==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-OCT-97 231L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.A.LIPSCOMB,D.L.DREW,N.GASSNER,W.A.BAASE,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8480.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 74.1 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 . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 53.7 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 0 1 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 78 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 155.1 43.5 -1.9 9.2 2 2 A N > - 0 0 65 1,-0.1 4,-3.1 156,-0.0 5,-0.2 -0.960 360.0 -69.9-166.0 177.7 40.3 -0.6 10.7 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-3.5 1,-0.2 5,-0.3 0.833 125.0 47.1 -44.3 -55.7 38.3 2.4 11.4 4 4 A F H > S+ 0 0 71 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.945 114.4 46.3 -57.8 -53.7 40.5 3.8 14.2 5 5 A E H > S+ 0 0 98 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.903 114.4 51.3 -56.6 -40.7 43.7 3.3 12.2 6 6 A M H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 3,-0.2 0.948 113.8 39.6 -60.6 -53.8 42.1 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-3.5 4,-3.4 1,-0.2 5,-0.3 0.894 109.6 60.9 -67.1 -33.0 40.8 7.9 10.9 8 8 A R H X S+ 0 0 107 -4,-3.0 4,-1.6 -5,-0.3 -1,-0.2 0.869 107.9 46.9 -59.9 -31.8 43.9 8.3 12.9 9 9 A I H < S+ 0 0 90 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.963 115.8 43.7 -74.7 -46.4 45.7 8.6 9.5 10 10 A D H < S+ 0 0 19 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.736 125.3 30.5 -69.2 -30.7 43.3 11.0 8.1 11 11 A E H < S- 0 0 49 -4,-3.4 19,-0.4 -5,-0.2 -1,-0.2 0.588 90.2-156.9-105.0 -16.0 42.9 13.2 11.1 12 12 A G < - 0 0 24 -4,-1.6 2,-0.4 -5,-0.3 -1,-0.1 -0.023 24.8 -83.9 65.6-168.8 46.3 13.0 12.9 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.972 39.6 172.6-139.9 123.6 46.9 13.7 16.5 14 14 A R E -A 28 0A 126 14,-1.5 14,-2.1 -2,-0.4 4,-0.1 -0.998 18.4-163.7-133.1 127.6 47.4 17.1 18.3 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.4 12,-0.1 2,-0.4 0.519 78.2 63.0 -82.4 -11.8 47.6 17.5 22.1 16 16 A K E S-C 57 0B 86 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.884 99.7 -91.8-117.4 144.1 47.1 21.2 21.8 17 17 A I E + 0 0 14 39,-1.6 2,-0.3 -2,-0.4 10,-0.2 -0.274 52.7 172.5 -57.1 140.3 44.1 23.0 20.4 18 18 A Y E -A 26 0A 28 8,-3.4 8,-3.9 -4,-0.1 2,-0.4 -0.837 34.8-105.3-141.0 174.6 44.3 23.8 16.8 19 19 A K E -A 25 0A 122 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.819 36.9-138.3-101.1 135.9 42.3 25.2 13.9 20 20 A D > - 0 0 46 4,-2.3 3,-2.0 -2,-0.4 -1,-0.1 -0.128 41.2 -77.3 -85.0-163.7 41.1 22.7 11.3 21 21 A T T 3 S+ 0 0 108 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.714 137.0 47.9 -65.4 -22.5 41.1 23.0 7.6 22 22 A E T 3 S- 0 0 84 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.329 123.0-105.7 -98.2 1.8 38.1 25.2 8.0 23 23 A G S < S+ 0 0 29 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.561 73.1 141.5 85.1 15.0 39.6 27.3 10.7 24 24 A Y - 0 0 76 1,-0.1 -4,-2.3 -5,-0.0 2,-0.4 -0.716 60.4 -98.9 -97.2 149.0 37.7 25.8 13.5 25 25 A Y E +AB 19 34A 32 9,-0.9 8,-3.3 11,-0.6 9,-1.3 -0.349 56.7 158.1 -63.4 117.4 38.9 24.9 16.9 26 26 A T E -AB 18 32A 5 -8,-3.9 -8,-3.4 -2,-0.4 2,-0.3 -0.855 18.4-167.5-138.4 166.2 39.7 21.3 17.2 27 27 A I E > - B 0 31A 0 4,-1.6 4,-2.3 -2,-0.3 2,-0.3 -0.993 47.6 -3.9-159.7 158.5 41.8 18.9 19.2 28 28 A G E 4 S+A 14 0A 0 -14,-2.1 -14,-1.5 -2,-0.3 2,-1.0 -0.430 123.2 0.9 62.3-117.5 43.2 15.4 19.5 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -2,-0.3 -17,-0.1 -0.576 129.4 -55.3-104.3 72.3 42.1 13.2 16.8 30 30 A G T 4 S+ 0 0 14 -2,-1.0 2,-1.0 -19,-0.4 -2,-0.2 0.750 85.7 161.7 68.5 21.7 39.9 15.5 14.7 31 31 A H E < -B 27 0A 31 -4,-2.3 -4,-1.6 1,-0.0 2,-0.3 -0.622 29.9-146.4 -81.4 101.2 37.8 16.3 17.8 32 32 A L E +B 26 0A 79 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.427 20.8 179.2 -68.2 125.7 35.9 19.5 16.9 33 33 A L E - 0 0 14 -8,-3.3 2,-0.3 -2,-0.3 -7,-0.2 0.901 56.9 -17.2 -93.4 -46.4 35.3 21.8 19.7 34 34 A T E -B 25 0A 25 -9,-1.3 -9,-0.9 2,-0.1 -1,-0.3 -0.965 31.0-143.9-165.5 148.8 33.5 24.7 18.2 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.668 76.9 102.8 -87.3 -15.0 32.5 26.7 15.2 36 36 A S S S- 0 0 48 1,-0.1 -11,-0.6 2,-0.1 -2,-0.1 -0.253 77.4-128.2 -67.7 158.2 32.8 29.8 17.1 37 37 A P S S+ 0 0 110 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.356 74.2 107.8 -86.3 -0.9 35.8 32.1 16.7 38 38 A S > - 0 0 42 1,-0.2 4,-2.8 -13,-0.0 5,-0.3 -0.719 53.4-161.2 -91.0 116.0 36.5 32.3 20.4 39 39 A L H > S+ 0 0 65 -2,-0.8 4,-2.9 1,-0.3 5,-0.2 0.884 95.6 56.5 -57.4 -29.5 39.5 30.6 21.7 40 40 A N H > S+ 0 0 116 2,-0.2 4,-3.8 1,-0.2 -1,-0.3 0.963 104.1 49.3 -68.2 -46.5 37.9 30.9 25.1 41 41 A A H > S+ 0 0 36 1,-0.3 4,-3.1 2,-0.2 5,-0.3 0.949 110.1 52.8 -56.3 -45.4 34.8 29.2 24.1 42 42 A A H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -1,-0.3 0.933 109.4 49.7 -56.6 -41.5 36.9 26.5 22.7 43 43 A K H X S+ 0 0 48 -4,-2.9 4,-2.9 -5,-0.3 5,-0.3 0.965 108.9 50.7 -64.2 -44.0 38.6 26.3 25.9 44 44 A S H X S+ 0 0 72 -4,-3.8 4,-2.9 1,-0.2 5,-0.3 0.983 110.9 50.2 -51.5 -56.6 35.3 26.1 27.8 45 45 A E H X S+ 0 0 69 -4,-3.1 4,-2.9 1,-0.3 5,-0.2 0.912 108.5 52.1 -48.9 -49.8 34.2 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.9 4,-3.1 -5,-0.3 5,-0.4 0.938 109.0 48.9 -55.0 -48.5 37.3 21.4 26.0 47 47 A D H X>S+ 0 0 33 -4,-2.9 4,-3.5 1,-0.3 5,-1.5 0.957 111.9 50.1 -55.5 -47.3 37.1 21.5 29.8 48 48 A K H <5S+ 0 0 145 -4,-2.9 -1,-0.3 -5,-0.3 -2,-0.2 0.917 112.7 45.8 -57.6 -46.1 33.7 20.4 29.6 49 49 A A H <5S+ 0 0 43 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.863 119.5 40.7 -69.0 -30.9 34.5 17.6 27.3 50 50 A I H <5S- 0 0 32 -4,-3.1 -2,-0.2 2,-0.3 -1,-0.2 0.728 105.1-121.8 -88.5 -26.4 37.5 16.5 29.3 51 51 A G T <5S+ 0 0 68 -4,-3.5 2,-0.3 -5,-0.4 -3,-0.2 0.769 77.8 54.0 92.5 21.5 36.1 16.9 32.7 52 52 A R S - 0 0 11 -2,-0.9 3,-0.6 -11,-0.2 -1,-0.2 0.856 34.3-143.6 -91.7 -36.0 42.9 21.8 30.7 55 55 A N T 3 S- 0 0 120 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.719 73.0 -55.7 73.4 27.6 44.3 25.1 29.7 56 56 A G T 3 S+ 0 0 0 1,-0.2 -39,-1.6 -13,-0.2 2,-0.4 0.460 118.5 98.5 87.2 -2.7 44.1 24.1 26.0 57 57 A V B < +C 16 0B 66 -3,-0.6 2,-0.3 -41,-0.2 -1,-0.2 -0.944 45.3 175.8-127.8 146.2 46.2 21.0 26.5 58 58 A I - 0 0 5 -43,-2.4 2,-0.2 -2,-0.4 -30,-0.1 -0.933 27.8-104.3-139.5 165.0 45.5 17.3 26.9 59 59 A T > - 0 0 62 -2,-0.3 4,-3.5 1,-0.1 5,-0.2 -0.453 31.2-114.8 -89.0 158.8 47.0 13.9 27.3 60 60 A K H > S+ 0 0 117 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.914 119.0 54.6 -50.9 -47.2 47.2 11.2 24.7 61 61 A D H > S+ 0 0 117 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.911 109.0 46.8 -54.5 -49.6 45.0 9.2 26.8 62 62 A E H > S+ 0 0 37 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.896 109.3 55.1 -60.7 -41.9 42.4 11.9 26.9 63 63 A A H X S+ 0 0 0 -4,-3.5 4,-2.3 1,-0.2 -34,-0.4 0.927 108.4 49.4 -55.9 -42.0 42.8 12.3 23.2 64 64 A E H X S+ 0 0 81 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.852 106.1 54.8 -67.5 -35.6 42.0 8.7 22.8 65 65 A K H X S+ 0 0 143 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.950 106.6 50.6 -62.8 -46.4 39.1 8.8 24.9 66 66 A L H X S+ 0 0 4 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.937 108.2 56.2 -52.5 -45.1 37.6 11.5 22.8 67 67 A F H X S+ 0 0 13 -4,-2.3 4,-3.6 1,-0.2 5,-0.3 0.899 106.5 45.9 -56.1 -46.7 38.3 9.4 19.8 68 68 A N H X S+ 0 0 84 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.948 111.3 52.4 -65.2 -40.4 36.4 6.4 20.9 69 69 A Q H X S+ 0 0 95 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.898 112.5 47.5 -60.5 -38.0 33.5 8.3 22.0 70 70 A D H X S+ 0 0 38 -4,-2.5 4,-2.6 -5,-0.3 -2,-0.2 0.947 110.3 48.5 -70.4 -42.5 33.5 9.9 18.6 71 71 A V H X S+ 0 0 7 -4,-3.6 4,-2.4 1,-0.2 5,-0.2 0.976 112.6 52.2 -61.4 -44.1 33.8 6.8 16.6 72 72 A D H X S+ 0 0 84 -4,-3.1 4,-2.6 -5,-0.3 5,-0.2 0.949 109.6 46.6 -52.0 -51.0 31.1 5.4 18.7 73 73 A A H X S+ 0 0 44 -4,-2.3 4,-3.6 -5,-0.3 5,-0.3 0.969 107.1 57.0 -59.1 -52.0 28.8 8.3 18.1 74 74 A A H X S+ 0 0 11 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.907 108.5 48.4 -46.4 -50.4 29.4 8.3 14.3 75 75 A V H X S+ 0 0 27 -4,-2.4 4,-3.5 1,-0.2 -1,-0.3 0.941 112.2 48.4 -56.6 -48.7 28.3 4.8 14.1 76 76 A R H X S+ 0 0 121 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.889 107.1 52.3 -61.6 -42.0 25.3 5.4 16.0 77 77 A G H >X S+ 0 0 5 -4,-3.6 4,-1.4 1,-0.2 3,-0.9 0.980 111.5 51.1 -58.8 -43.1 24.2 8.5 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.4 3,-1.1 -5,-0.3 7,-0.4 0.948 109.1 49.9 -53.6 -52.6 24.6 6.2 11.1 79 79 A L H 3< S+ 0 0 74 -4,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.715 114.3 45.5 -61.6 -19.4 22.5 3.6 12.7 80 80 A R H << S+ 0 0 176 -4,-1.7 2,-0.5 -3,-0.9 -1,-0.3 0.537 89.1 98.7 -98.5 -13.8 19.8 6.1 13.6 81 81 A N S+ 0 0 97 2,-0.1 4,-0.7 3,-0.1 -1,-0.2 0.745 118.1 45.4-104.2 -29.5 18.9 7.4 5.0 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.7 1,-0.2 5,-0.4 0.898 98.9 68.0 -79.7 -43.0 22.2 6.1 6.3 85 85 A K H X S+ 0 0 93 -4,-3.1 4,-2.6 -7,-0.4 5,-0.2 0.884 99.1 47.8 -44.3 -53.1 21.1 2.9 7.8 86 86 A P H > S+ 0 0 49 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.917 112.2 49.8 -62.0 -40.2 20.1 1.1 4.8 87 87 A V H X S+ 0 0 0 -4,-0.7 4,-0.9 -3,-0.3 -2,-0.2 0.970 112.3 44.9 -63.1 -52.2 23.2 2.0 3.0 88 88 A Y H >< S+ 0 0 29 -4,-2.7 3,-1.4 1,-0.3 -1,-0.2 0.928 109.5 57.6 -57.3 -42.2 25.5 1.0 5.6 89 89 A D H 3< S+ 0 0 71 -4,-2.6 -1,-0.3 -5,-0.4 -2,-0.2 0.865 106.5 48.6 -60.3 -35.8 23.6 -2.1 6.2 90 90 A S H 3< S+ 0 0 43 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.599 96.1 96.3 -82.9 -4.6 24.1 -3.2 2.6 91 91 A L S << S- 0 0 6 -3,-1.4 2,-0.1 -4,-0.9 31,-0.0 -0.504 73.7-119.9 -85.8 160.7 27.8 -2.5 2.6 92 92 A D > - 0 0 58 -2,-0.1 4,-1.7 1,-0.1 5,-0.2 -0.330 43.8 -92.9 -80.2 171.5 30.7 -4.9 3.2 93 93 A A H > S+ 0 0 83 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.799 120.5 49.0 -56.5 -40.6 33.0 -4.2 6.2 94 94 A V H > S+ 0 0 25 1,-0.2 4,-1.5 2,-0.2 3,-0.5 0.949 111.1 49.8 -69.1 -45.9 35.7 -2.2 4.4 95 95 A R H > S+ 0 0 24 1,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.834 104.2 59.1 -66.2 -27.1 33.3 0.0 2.8 96 96 A R H X S+ 0 0 76 -4,-1.7 4,-3.3 1,-0.3 -1,-0.3 0.913 98.9 59.0 -67.4 -34.8 31.4 0.7 6.0 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.4 -3,-0.5 -1,-0.3 0.920 103.3 53.0 -59.8 -39.8 34.5 2.1 7.4 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -1,-0.3 0.897 108.1 48.0 -60.5 -41.9 34.5 4.5 4.6 99 99 A L H X S+ 0 0 1 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.937 110.4 53.2 -64.8 -42.4 30.9 5.7 5.3 100 100 A I H X S+ 0 0 10 -4,-3.3 4,-2.9 1,-0.2 5,-0.2 0.934 105.9 54.8 -57.6 -40.9 31.8 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.916 109.0 46.6 -56.5 -47.3 34.9 8.2 7.9 102 102 A M H X S+ 0 0 5 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.947 112.0 50.2 -62.0 -46.8 32.8 10.6 6.1 103 103 A V H X S+ 0 0 9 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.912 110.0 51.0 -59.0 -38.8 30.2 10.8 8.9 104 104 A F H < S+ 0 0 32 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.879 115.8 41.8 -64.3 -40.0 32.9 11.5 11.3 105 105 A Q H < S+ 0 0 53 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.775 131.7 16.7 -80.4 -31.3 34.3 14.2 9.2 106 106 A K H X S- 0 0 64 -4,-2.7 4,-0.6 -5,-0.2 -3,-0.2 0.471 102.2-105.6-128.2 -1.1 31.1 15.9 8.1 107 107 A G H X - 0 0 26 -4,-2.5 4,-3.1 -5,-0.3 5,-0.2 0.196 31.2 -87.7 90.6 145.8 28.2 14.9 10.1 108 108 A E H > S+ 0 0 53 1,-0.2 4,-4.2 2,-0.2 -1,-0.1 0.838 129.0 49.0 -58.0 -41.2 25.2 12.7 9.6 109 109 A T H > S+ 0 0 109 2,-0.2 4,-1.9 3,-0.2 -1,-0.2 0.971 108.2 51.7 -66.4 -56.2 23.4 15.4 8.1 110 110 A G H >< S+ 0 0 29 -4,-0.6 3,-0.8 1,-0.2 -2,-0.2 0.958 120.0 36.4 -46.2 -54.5 26.2 16.4 5.8 111 111 A V H >< S+ 0 0 1 -4,-3.1 3,-3.0 1,-0.3 -1,-0.2 0.931 103.1 68.6 -66.2 -42.9 26.4 12.9 4.7 112 112 A A H 3< S+ 0 0 10 -4,-4.2 -1,-0.3 1,-0.3 -2,-0.2 0.834 96.1 64.9 -46.2 -29.6 22.7 12.2 4.8 113 113 A G T << S+ 0 0 52 -4,-1.9 2,-0.7 -3,-0.8 3,-0.3 0.469 70.9 87.5 -72.0 -11.7 22.8 14.8 1.9 114 114 A F <> + 0 0 36 -3,-3.0 4,-3.2 1,-0.2 3,-0.4 -0.163 53.9 158.5 -85.7 48.2 24.8 12.8 -0.8 115 115 A T H > + 0 0 70 -2,-0.7 4,-3.2 1,-0.3 -1,-0.2 0.813 65.1 46.3 -30.1 -58.8 21.5 11.3 -1.9 116 116 A N H > S+ 0 0 82 -3,-0.3 4,-2.6 1,-0.2 -1,-0.3 0.924 115.6 41.8 -63.1 -47.4 22.7 10.3 -5.3 117 117 A S H > S+ 0 0 1 -3,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.852 113.2 55.6 -73.6 -22.6 25.9 8.8 -4.4 118 118 A L H X S+ 0 0 11 -4,-3.2 4,-2.5 2,-0.2 -2,-0.2 0.922 107.5 49.8 -69.3 -40.5 24.2 7.1 -1.5 119 119 A R H X S+ 0 0 111 -4,-3.2 4,-2.1 -5,-0.4 -2,-0.2 0.956 110.4 51.0 -59.5 -40.5 21.8 5.7 -3.9 120 120 A M H <>S+ 0 0 25 -4,-2.6 5,-2.4 1,-0.2 4,-0.5 0.918 106.3 52.2 -63.2 -44.7 24.7 4.5 -6.0 121 121 A L H ><5S+ 0 0 4 -4,-2.8 3,-1.9 1,-0.2 -1,-0.2 0.947 106.5 56.7 -58.9 -41.0 26.5 2.9 -3.2 122 122 A Q H 3<5S+ 0 0 96 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.925 108.9 44.1 -55.2 -46.5 23.2 1.0 -2.5 123 123 A Q T 3<5S- 0 0 86 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.472 115.7-117.7 -80.9 5.8 23.1 -0.4 -5.9 124 124 A K T < 5 + 0 0 95 -3,-1.9 2,-1.1 -4,-0.5 -3,-0.2 0.845 58.9 155.6 65.6 37.8 26.7 -1.2 -5.7 125 125 A R >< + 0 0 101 -5,-2.4 4,-3.8 1,-0.2 5,-0.2 -0.617 13.5 173.1 -98.3 70.6 27.7 1.1 -8.6 126 126 A W H > S+ 0 0 52 -2,-1.1 4,-2.5 1,-0.2 5,-0.2 0.901 71.1 42.0 -44.3 -62.5 31.3 1.7 -7.5 127 127 A D H > S+ 0 0 116 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.954 117.4 47.5 -60.5 -43.8 32.7 3.5 -10.3 128 128 A E H > S+ 0 0 110 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.926 110.7 51.7 -66.8 -40.3 29.7 5.7 -10.8 129 129 A A H X S+ 0 0 1 -4,-3.8 4,-3.9 2,-0.2 5,-0.3 0.944 106.6 53.9 -57.9 -46.1 29.5 6.5 -7.2 130 130 A A H X S+ 0 0 10 -4,-2.5 4,-1.6 1,-0.3 -2,-0.2 0.935 110.5 46.8 -58.3 -41.7 33.2 7.5 -7.1 131 131 A V H X S+ 0 0 93 -4,-2.2 4,-0.8 -5,-0.2 -1,-0.3 0.949 113.6 48.7 -64.7 -44.7 32.7 9.9 -9.8 132 132 A N H >< S+ 0 0 36 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.939 108.5 52.2 -59.1 -48.2 29.6 11.2 -8.1 133 133 A L H 3< S+ 0 0 2 -4,-3.9 6,-0.3 1,-0.3 -1,-0.2 0.843 101.8 63.3 -60.3 -28.5 31.2 11.6 -4.8 134 134 A A H 3< S+ 0 0 25 -4,-1.6 2,-2.0 -5,-0.3 -1,-0.3 0.740 83.7 76.9 -69.2 -24.5 34.0 13.6 -6.5 135 135 A K S << S+ 0 0 168 -3,-1.3 2,-0.4 -4,-0.8 -1,-0.2 -0.513 80.6 106.3 -83.9 70.2 31.7 16.4 -7.5 136 136 A S S > S- 0 0 14 -2,-2.0 4,-2.4 1,-0.1 5,-0.2 -0.996 80.4-122.7-153.3 156.3 31.5 17.9 -4.1 137 137 A R H > S+ 0 0 154 -2,-0.4 4,-2.1 1,-0.2 5,-0.2 0.868 114.9 61.2 -58.3 -41.3 32.6 20.7 -2.1 138 138 A W H > S+ 0 0 12 2,-0.2 4,-1.9 1,-0.2 8,-0.2 0.907 106.2 42.7 -52.5 -45.7 34.0 18.1 0.1 139 139 A Y H 4 S+ 0 0 60 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.942 113.6 52.6 -68.2 -43.8 36.3 16.7 -2.5 140 140 A N H < S+ 0 0 106 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.788 113.3 42.6 -62.9 -32.1 37.3 20.1 -3.7 141 141 A Q H < S+ 0 0 104 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.767 130.8 22.9 -87.3 -29.3 38.3 21.3 -0.2 142 142 A T S X S+ 0 0 23 -4,-1.9 4,-2.7 -5,-0.2 5,-0.3 -0.543 71.3 165.1-136.5 63.6 40.1 18.1 0.9 143 143 A P H > S+ 0 0 51 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.913 70.6 49.7 -46.3 -53.8 41.1 16.4 -2.2 144 144 A N H > S+ 0 0 97 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.942 115.9 40.1 -61.2 -44.0 43.7 13.9 -0.7 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.4 1,-0.2 3,-0.5 0.981 113.7 52.9 -69.0 -50.3 41.6 12.6 2.0 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.3 5,-0.3 0.948 106.7 57.1 -48.7 -46.7 38.5 12.5 -0.2 147 147 A K H X S+ 0 0 97 -4,-3.5 4,-3.3 -5,-0.3 5,-0.3 0.874 104.9 49.7 -52.6 -44.4 40.6 10.5 -2.6 148 148 A R H X S+ 0 0 71 -4,-1.7 4,-2.5 -3,-0.5 -1,-0.2 0.983 113.8 44.8 -60.7 -50.7 41.4 7.9 -0.0 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.908 114.0 49.0 -57.8 -43.8 37.8 7.5 1.0 150 150 A I H X S+ 0 0 13 -4,-3.0 4,-2.7 -5,-0.3 -1,-0.2 0.925 110.5 50.2 -64.1 -43.8 36.6 7.4 -2.5 151 151 A T H X S+ 0 0 33 -4,-3.3 4,-2.9 -5,-0.3 6,-0.4 0.875 109.8 53.5 -60.3 -36.1 39.1 4.9 -3.5 152 152 A T H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.3 5,-0.4 0.943 108.9 45.2 -64.0 -46.2 38.0 3.0 -0.6 153 153 A F H < S+ 0 0 2 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.879 114.0 54.4 -61.7 -37.2 34.4 3.0 -1.7 154 154 A R H < S+ 0 0 91 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.954 120.9 22.2 -63.4 -52.8 35.5 2.1 -5.1 155 155 A T H < S- 0 0 48 -4,-2.9 -2,-0.2 2,-0.2 -1,-0.2 0.465 85.9-129.8 -97.6 -11.4 37.6 -1.0 -4.4 156 156 A G S < S+ 0 0 17 -4,-2.2 2,-0.2 -5,-0.3 -62,-0.2 0.777 77.1 103.1 67.4 16.1 36.4 -2.4 -1.1 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.4 -1,-0.2 -0.833 77.3-122.8-129.5 170.5 40.1 -2.5 -0.1 158 158 A W S >> S+ 0 0 44 -2,-0.2 3,-2.0 1,-0.2 4,-0.5 0.175 71.7 115.9 -95.8 14.0 42.6 -0.6 2.1 159 159 A D G >4 + 0 0 90 1,-0.3 3,-2.1 2,-0.2 -1,-0.2 0.880 68.1 61.5 -53.6 -37.1 45.1 0.2 -0.6 160 160 A A G 34 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.743 110.0 43.7 -59.4 -24.5 44.6 3.9 -0.4 161 161 A Y G <4 0 0 21 -3,-2.0 -1,-0.3 -13,-0.1 -2,-0.2 0.340 360.0 360.0-101.3 -0.0 45.8 3.6 3.1 162 162 A K << 0 0 167 -3,-2.1 -2,-0.2 -4,-0.5 -3,-0.1 0.804 360.0 360.0-104.9 360.0 48.7 1.2 2.3