6 8.5 18.0 74 74 A A H X S+ 0 0 9 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.924 108.5 47.1 -63.4 -43.0 29.2 8.4 14.3 75 75 A V H X S+ 0 0 32 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.925 112.7 48.3 -64.0 -45.5 27.9 4.7 14.0 76 76 A R H X S+ 0 0 132 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.943 108.4 56.3 -63.6 -39.0 24.9 5.4 16.1 77 77 A G H X S+ 0 0 11 -4,-2.4 4,-0.9 -5,-0.3 -1,-0.2 0.936 109.8 44.9 -53.2 -49.7 24.2 8.4 14.0 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 7,-0.5 0.964 112.8 50.2 -58.8 -49.8 24.2 6.3 10.9 79 79 A L H 3< S+ 0 0 62 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.785 111.1 49.3 -63.6 -28.9 22.1 3.7 12.5 80 80 A R H 3< S+ 0 0 198 -4,-2.4 2,-0.6 -5,-0.2 -1,-0.3 0.569 93.8 92.4 -86.7 -8.1 19.6 6.2 13.6 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.9 -7,-0.2 3,-0.3 0.869 99.6 67.0 -86.8 -42.4 21.9 6.2 6.0 85 85 A K H X S+ 0 0 90 -4,-3.0 4,-2.9 -7,-0.5 5,-0.2 0.887 98.6 52.5 -52.2 -45.9 21.1 3.0 7.8 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.889 112.8 46.0 -64.1 -31.4 19.9 1.1 4.7 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-1.1 -3,-0.3 3,-0.4 0.957 112.3 48.7 -73.0 -47.9 23.0 1.9 2.9 88 88 A Y H >< S+ 0 0 30 -4,-2.9 3,-0.8 1,-0.2 -1,-0.2 0.922 110.1 51.9 -55.3 -45.1 25.2 1.1 5.6 89 89 A D H 3< S+ 0 0 73 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.825 107.0 54.5 -64.3 -29.5 23.5 -2.2 6.2 90 90 A S H 3< S+ 0 0 41 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.678 96.0 87.0 -77.1 -17.1 23.8 -3.2 2.5 91 91 A L S << S- 0 0 5 -4,-1.1 2,-0.1 -3,-0.8 31,-0.0 -0.495 77.9-113.0 -87.9 158.8 27.6 -2.7 2.4 92 92 A D > - 0 0 56 -2,-0.1 4,-2.3 1,-0.1 5,-0.1 -0.219 44.1 -94.0 -73.9 170.6 30.6 -5.0 3.3 93 93 A A H > S+ 0 0 80 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.840 121.1 50.1 -60.4 -42.0 32.8 -4.2 6.3 94 94 A V H > S+ 0 0 28 2,-0.2 4,-1.6 62,-0.2 3,-0.3 0.939 112.8 46.1 -62.4 -49.1 35.4 -2.2 4.5 95 95 A R H > S+ 0 0 26 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.891 105.2 61.0 -68.3 -34.0 33.0 0.1 2.7 96 96 A R H X S+ 0 0 83 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.884 102.0 54.0 -56.2 -39.0 31.1 0.6 6.0 97 97 A A H X S+ 0 0 5 -4,-1.5 4,-2.5 -3,-0.3 -1,-0.2 0.879 105.6 52.8 -65.1 -34.2 34.3 2.1 7.4 98 98 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.873 108.4 49.3 -68.4 -34.7 34.4 4.5 4.5 99 99 A L H X S+ 0 0 1 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.882 110.3 51.0 -70.5 -35.7 30.9 5.6 5.2 100 100 A I H X S+ 0 0 11 -4,-2.2 4,-3.1 2,-0.2 5,-0.3 0.926 106.3 56.5 -63.1 -41.3 31.7 6.1 8.9 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.957 107.3 48.1 -54.4 -51.5 34.8 8.2 7.8 102 102 A M H X S+ 0 0 2 -4,-2.0 4,-3.1 1,-0.2 5,-0.4 0.921 112.0 47.7 -56.4 -47.2 32.6 10.5 5.9 103 103 A V H X S+ 0 0 9 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.917 109.8 53.8 -62.5 -42.3 30.0 11.0 8.7 104 104 A F H < S+ 0 0 33 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.947 117.1 38.5 -58.2 -44.7 32.8 11.6 11.3 105 105 A Q H < S+ 0 0 53 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.916 134.8 16.6 -71.2 -47.2 34.2 14.4 9.0 106 106 A M H X S- 0 0 53 -4,-3.1 4,-0.6 -5,-0.2 -3,-0.2 0.534 103.5-112.5-110.0 -7.1 31.0 16.0 7.8 107 107 A G H X - 0 0 29 -4,-2.7 4,-2.5 -5,-0.4 5,-0.2 0.134 32.2 -83.0 85.2 153.7 28.2 14.9 10.0 108 108 A E H > S+ 0 0 67 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.864 127.0 54.7 -55.8 -44.7 25.2 12.7 9.4 109 109 A T H > S+ 0 0 121 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.930 108.0 46.0 -59.3 -52.3 23.3 15.5 8.0 110 110 A G H < S+ 0 0 35 -4,-0.6 3,-0.4 1,-0.2 -2,-0.2 0.902 116.7 45.4 -63.4 -41.0 25.9 16.5 5.4 111 111 A V H >< S+ 0 0 1 -4,-2.5 3,-2.4 1,-0.2 -2,-0.2 0.894 104.1 61.3 -69.9 -37.7 26.4 12.9 4.3 112 112 A A H 3< S+ 0 0 20 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.773 96.2 65.2 -61.6 -19.7 22.6 12.1 4.2 113 113 A G T 3< S+ 0 0 57 -4,-0.9 2,-0.9 -3,-0.4 -1,-0.3 0.480 74.7 88.1 -80.5 2.2 22.5 14.8 1.5 114 114 A F <> + 0 0 39 -3,-2.4 4,-2.9 1,-0.2 5,-0.3 -0.314 55.4 156.5 -94.3 55.7 24.6 12.8 -1.0 115 115 A T H > + 0 0 85 -2,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.835 64.5 45.6 -47.5 -53.8 21.5 11.2 -2.2 116 116 A N H > S+ 0 0 97 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.879 115.5 47.6 -60.4 -43.2 22.6 10.1 -5.7 117 117 A S H > S+ 0 0 0 -3,-0.2 4,-2.6 2,-0.2 5,-0.3 0.923 110.1 53.6 -65.6 -44.6 25.9 8.7 -4.4 118 118 A L H X S+ 0 0 12 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.896 108.5 49.1 -54.1 -45.0 24.0 6.8 -1.6 119 119 A R H X S+ 0 0 166 -4,-1.9 4,-2.1 -5,-0.3 -1,-0.2 0.927 110.9 49.8 -66.1 -41.0 21.7 5.2 -4.1 120 120 A M H <>S+ 0 0 41 -4,-2.0 5,-2.3 2,-0.2 4,-0.5 0.898 111.0 48.9 -66.1 -39.0 24.7 4.1 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.931 110.4 51.9 -64.8 -41.9 26.5 2.6 -3.3 122 122 A Q H 3<5S+ 0 0 94 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.902 110.6 48.0 -57.4 -40.8 23.3 0.8 -2.3 123 123 A Q T 3<5S- 0 0 93 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.479 113.0-120.6 -78.5 -5.9 23.1 -0.5 -5.9 124 124 A K T < 5 + 0 0 100 -3,-1.3 2,-1.2 -4,-0.5 -3,-0.2 0.746 63.6 145.8 67.9 30.6 26.8 -1.6 -5.8 125 125 A R >< + 0 0 114 -5,-2.3 4,-2.4 1,-0.2 5,-0.3 -0.673 22.0 172.9 -96.1 73.8 27.6 0.6 -8.9 126 126 A W H > + 0 0 47 -2,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.907 68.4 44.5 -55.4 -54.3 31.1 1.4 -7.5 127 127 A D H > S+ 0 0 104 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.889 114.6 50.9 -64.2 -35.0 32.7 3.3 -10.3 128 128 A E H > S+ 0 0 104 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.862 110.2 47.9 -67.9 -40.1 29.7 5.3 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.889 108.3 56.6 -67.6 -37.4 29.4 6.3 -7.1 130 130 A A H X S+ 0 0 10 -4,-2.1 4,-1.2 -5,-0.3 -2,-0.2 0.925 108.7 45.0 -62.5 -42.9 33.0 7.1 -7.1 131 131 A V H X S+ 0 0 100 -4,-1.8 4,-0.6 2,-0.2 3,-0.3 0.939 116.0 46.6 -65.5 -45.5 32.6 9.7 -10.0 132 132 A N H >< S+ 0 0 27 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.879 107.8 57.5 -65.6 -34.8 29.4 11.2 -8.4 133 133 A L H 3< S+ 0 0 2 -4,-2.9 6,-0.3 -5,-0.2 -1,-0.2 0.863 100.7 57.5 -64.3 -30.6 31.2 11.4 -5.0 134 134 A A H 3< S+ 0 0 27 -4,-1.2 2,-1.8 -3,-0.3 -1,-0.2 0.663 86.2 81.8 -71.1 -19.0 34.0 13.5 -6.5 135 135 A K S << S+ 0 0 157 -3,-0.9 2,-0.4 -4,-0.6 -1,-0.2 -0.556 79.3 96.1 -86.9 69.4 31.5 16.2 -7.7 136 136 A S S > S- 0 0 17 -2,-1.8 4,-2.1 1,-0.1 5,-0.2 -1.000 84.9-117.1-158.4 154.2 31.3 17.8 -4.4 137 137 A R H > S+ 0 0 146 -2,-0.4 4,-2.9 2,-0.2 5,-0.3 0.898 114.0 63.0 -60.6 -39.6 32.7 20.6 -2.4 138 138 A W H > S+ 0 0 15 1,-0.2 4,-3.2 2,-0.2 8,-0.2 0.960 106.5 43.8 -48.6 -50.2 34.1 17.9 0.0 139 139 A Y H 4 S+ 0 0 64 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.891 114.7 49.2 -64.8 -43.8 36.3 16.5 -2.8 140 140 A N H < S+ 0 0 107 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.834 116.6 41.2 -68.6 -33.3 37.4 20.0 -3.9 141 141 A Q H < S+ 0 0 104 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.861 132.3 19.9 -82.0 -38.7 38.3 21.2 -0.5 142 142 A T S X S+ 0 0 21 -4,-3.2 4,-2.5 -5,-0.3 5,-0.3 -0.581 73.4 161.1-129.9 70.1 40.0 18.0 0.9 143 143 A P H > + 0 0 47 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.900 68.1 52.0 -60.6 -44.6 41.0 16.1 -2.3 144 144 A N H > S+ 0 0 108 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.937 116.7 39.2 -63.3 -41.7 43.7 13.8 -0.9 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.928 115.4 52.2 -70.7 -45.0 41.5 12.5 1.9 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.3 1,-0.3 5,-0.3 0.927 108.6 54.8 -58.0 -39.1 38.4 12.4 -0.3 147 147 A K H X S+ 0 0 95 -4,-3.0 4,-2.2 -5,-0.3 -1,-0.3 0.914 106.2 49.1 -60.6 -43.9 40.5 10.4 -2.7 148 148 A R H X S+ 0 0 70 -4,-1.7 4,-1.4 -5,-0.2 -1,-0.2 0.909 114.4 44.3 -64.1 -38.6 41.4 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 5,-0.2 0.927 112.6 51.7 -72.8 -43.2 37.8 7.4 1.0 150 150 A I H X S+ 0 0 14 -4,-3.3 4,-2.5 -5,-0.3 -1,-0.2 0.912 108.1 51.7 -57.6 -41.5 36.5 7.3 -2.5 151 151 A T H X S+ 0 0 38 -4,-2.2 4,-2.8 -5,-0.3 6,-0.4 0.878 107.2 55.8 -61.0 -33.3 39.0 4.6 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.909 109.3 43.3 -65.7 -45.7 37.9 2.7 -0.5 153 153 A F H < S+ 0 0 1 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.870 116.0 51.2 -66.6 -39.2 34.2 2.7 -1.7 154 154 A R H < S+ 0 0 108 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.910 124.6 22.1 -65.4 -45.1 35.4 1.9 -5.2 155 155 A T H < S- 0 0 44 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.596 84.0-137.3-100.1 -21.1 37.6 -1.1 -4.4 156 156 A G S < S+ 0 0 16 -4,-2.5 2,-0.2 -5,-0.3 -62,-0.2 0.719 72.4 101.9 67.0 21.9 36.4 -2.4 -1.1 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.2 -0.741 81.3-118.4-127.2 173.1 40.1 -2.8 -0.0 158 158 A W S >> S+ 0 0 32 -2,-0.2 3,-2.6 1,-0.2 4,-0.8 0.141 72.3 124.4 -98.4 16.7 42.3 -0.8 2.2 159 159 A D G >4 + 0 0 109 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.803 66.7 57.2 -46.0 -36.4 44.7 -0.1 -0.7 160 160 A A G 34 S+ 0 0 33 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.708 110.6 44.9 -70.7 -21.0 44.5 3.6 -0.3 161 161 A Y G <4 0 0 19 -3,-2.6 -1,-0.2 -13,-0.1 -2,-0.2 0.509 360.0 360.0-104.1 -2.1 45.7 3.4 3.3 162 162 A K << 0 0 172 -4,-0.8 -2,-0.1 -3,-0.7 -3,-0.1 0.828 360.0 360.0 -99.5 360.0 48.5 0.9 2.8