==== 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 22-AUG-99 1CV6 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR N.C.GASSNER,W.A.BAASE,J.LINDSTROM,J.LU,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8650.0 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 . 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 79 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 155.3 43.5 -1.9 9.2 2 2 A N > - 0 0 68 156,-0.0 4,-3.2 1,-0.0 5,-0.3 -0.960 360.0 -82.8-154.9 177.7 40.3 -0.7 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.8 1,-0.3 5,-0.3 0.823 124.2 51.2 -55.8 -42.1 38.1 2.4 11.3 4 4 A F H > S+ 0 0 77 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.935 114.0 40.5 -66.1 -47.2 40.3 3.6 14.2 5 5 A E H > S+ 0 0 90 -3,-0.3 4,-1.5 1,-0.2 -2,-0.2 0.845 114.8 54.9 -68.8 -31.4 43.5 3.3 12.4 6 6 A M H X S+ 0 0 0 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.949 111.4 41.4 -65.4 -55.1 42.0 4.7 9.3 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 -5,-0.3 5,-0.3 0.857 108.2 60.9 -63.0 -32.1 40.7 7.8 10.9 8 8 A R H X S+ 0 0 93 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.895 107.1 48.0 -60.8 -33.4 43.9 8.3 12.9 9 9 A I H < S+ 0 0 90 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.931 114.4 44.4 -70.8 -43.3 45.6 8.5 9.6 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.821 124.4 32.3 -72.3 -30.3 43.2 11.0 8.1 11 11 A E H < S- 0 0 46 -4,-2.8 19,-0.4 -5,-0.2 -1,-0.2 0.635 90.4-149.9 -98.9 -27.5 43.0 13.2 11.2 12 12 A G < - 0 0 27 -4,-1.7 2,-0.4 -5,-0.3 -1,-0.1 -0.057 25.6 -86.9 78.2 179.7 46.3 13.1 12.9 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.978 43.5 172.5-129.4 122.0 46.9 13.5 16.6 14 14 A R E -A 28 0A 144 14,-2.0 14,-2.7 -2,-0.4 4,-0.1 -0.993 18.8-166.8-134.8 132.2 47.2 16.9 18.4 15 15 A L E S+ 0 0 64 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.412 73.8 60.8 -96.8 -1.8 47.4 17.5 22.0 16 16 A K E S-C 57 0B 112 41,-0.2 12,-0.2 12,-0.1 41,-0.2 -0.876 101.1 -86.3-123.5 148.6 46.9 21.2 22.0 17 17 A I E + 0 0 10 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.361 57.1 172.6 -53.4 140.2 43.9 23.1 20.6 18 18 A Y E -A 26 0A 27 8,-3.1 8,-3.8 -4,-0.1 2,-0.5 -0.861 34.6-103.3-143.1 172.2 44.2 23.7 16.9 19 19 A K E -A 25 0A 129 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.852 35.0-140.1 -98.7 134.5 42.3 25.0 13.9 20 20 A D > - 0 0 48 4,-2.7 3,-2.0 -2,-0.5 -1,-0.1 -0.086 39.7 -81.4 -81.1-171.3 40.9 22.5 11.5 21 21 A T T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.774 135.0 48.3 -63.6 -23.4 40.9 22.8 7.6 22 22 A E T 3 S- 0 0 78 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.354 124.5-104.7 -94.1 -1.0 37.7 24.9 8.0 23 23 A G S < S+ 0 0 38 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.625 73.8 142.8 87.7 20.0 39.4 27.1 10.6 24 24 A Y - 0 0 76 1,-0.1 -4,-2.7 9,-0.0 -1,-0.3 -0.771 59.0-102.1 -98.8 145.2 37.5 25.6 13.5 25 25 A Y E +AB 19 34A 35 9,-0.7 8,-2.8 11,-0.4 9,-1.3 -0.398 54.8 159.7 -64.2 129.5 38.8 24.9 16.9 26 26 A T E -AB 18 32A 4 -8,-3.8 -8,-3.1 6,-0.2 2,-0.3 -0.900 19.6-168.7-141.9 167.8 39.7 21.3 17.4 27 27 A I E > + B 0 31A 0 4,-2.1 4,-2.1 -2,-0.3 2,-0.2 -0.986 51.5 2.4-152.7 166.7 41.8 19.0 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.7 -14,-2.0 -2,-0.3 2,-0.8 -0.468 123.0 -4.7 70.7-125.8 43.0 15.3 19.7 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.698 127.4 -54.2-105.7 72.3 42.0 13.2 16.8 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.0 -19,-0.4 -2,-0.2 0.759 84.1 160.4 68.4 28.6 39.7 15.4 14.8 31 31 A H E < -B 27 0A 32 -4,-2.1 -4,-2.1 1,-0.0 2,-0.2 -0.680 33.1-142.8 -86.6 108.6 37.5 16.2 17.8 32 32 A L E -B 26 0A 71 -2,-1.0 -6,-0.2 -6,-0.2 3,-0.1 -0.416 19.2-176.2 -69.7 132.5 35.7 19.4 16.9 33 33 A L E - 0 0 15 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.903 58.0 -27.8 -93.4 -48.3 35.3 21.7 19.8 34 34 A T E -B 25 0A 29 -9,-1.3 -9,-0.7 2,-0.1 -1,-0.4 -0.945 34.1-135.3-164.4 155.7 33.2 24.6 18.5 35 35 A K S S+ 0 0 148 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.600 74.4 112.7 -92.0 -12.0 32.5 26.5 15.4 36 36 A S S S- 0 0 39 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.256 72.0-132.1 -65.4 147.4 32.8 29.7 17.4 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.558 77.0 100.2 -73.6 -13.6 35.6 32.1 16.6 38 38 A S > - 0 0 47 1,-0.1 4,-1.9 -13,-0.0 5,-0.1 -0.702 57.7-158.2 -89.5 132.2 36.4 32.4 20.3 39 39 A L H > S+ 0 0 66 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 0.736 96.5 54.3 -71.5 -28.0 39.3 30.6 21.9 40 40 A N H > S+ 0 0 116 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.921 105.5 53.0 -72.7 -42.1 37.8 30.9 25.3 41 41 A A H > S+ 0 0 32 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.938 112.2 46.8 -54.9 -40.7 34.7 29.4 24.1 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.882 110.2 51.6 -67.6 -39.0 36.9 26.5 22.8 43 43 A K H X S+ 0 0 63 -4,-2.5 4,-2.1 1,-0.2 11,-0.2 0.916 110.7 49.5 -66.7 -34.4 38.7 26.3 26.0 44 44 A S H X S+ 0 0 69 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.934 109.4 48.7 -68.2 -47.6 35.5 26.1 27.8 45 45 A E H X S+ 0 0 66 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.914 110.6 54.8 -62.2 -38.6 34.0 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 5,-0.3 0.927 107.8 46.2 -62.3 -43.6 37.2 21.5 26.1 47 47 A D H X>S+ 0 0 36 -4,-2.1 4,-2.8 1,-0.2 5,-1.2 0.933 112.2 51.7 -66.2 -40.0 37.1 21.5 29.9 48 48 A K H <5S+ 0 0 140 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.876 110.8 48.7 -57.9 -42.5 33.5 20.5 29.8 49 49 A A H <5S+ 0 0 44 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.875 120.4 34.7 -67.6 -38.6 34.4 17.6 27.5 50 50 A I H <5S- 0 0 37 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.693 103.8-123.6 -89.5 -29.0 37.3 16.3 29.5 51 51 A G T <5S+ 0 0 65 -4,-2.8 2,-0.3 -5,-0.3 -3,-0.2 0.842 76.2 71.5 90.4 28.2 36.0 17.1 33.0 52 52 A R S - 0 0 9 -2,-0.8 3,-1.1 -11,-0.2 -1,-0.2 0.682 34.0-144.7 -97.9 -27.6 42.8 21.8 31.0 55 55 A N T 3 S- 0 0 119 1,-0.2 -2,-0.1 -3,-0.1 3,-0.1 0.883 72.1 -59.4 60.9 33.2 44.1 25.1 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.503 115.8 98.7 75.0 12.4 43.9 23.8 26.1 57 57 A V B < +C 16 0B 69 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.987 45.9 178.2-127.5 141.9 46.2 20.8 26.5 58 58 A I - 0 0 4 -43,-2.3 2,-0.2 -2,-0.4 -30,-0.1 -0.812 27.3-108.0-132.9 172.8 45.2 17.2 27.0 59 59 A T > - 0 0 64 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.536 32.5-107.4 -96.1 171.9 47.0 13.9 27.3 60 60 A K H > S+ 0 0 105 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.917 121.1 53.9 -61.6 -41.0 47.1 11.2 24.7 61 61 A D H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.900 108.5 48.0 -58.7 -44.8 44.9 9.1 26.8 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.893 111.4 52.4 -65.5 -41.9 42.2 11.9 27.0 63 63 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -34,-0.4 0.920 109.5 48.8 -58.7 -45.7 42.5 12.3 23.2 64 64 A E H X S+ 0 0 70 -4,-2.9 4,-2.5 2,-0.2 5,-0.3 0.853 108.1 53.4 -62.5 -39.1 41.9 8.6 22.8 65 65 A K H X S+ 0 0 136 -4,-2.0 4,-2.4 -5,-0.2 5,-0.3 0.976 109.1 47.9 -66.9 -36.4 39.0 8.7 25.0 66 66 A L H X S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.928 111.4 54.2 -64.5 -38.0 37.3 11.5 23.0 67 67 A F H X S+ 0 0 14 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.930 106.8 48.4 -61.7 -46.9 38.2 9.5 19.9 68 68 A N H X S+ 0 0 88 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.924 112.1 49.8 -60.4 -39.6 36.4 6.4 21.1 69 69 A Q H X S+ 0 0 100 -4,-2.4 4,-2.7 -5,-0.3 -1,-0.2 0.934 111.1 49.8 -65.3 -41.2 33.4 8.4 22.0 70 70 A D H X S+ 0 0 34 -4,-2.4 4,-1.8 -5,-0.3 -2,-0.2 0.893 110.3 48.0 -66.8 -38.3 33.3 10.0 18.6 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.952 112.7 50.3 -64.5 -47.2 33.6 6.9 16.6 72 72 A D H X S+ 0 0 106 -4,-2.3 4,-2.5 -5,-0.3 5,-0.3 0.950 109.6 50.5 -53.9 -48.9 30.9 5.3 18.7 73 73 A A H X S+ 0 0 55 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.890 108.4 52.0 -60.0 -39.2 28.7 8.3 18.2 74 74 A A H X S+ 0 0 9 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.924 110.0 48.5 -63.8 -45.3 29.1 8.2 14.4 75 75 A V H X S+ 0 0 36 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.968 114.8 44.0 -57.8 -49.6 28.2 4.6 14.2 76 76 A R H X S+ 0 0 126 -4,-2.5 4,-1.9 1,-0.3 5,-0.2 0.904 109.8 56.7 -64.9 -39.4 25.1 5.0 16.3 77 77 A G H X S+ 0 0 1 -4,-2.7 4,-0.8 -5,-0.3 -1,-0.3 0.922 107.7 49.3 -56.3 -43.8 24.3 8.1 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.2 7,-0.4 0.970 109.6 51.5 -58.0 -48.3 24.3 6.1 11.2 79 79 A L H 3< S+ 0 0 61 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.735 111.2 46.5 -67.2 -27.7 22.1 3.4 12.6 80 80 A R H 3< S+ 0 0 163 -4,-1.9 2,-0.6 -5,-0.2 -1,-0.3 0.493 92.6 95.5 -86.4 -13.3 19.6 5.8 13.7 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.6 -7,-0.2 5,-0.3 0.815 100.0 66.2 -81.1 -43.1 22.0 6.2 6.3 85 85 A K H X S+ 0 0 84 -4,-3.2 4,-2.9 -7,-0.4 5,-0.2 0.912 98.5 51.3 -49.6 -49.5 21.1 2.9 7.9 86 86 A P H > S+ 0 0 53 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.912 111.8 49.6 -62.4 -30.8 20.0 1.1 4.8 87 87 A V H > S+ 0 0 1 -4,-0.5 4,-0.8 2,-0.2 -2,-0.2 0.958 111.5 46.1 -68.3 -54.0 23.1 2.0 3.0 88 88 A Y H >< S+ 0 0 34 -4,-2.6 3,-1.2 1,-0.2 -1,-0.2 0.924 110.8 54.5 -54.7 -43.1 25.4 0.9 5.8 89 89 A D H 3< S+ 0 0 72 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.888 105.9 53.3 -62.8 -33.9 23.5 -2.3 6.1 90 90 A S H 3< S+ 0 0 36 -4,-1.7 -1,-0.3 -5,-0.2 2,-0.2 0.640 97.8 87.3 -74.5 -16.6 23.9 -3.1 2.4 91 91 A L S << S- 0 0 7 -3,-1.2 31,-0.0 -4,-0.8 2,-0.0 -0.588 74.5-117.4 -90.8 160.7 27.7 -2.7 2.5 92 92 A D > - 0 0 57 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.217 44.2 -92.7 -77.9 172.6 30.7 -4.9 3.2 93 93 A A H > S+ 0 0 79 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.870 121.2 48.8 -58.8 -41.9 33.0 -4.2 6.2 94 94 A V H > S+ 0 0 24 1,-0.2 4,-1.6 62,-0.2 3,-0.3 0.957 113.6 45.4 -66.3 -48.0 35.6 -2.1 4.3 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.859 106.2 60.9 -65.2 -30.5 33.1 0.1 2.7 96 96 A R H X S+ 0 0 82 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.904 102.5 52.9 -60.7 -34.6 31.2 0.5 6.0 97 97 A A H X S+ 0 0 8 -4,-1.7 4,-2.6 -3,-0.3 -1,-0.2 0.909 105.3 54.3 -70.9 -33.5 34.3 2.0 7.5 98 98 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.879 108.4 48.8 -65.2 -39.3 34.5 4.5 4.6 99 99 A L H X S+ 0 0 1 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.878 109.7 51.8 -65.9 -39.0 31.0 5.6 5.4 100 100 A I H X S+ 0 0 10 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.953 107.8 53.3 -60.9 -44.5 31.8 6.0 9.1 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.3 -2,-0.2 0.952 108.6 48.8 -56.5 -45.8 34.8 8.1 8.2 102 102 A M H X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.2 5,-0.3 0.891 111.5 49.2 -65.4 -38.4 32.7 10.4 6.1 103 103 A V H X S+ 0 0 9 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.936 109.7 52.4 -65.7 -36.2 30.1 10.7 8.9 104 104 A F H < S+ 0 0 33 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.938 114.7 43.5 -63.1 -37.4 32.9 11.5 11.4 105 105 A Q H < S+ 0 0 55 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.911 132.3 14.2 -74.0 -46.0 34.2 14.2 9.1 106 106 A M H X S- 0 0 51 -4,-2.7 4,-0.8 -5,-0.2 -2,-0.2 0.384 102.2-112.9-117.2 -2.4 31.0 15.9 8.0 107 107 A G H X - 0 0 32 -4,-2.5 4,-2.3 -5,-0.3 5,-0.2 0.165 36.8 -78.2 76.1 151.9 28.2 14.8 10.3 108 108 A E H > S+ 0 0 66 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.735 129.1 53.8 -51.5 -43.3 25.2 12.7 9.5 109 109 A T H > S+ 0 0 121 2,-0.2 4,-1.2 3,-0.1 -1,-0.2 0.940 106.4 50.9 -62.4 -49.6 23.4 15.5 8.0 110 110 A G H >< S+ 0 0 31 -4,-0.8 3,-0.7 1,-0.2 -2,-0.2 0.939 115.5 42.4 -54.8 -51.8 26.2 16.3 5.6 111 111 A V H >< S+ 0 0 0 -4,-2.3 3,-2.7 1,-0.2 -1,-0.2 0.903 104.5 62.0 -64.0 -42.4 26.4 12.8 4.4 112 112 A A H 3< S+ 0 0 11 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.755 95.2 68.5 -56.8 -20.0 22.6 12.1 4.2 113 113 A G T << S+ 0 0 56 -4,-1.2 2,-1.5 -3,-0.7 3,-0.3 0.655 74.6 83.8 -71.8 -16.3 22.8 14.9 1.6 114 114 A F <> + 0 0 37 -3,-2.7 4,-3.3 1,-0.2 5,-0.4 -0.257 56.8 156.7 -84.8 54.4 24.7 12.8 -0.9 115 115 A T H > + 0 0 86 -2,-1.5 4,-1.7 1,-0.3 -1,-0.2 0.849 65.8 44.3 -45.7 -57.3 21.5 11.3 -2.0 116 116 A N H > S+ 0 0 89 -3,-0.3 4,-1.9 1,-0.2 -1,-0.3 0.886 114.4 47.5 -60.2 -45.0 22.5 10.3 -5.4 117 117 A S H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.880 109.8 55.7 -63.3 -41.7 25.8 8.8 -4.3 118 118 A L H X S+ 0 0 12 -4,-3.3 4,-2.4 1,-0.2 -1,-0.2 0.904 106.7 49.8 -57.6 -42.0 24.1 6.9 -1.5 119 119 A R H X S+ 0 0 126 -4,-1.7 4,-1.8 -5,-0.4 -1,-0.2 0.936 110.5 49.6 -64.4 -40.1 21.7 5.3 -3.9 120 120 A M H <>S+ 0 0 20 -4,-1.9 5,-2.3 1,-0.2 4,-0.5 0.877 109.9 50.9 -69.7 -34.8 24.5 4.2 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.935 108.1 51.0 -68.2 -43.3 26.4 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 87 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.878 110.8 51.2 -59.1 -30.9 23.4 0.8 -2.1 123 123 A Q T 3<5S- 0 0 82 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.496 112.5-123.4 -80.3 -10.1 23.1 -0.4 -5.7 124 124 A K T < 5 + 0 0 101 -3,-1.6 2,-1.2 -4,-0.5 -3,-0.2 0.768 61.2 145.9 68.6 31.0 26.7 -1.4 -5.8 125 125 A R >< + 0 0 105 -5,-2.3 4,-1.9 1,-0.2 -1,-0.2 -0.774 23.7 177.5 -95.1 81.4 27.5 0.7 -8.8 126 126 A W H > + 0 0 50 -2,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.881 69.5 41.4 -59.2 -51.2 31.1 1.5 -7.6 127 127 A D H > S+ 0 0 103 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.894 114.6 52.1 -68.8 -35.2 32.5 3.5 -10.4 128 128 A E H > S+ 0 0 109 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.911 110.4 48.2 -65.8 -41.4 29.5 5.5 -10.9 129 129 A A H X S+ 0 0 1 -4,-1.9 4,-3.1 2,-0.2 5,-0.3 0.917 108.5 55.3 -64.1 -35.5 29.3 6.3 -7.2 130 130 A A H X S+ 0 0 10 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.910 108.8 47.8 -66.2 -33.6 33.0 7.3 -7.3 131 131 A V H X S+ 0 0 90 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.928 113.0 47.5 -73.8 -44.9 32.3 9.7 -10.1 132 132 A N H >< S+ 0 0 39 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.891 107.1 56.1 -59.8 -43.4 29.3 11.2 -8.4 133 133 A L H 3< S+ 0 0 2 -4,-3.1 6,-0.4 1,-0.3 -1,-0.2 0.862 100.4 60.2 -61.3 -30.5 31.1 11.6 -5.0 134 134 A A H 3< S+ 0 0 27 -4,-1.1 2,-1.8 -5,-0.3 -1,-0.3 0.729 85.0 79.5 -73.9 -19.0 33.8 13.7 -6.5 135 135 A K S << S+ 0 0 162 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.499 81.1 95.2 -82.9 74.6 31.4 16.3 -7.7 136 136 A S S > S- 0 0 16 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.995 84.9-116.0-159.6 154.3 31.2 17.9 -4.3 137 137 A R H > S+ 0 0 146 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.917 114.2 64.1 -58.6 -40.6 32.6 20.6 -2.3 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.930 105.7 43.4 -47.8 -51.0 33.9 18.0 0.0 139 139 A Y H 4 S+ 0 0 50 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.909 113.3 50.9 -64.8 -44.1 36.2 16.6 -2.7 140 140 A N H < S+ 0 0 107 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.849 115.3 42.4 -66.9 -28.2 37.3 20.1 -3.9 141 141 A Q H < S+ 0 0 105 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.842 131.0 20.2 -86.2 -35.3 38.3 21.2 -0.4 142 142 A T S X S+ 0 0 23 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 -0.573 75.1 162.4-133.2 67.6 40.0 18.1 0.9 143 143 A P H > + 0 0 54 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.864 68.9 50.3 -58.1 -41.8 40.9 16.3 -2.2 144 144 A N H > S+ 0 0 117 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.949 115.0 42.8 -71.0 -40.4 43.5 13.9 -1.0 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.916 114.9 51.5 -65.3 -45.7 41.4 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 -8,-0.2 -2,-0.2 0.913 108.1 52.0 -56.0 -43.4 38.3 12.5 -0.4 147 147 A K H X S+ 0 0 98 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.880 106.6 54.4 -61.8 -39.2 40.4 10.4 -3.0 148 148 A R H X S+ 0 0 67 -4,-1.8 4,-1.7 -5,-0.2 12,-0.2 0.957 112.9 42.5 -56.6 -45.7 41.3 8.0 -0.3 149 149 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.873 112.2 52.7 -65.3 -45.6 37.7 7.5 0.6 150 150 A I H X S+ 0 0 18 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.910 109.1 49.6 -59.0 -40.0 36.5 7.3 -2.9 151 151 A T H X S+ 0 0 39 -4,-2.3 4,-2.4 1,-0.2 6,-0.4 0.841 109.7 53.2 -65.8 -38.1 39.1 4.6 -3.7 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.893 111.4 43.2 -63.1 -46.4 38.0 2.7 -0.8 153 153 A F H < S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.885 115.7 51.5 -65.7 -38.4 34.3 2.8 -1.9 154 154 A R H < S+ 0 0 103 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.912 124.3 23.3 -61.7 -46.4 35.4 2.0 -5.4 155 155 A T H < S- 0 0 45 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.577 84.6-135.6 -99.0 -26.4 37.5 -1.0 -4.5 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 1,-0.2 -62,-0.2 0.703 73.5 98.3 72.0 20.3 36.4 -2.4 -1.3 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.2 -0.802 80.3-118.1-130.4 175.2 40.0 -2.7 -0.1 158 158 A W S >> S+ 0 0 40 -2,-0.3 3,-2.6 1,-0.2 4,-0.7 0.114 70.6 123.0 -95.7 14.2 42.4 -0.6 2.0 159 159 A D G >4 + 0 0 99 1,-0.3 3,-1.2 2,-0.2 -1,-0.2 0.860 67.1 59.5 -52.4 -34.4 44.9 -0.0 -0.7 160 160 A A G 34 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.667 107.4 48.0 -65.6 -18.4 44.6 3.8 -0.4 161 161 A Y G <4 0 0 20 -3,-2.6 -1,-0.3 -13,-0.1 -2,-0.2 0.476 360.0 360.0-105.1 -1.2 45.7 3.6 3.2 162 162 A K << 0 0 177 -3,-1.2 -2,-0.2 -4,-0.7 -3,-0.1 0.790 360.0 360.0-100.3 360.0 48.7 1.2 2.7