==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-JUL-99 1QUH . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.WRAY,W.A.BAASE,J.D.LINDSTROM,A.R POTEETE,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8808.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 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 . 7 4.3 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 . 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 0 3 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 84 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 144.4 43.5 -1.9 9.3 2 2 A N > - 0 0 69 1,-0.0 4,-2.8 156,-0.0 5,-0.2 -0.942 360.0 -76.6-157.0 179.9 40.2 -0.7 10.7 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.8 1,-0.3 5,-0.3 0.840 124.6 52.4 -54.7 -42.4 38.1 2.4 11.2 4 4 A F H > S+ 0 0 73 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.939 113.0 41.0 -66.0 -43.4 40.2 3.6 14.1 5 5 A E H > S+ 0 0 87 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.933 113.6 57.1 -69.1 -31.0 43.5 3.4 12.3 6 6 A M H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.956 111.5 38.4 -62.5 -54.9 41.9 4.8 9.3 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 5,-0.4 0.820 109.9 61.9 -67.8 -29.1 40.7 7.9 10.9 8 8 A R H X S+ 0 0 106 -4,-2.1 4,-1.4 -5,-0.3 -2,-0.2 0.924 108.5 45.5 -64.2 -31.9 43.8 8.2 13.0 9 9 A I H < S+ 0 0 88 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.937 115.2 44.4 -74.0 -46.9 45.6 8.5 9.6 10 10 A D H < S+ 0 0 21 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.790 125.0 31.4 -67.6 -27.8 43.2 11.0 8.0 11 11 A E H < S- 0 0 49 -4,-2.2 19,-0.4 -5,-0.2 -1,-0.2 0.626 91.3-153.5-106.8 -20.4 42.9 13.2 11.0 12 12 A G < - 0 0 23 -4,-1.4 2,-0.4 -5,-0.4 -1,-0.1 -0.130 24.2 -85.1 72.1-176.2 46.2 13.0 12.8 13 13 A L + 0 0 47 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.979 43.2 168.2-139.3 122.6 46.7 13.6 16.5 14 14 A R E -A 28 0A 140 14,-1.6 14,-2.3 -2,-0.4 4,-0.1 -0.998 20.2-162.6-134.8 134.3 47.3 16.9 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.0 12,-0.2 2,-0.4 0.389 74.1 63.1 -96.5 -0.5 47.2 17.6 21.9 16 16 A K E S-C 57 0B 99 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.917 100.2 -88.0-121.6 146.8 46.8 21.3 21.9 17 17 A I E + 0 0 12 39,-1.6 2,-0.3 -2,-0.4 10,-0.2 -0.241 57.5 167.2 -48.5 139.7 43.8 23.2 20.5 18 18 A Y E -A 26 0A 31 8,-3.4 8,-3.3 -4,-0.1 2,-0.5 -0.883 37.3 -98.8-145.1-179.5 44.2 23.9 16.8 19 19 A K E -A 25 0A 128 -2,-0.3 6,-0.2 6,-0.2 2,-0.0 -0.888 34.0-139.9-104.5 132.3 42.2 25.0 13.7 20 20 A D > - 0 0 48 4,-2.7 3,-3.1 -2,-0.5 -1,-0.0 -0.197 42.8 -79.5 -78.5-172.3 41.0 22.4 11.3 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.650 135.7 50.7 -63.4 -20.0 41.0 22.8 7.5 22 22 A E T 3 S- 0 0 75 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.495 123.0-107.4 -97.0 -1.6 37.8 24.9 7.8 23 23 A G S < S+ 0 0 35 -3,-3.1 2,-0.3 1,-0.3 -2,-0.2 0.565 72.7 140.5 89.4 11.6 39.4 27.0 10.5 24 24 A Y - 0 0 78 1,-0.1 -4,-2.7 9,-0.0 2,-0.3 -0.668 60.2-100.5 -93.2 142.5 37.4 25.6 13.4 25 25 A Y E +AB 19 34A 33 9,-0.8 8,-3.1 11,-0.4 9,-1.4 -0.505 55.4 159.9 -65.2 126.6 38.8 24.9 16.9 26 26 A T E -AB 18 32A 2 -8,-3.3 -8,-3.4 -2,-0.3 2,-0.3 -0.884 19.5-167.4-136.9 169.9 39.6 21.3 17.3 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.3 -2,-0.3 -12,-0.2 -0.973 50.7 2.9-155.5 166.2 41.7 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.6 -2,-0.3 2,-1.1 -0.410 123.6 -5.0 66.2-130.2 42.9 15.4 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.618 129.5 -52.7 -98.6 71.9 42.0 13.2 16.7 30 30 A G T 4 S+ 0 0 15 -2,-1.1 2,-1.2 -19,-0.4 -2,-0.2 0.780 83.5 163.2 69.7 29.8 39.7 15.6 14.8 31 31 A H E < -B 27 0A 32 -4,-2.3 -4,-1.8 1,-0.0 -1,-0.2 -0.621 30.6-144.0 -86.8 102.2 37.5 16.4 17.8 32 32 A L E -B 26 0A 74 -2,-1.2 -6,-0.3 -6,-0.2 3,-0.1 -0.317 19.0-176.9 -61.7 127.8 35.7 19.5 16.8 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.887 56.4 -27.5 -95.9 -41.7 35.2 21.8 19.7 34 34 A T E -B 25 0A 29 -9,-1.4 -9,-0.8 2,-0.1 -1,-0.4 -0.932 36.2-135.5-167.9 150.6 33.2 24.7 18.4 35 35 A K S S+ 0 0 142 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.535 75.1 105.9 -88.7 -8.7 32.4 26.7 15.2 36 36 A S S S- 0 0 44 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.376 75.6-128.3 -75.2 153.3 32.7 29.9 17.0 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.448 75.4 106.5 -77.6 1.0 35.7 32.1 16.4 38 38 A S > - 0 0 48 1,-0.2 4,-2.0 2,-0.0 5,-0.2 -0.769 55.9-158.1 -95.4 121.0 36.4 32.5 20.1 39 39 A L H > S+ 0 0 65 -2,-0.7 4,-2.3 1,-0.3 5,-0.2 0.827 95.3 52.4 -56.2 -38.2 39.3 30.7 21.6 40 40 A N H > S+ 0 0 112 2,-0.2 4,-2.9 1,-0.2 -1,-0.3 0.874 103.9 55.5 -73.3 -35.4 37.8 30.9 25.1 41 41 A A H > S+ 0 0 37 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.935 109.9 48.6 -60.8 -36.4 34.6 29.5 23.9 42 42 A A H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.921 109.0 51.5 -66.7 -42.1 36.7 26.6 22.7 43 43 A K H X S+ 0 0 54 -4,-2.3 4,-2.1 2,-0.2 5,-0.3 0.921 109.0 51.7 -62.6 -35.0 38.5 26.3 25.9 44 44 A S H X S+ 0 0 71 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.954 109.7 48.9 -66.6 -43.2 35.2 26.2 27.7 45 45 A E H X S+ 0 0 65 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.913 110.0 53.1 -61.5 -38.4 34.0 23.4 25.4 46 46 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.932 108.0 47.7 -62.6 -46.7 37.2 21.5 26.0 47 47 A D H X>S+ 0 0 34 -4,-2.1 4,-3.2 1,-0.3 5,-1.2 0.925 111.4 52.5 -61.3 -43.9 37.0 21.5 29.8 48 48 A K H <5S+ 0 0 143 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.826 110.6 46.7 -62.1 -33.3 33.5 20.5 29.6 49 49 A A H <5S+ 0 0 46 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.884 120.0 38.3 -79.1 -32.9 34.3 17.6 27.4 50 50 A I H <5S- 0 0 34 -4,-2.7 -2,-0.2 2,-0.3 -3,-0.2 0.666 103.2-125.6 -82.8 -31.4 37.3 16.4 29.5 51 51 A G T <5S+ 0 0 67 -4,-3.2 2,-0.3 -5,-0.3 -3,-0.2 0.776 76.9 71.2 91.0 18.8 35.9 17.1 32.9 52 52 A R S - 0 0 9 -2,-0.9 3,-1.4 -11,-0.2 -1,-0.2 0.711 32.8-143.1 -94.1 -24.8 42.6 21.8 30.8 55 55 A N T 3 S- 0 0 118 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.819 70.8 -59.8 62.3 26.4 44.0 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 0.482 116.8 94.1 85.7 0.2 43.8 23.9 26.1 57 57 A V B < +C 16 0B 73 -3,-1.4 2,-0.3 -41,-0.2 -41,-0.2 -0.963 47.4 178.8-125.9 142.2 46.1 20.9 26.4 58 58 A I - 0 0 4 -43,-2.0 2,-0.2 -2,-0.4 -30,-0.1 -0.849 27.1-103.9-133.7 173.9 45.1 17.3 27.0 59 59 A T > - 0 0 61 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.535 31.6-108.5 -97.2 167.9 46.8 14.0 27.2 60 60 A K H > S+ 0 0 123 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.889 120.4 52.2 -59.8 -42.4 47.0 11.2 24.7 61 61 A D H > S+ 0 0 118 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.934 109.2 50.0 -57.5 -47.8 44.7 9.0 26.8 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.945 110.7 49.9 -59.2 -44.1 42.2 11.9 26.9 63 63 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -34,-0.4 0.945 110.4 50.6 -56.3 -46.5 42.4 12.3 23.1 64 64 A E H X S+ 0 0 71 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.842 107.9 53.1 -61.9 -31.9 41.9 8.6 22.7 65 65 A K H X S+ 0 0 141 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.960 109.3 47.1 -74.3 -44.3 38.8 8.8 24.9 66 66 A L H X S+ 0 0 4 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.909 111.3 54.2 -56.9 -42.2 37.2 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-2.5 4,-3.0 -5,-0.3 5,-0.3 0.952 106.3 50.5 -56.3 -51.5 38.0 9.6 19.7 68 68 A N H X S+ 0 0 87 -4,-2.3 4,-2.3 1,-0.3 -1,-0.2 0.923 111.7 47.9 -52.5 -46.1 36.3 6.5 21.0 69 69 A Q H X S+ 0 0 98 -4,-2.2 4,-2.4 1,-0.2 -1,-0.3 0.882 110.2 52.7 -63.4 -39.9 33.3 8.4 21.8 70 70 A D H X S+ 0 0 32 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.878 108.5 48.5 -66.9 -39.2 33.3 10.1 18.5 71 71 A V H X S+ 0 0 6 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.956 112.1 50.6 -64.7 -44.4 33.5 6.9 16.5 72 72 A D H X S+ 0 0 85 -4,-2.3 4,-2.5 -5,-0.3 -2,-0.2 0.944 109.2 50.5 -54.4 -46.1 30.7 5.6 18.5 73 73 A A H X S+ 0 0 45 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.875 107.4 53.7 -63.5 -38.5 28.6 8.6 18.0 74 74 A A H X S+ 0 0 9 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.950 109.2 47.5 -63.7 -43.8 29.1 8.5 14.3 75 75 A V H X S+ 0 0 33 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.944 112.3 50.0 -60.6 -43.5 28.0 5.0 14.0 76 76 A R H X S+ 0 0 105 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.2 0.898 106.8 53.8 -64.4 -35.8 25.0 5.7 16.1 77 77 A G H X S+ 0 0 10 -4,-2.7 4,-0.6 1,-0.2 -1,-0.2 0.885 110.3 50.3 -64.2 -35.4 24.1 8.7 14.0 78 78 A I H >< S+ 0 0 5 -4,-2.2 3,-1.8 -5,-0.2 7,-0.6 0.980 109.0 49.0 -63.9 -50.6 24.2 6.5 11.0 79 79 A L H 3< S+ 0 0 72 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.783 110.4 51.2 -64.0 -26.2 22.0 3.9 12.5 80 80 A R H 3< S+ 0 0 196 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.3 0.491 91.3 91.2 -86.0 -7.2 19.5 6.4 13.6 81 81 A N S+ 0 0 148 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.870 119.1 38.4 -83.7 -35.8 18.4 7.5 4.8 84 84 A L H > S+ 0 0 11 -6,-0.2 4,-2.8 -7,-0.2 3,-0.4 0.923 102.5 65.4 -79.7 -46.4 21.7 6.2 5.9 85 85 A K H X S+ 0 0 84 -4,-2.3 4,-3.0 -7,-0.6 5,-0.3 0.896 98.8 51.9 -44.0 -51.1 21.0 3.1 7.7 86 86 A P H > S+ 0 0 56 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.924 112.6 47.3 -59.3 -36.2 19.7 1.1 4.8 87 87 A V H X S+ 0 0 8 -4,-0.6 4,-0.7 -3,-0.4 -2,-0.2 0.934 111.6 49.4 -69.4 -47.6 22.7 1.9 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.8 3,-0.9 1,-0.2 -1,-0.2 0.883 107.9 53.6 -56.0 -47.8 25.0 1.1 5.6 89 89 A D H 3< S+ 0 0 70 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.830 105.0 57.3 -64.5 -23.5 23.4 -2.2 6.2 90 90 A S H 3< S+ 0 0 39 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.704 94.5 86.7 -78.8 -17.8 23.8 -3.1 2.7 91 91 A L S << S- 0 0 11 -3,-0.9 2,-0.1 -4,-0.7 31,-0.0 -0.468 76.4-111.2 -86.5 164.3 27.5 -2.7 2.6 92 92 A D > - 0 0 53 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.246 42.7 -97.9 -80.0 166.5 30.5 -4.9 3.3 93 93 A A H > S+ 0 0 78 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.855 119.2 50.6 -58.8 -41.5 32.8 -4.1 6.3 94 94 A V H > S+ 0 0 27 1,-0.2 4,-1.6 2,-0.2 3,-0.2 0.927 112.7 45.9 -65.7 -39.9 35.4 -2.2 4.5 95 95 A R H > S+ 0 0 27 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.859 104.7 62.5 -73.0 -28.5 33.0 0.0 2.8 96 96 A R H X S+ 0 0 80 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.882 101.2 53.5 -58.1 -36.9 31.2 0.6 6.1 97 97 A A H X S+ 0 0 6 -4,-1.4 4,-2.6 -3,-0.2 -1,-0.2 0.907 104.4 54.9 -65.6 -38.0 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 0.928 107.9 49.5 -60.8 -40.9 34.4 4.4 4.5 99 99 A G H X S+ 0 0 15 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.873 108.7 52.1 -67.5 -30.6 30.9 5.6 5.3 100 100 A I H X S+ 0 0 10 -4,-2.1 4,-3.9 2,-0.2 5,-0.3 0.944 105.2 55.5 -69.7 -42.3 31.8 6.1 8.9 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.928 107.7 49.3 -51.2 -51.2 34.8 8.2 8.0 102 102 A M H X S+ 0 0 3 -4,-2.0 4,-2.8 -5,-0.2 5,-0.3 0.951 111.9 47.6 -58.6 -44.5 32.7 10.5 6.0 103 103 A V H X S+ 0 0 11 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.924 110.4 52.8 -64.7 -37.8 30.1 10.9 8.7 104 104 A F H < S+ 0 0 30 -4,-3.9 -1,-0.2 1,-0.2 -2,-0.2 0.913 113.7 44.0 -59.3 -39.9 32.8 11.5 11.2 105 105 A Q H < S+ 0 0 55 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.855 132.2 13.1 -75.8 -41.6 34.2 14.2 9.1 106 106 A M H X S- 0 0 54 -4,-2.8 4,-0.7 -5,-0.3 -2,-0.2 0.476 98.6-114.0-124.3 7.6 31.1 16.0 8.1 107 107 A G H X - 0 0 29 -4,-2.9 4,-2.7 -5,-0.3 5,-0.2 0.021 34.1 -78.9 82.7 159.4 28.1 14.9 10.1 108 108 A V H > S+ 0 0 40 2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.885 130.7 51.2 -67.7 -49.6 24.9 13.1 9.4 109 109 A T H > S+ 0 0 129 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.950 110.7 56.0 -40.6 -58.8 23.3 16.0 7.9 110 110 A G H >< S+ 0 0 23 -4,-0.7 3,-0.9 1,-0.3 -2,-0.3 0.901 114.4 31.7 -42.1 -74.7 26.3 16.2 5.8 111 111 A V H >< S+ 0 0 10 -4,-2.7 3,-1.2 1,-0.2 -1,-0.3 0.799 107.9 74.3 -67.4 -21.7 26.5 12.8 4.3 112 112 A A H 3< S+ 0 0 22 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.715 88.5 57.1 -67.0 -17.5 22.6 12.5 4.3 113 113 A G T << S+ 0 0 64 -4,-1.1 2,-0.5 -3,-0.9 -1,-0.2 0.233 76.8 95.5-101.8 25.3 22.0 14.9 1.3 114 114 A F <> + 0 0 44 -3,-1.2 4,-3.0 1,-0.2 5,-0.3 -0.614 51.0 156.7 -99.2 48.5 24.3 12.9 -1.1 115 115 A T H > + 0 0 80 -2,-0.5 4,-2.9 1,-0.3 5,-0.2 0.910 63.4 47.6 -53.8 -49.3 21.2 11.2 -2.3 116 116 A N H > S+ 0 0 77 2,-0.2 4,-2.6 -3,-0.2 -1,-0.3 0.922 113.0 49.3 -61.8 -42.2 22.3 10.1 -5.7 117 117 A S H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.945 110.1 52.8 -60.2 -43.7 25.6 8.7 -4.3 118 118 A L H X S+ 0 0 23 -4,-3.0 4,-2.9 1,-0.2 5,-0.3 0.960 108.0 50.8 -55.6 -48.0 23.6 6.9 -1.7 119 119 A R H X S+ 0 0 122 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.942 110.7 48.1 -58.1 -47.2 21.5 5.4 -4.3 120 120 A M H X>S+ 0 0 36 -4,-2.6 5,-2.1 1,-0.2 4,-0.6 0.869 111.3 49.2 -63.1 -37.5 24.4 4.2 -6.3 121 121 A L H ><5S+ 0 0 7 -4,-2.9 3,-2.0 -5,-0.2 -1,-0.2 0.952 106.9 56.1 -68.8 -37.8 26.1 2.7 -3.4 122 122 A Q H 3<5S+ 0 0 96 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.928 109.4 47.6 -57.7 -35.3 23.0 0.9 -2.4 123 123 A Q H 3<5S- 0 0 92 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.583 111.5-122.3 -81.7 -9.3 23.0 -0.5 -5.8 124 124 A K T <<5 + 0 0 98 -3,-2.0 2,-1.5 -4,-0.6 3,-0.2 0.739 62.0 145.4 71.7 28.6 26.7 -1.5 -5.7 125 125 A R >< + 0 0 116 -5,-2.1 4,-2.5 1,-0.2 5,-0.2 -0.661 22.1 171.9 -91.9 75.0 27.5 0.5 -8.8 126 126 A W H > + 0 0 49 -2,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.880 66.4 48.7 -64.8 -46.0 31.0 1.4 -7.4 127 127 A D H > S+ 0 0 116 1,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.928 115.3 47.6 -59.8 -37.4 32.7 3.1 -10.3 128 128 A E H > S+ 0 0 119 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.945 110.3 50.3 -67.4 -45.4 29.6 5.3 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-3.7 1,-0.2 5,-0.3 0.934 107.2 57.3 -56.7 -42.5 29.3 6.2 -7.1 130 130 A A H X S+ 0 0 9 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.910 107.5 45.4 -57.7 -43.1 32.9 7.1 -7.2 131 131 A V H X S+ 0 0 93 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.902 113.8 49.6 -68.6 -38.1 32.4 9.6 -9.9 132 132 A N H >< S+ 0 0 38 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.960 106.6 54.0 -65.8 -42.8 29.4 11.1 -8.3 133 133 A L H 3< S+ 0 0 4 -4,-3.7 6,-0.3 1,-0.3 -1,-0.2 0.835 102.2 59.9 -60.8 -29.9 31.0 11.4 -4.9 134 134 A A H 3< S+ 0 0 28 -4,-1.1 2,-2.1 -5,-0.3 -1,-0.3 0.706 84.9 80.4 -70.2 -22.3 33.9 13.4 -6.5 135 135 A K S << S+ 0 0 161 -3,-1.4 2,-0.3 -4,-0.7 -1,-0.2 -0.499 81.4 99.0 -81.9 71.8 31.5 16.1 -7.8 136 136 A S S > S- 0 0 19 -2,-2.1 4,-2.0 1,-0.1 5,-0.2 -0.999 84.4-118.0-154.3 158.0 31.4 17.8 -4.3 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.889 113.4 63.9 -59.7 -41.0 32.7 20.5 -2.3 138 138 A W H > S+ 0 0 15 1,-0.3 4,-2.8 2,-0.2 8,-0.2 0.929 105.8 42.6 -44.8 -50.4 34.1 17.9 -0.0 139 139 A Y H 4 S+ 0 0 65 -6,-0.3 -1,-0.3 1,-0.2 -2,-0.2 0.891 113.9 50.3 -70.4 -40.7 36.3 16.6 -2.7 140 140 A N H < S+ 0 0 111 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.820 116.2 41.7 -70.0 -28.0 37.4 19.9 -3.9 141 141 A Q H < S+ 0 0 104 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.848 131.1 22.0 -86.4 -34.1 38.3 21.1 -0.5 142 142 A T S X S+ 0 0 20 -4,-2.8 4,-2.6 -5,-0.3 5,-0.3 -0.533 72.3 159.8-135.6 69.2 40.0 18.0 0.8 143 143 A P H > + 0 0 50 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.844 67.6 51.9 -59.4 -45.9 41.0 16.1 -2.2 144 144 A N H > S+ 0 0 108 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.915 116.5 41.6 -66.2 -35.5 43.7 13.8 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.945 113.7 51.6 -75.4 -42.1 41.5 12.5 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.6 1,-0.3 5,-0.3 0.939 107.9 54.4 -59.2 -41.3 38.4 12.3 -0.3 147 147 A K H X S+ 0 0 91 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.3 0.916 107.6 49.7 -57.0 -45.7 40.4 10.3 -2.8 148 148 A R H X S+ 0 0 71 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.934 114.8 44.4 -59.5 -40.0 41.4 7.9 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 3,-0.3 0.930 112.5 49.8 -72.0 -43.6 37.8 7.5 0.9 150 150 A I H X S+ 0 0 12 -4,-3.6 4,-2.8 1,-0.2 -1,-0.2 0.858 107.8 52.9 -63.6 -38.9 36.4 7.2 -2.5 151 151 A T H X S+ 0 0 29 -4,-2.6 4,-2.9 -5,-0.3 6,-0.4 0.818 106.2 56.5 -70.1 -15.3 38.9 4.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.0 4,-2.7 -3,-0.3 -1,-0.2 0.917 109.6 43.3 -72.6 -43.9 37.8 2.7 -0.6 153 153 A F H < S+ 0 0 8 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.865 116.4 49.8 -64.6 -39.8 34.3 2.7 -1.6 154 154 A R H < S+ 0 0 97 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.934 123.6 25.4 -64.9 -48.5 35.3 1.9 -5.1 155 155 A T H < S- 0 0 49 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.641 83.2-137.5 -96.1 -15.2 37.5 -1.0 -4.3 156 156 A G S < S+ 0 0 16 -4,-2.7 2,-0.3 1,-0.2 -62,-0.2 0.718 73.5 100.1 63.9 21.3 36.3 -2.5 -1.1 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.2 -0.800 80.3-120.6-129.6 174.1 40.0 -2.8 -0.0 158 158 A W S > S+ 0 0 53 -2,-0.3 3,-2.3 1,-0.2 4,-0.5 0.188 71.1 120.8 -98.6 20.5 42.4 -0.8 2.2 159 159 A D G > + 0 0 110 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.842 66.3 60.3 -57.6 -25.0 44.8 -0.1 -0.6 160 160 A A G 3 S+ 0 0 25 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.706 106.7 47.6 -74.6 -14.0 44.6 3.6 -0.3 161 161 A Y G < 0 0 14 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.429 360.0 360.0-104.3 1.4 45.7 3.4 3.3 162 162 A K < 0 0 192 -3,-1.3 -1,-0.2 -4,-0.5 -2,-0.1 0.166 360.0 360.0 112.8 360.0 48.7 1.0 2.3