==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 28-MAY-93 123L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.BLABER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8614.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 73.5 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 74 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.7 43.5 -1.7 9.1 2 2 A N > - 0 0 68 156,-0.0 4,-2.3 1,-0.0 3,-0.2 -0.905 360.0 -82.0-151.9 175.0 40.2 -0.8 10.9 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.839 125.8 51.7 -52.9 -41.1 38.0 2.3 11.3 4 4 A F H > S+ 0 0 79 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 112.8 43.3 -65.6 -46.6 40.2 3.7 14.2 5 5 A E H > S+ 0 0 91 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.842 114.0 53.1 -68.4 -32.3 43.5 3.4 12.2 6 6 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 3,-0.2 0.966 113.1 41.3 -66.1 -53.5 41.8 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.4 0.861 110.1 58.5 -64.1 -32.8 40.5 7.9 11.0 8 8 A R H X S+ 0 0 102 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.2 0.905 109.1 45.7 -64.4 -35.3 43.8 8.3 12.9 9 9 A I H < S+ 0 0 84 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.942 116.9 44.7 -70.2 -44.7 45.6 8.5 9.5 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.858 125.2 29.8 -67.8 -37.7 43.0 11.0 8.1 11 11 A E H < S- 0 0 44 -4,-3.0 19,-0.3 -5,-0.2 -1,-0.2 0.712 90.4-153.5 -97.9 -25.2 42.7 13.2 11.2 12 12 A G < - 0 0 23 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.2 -0.270 26.3 -88.8 75.3-169.8 46.2 13.0 12.8 13 13 A L + 0 0 39 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.961 41.9 174.4-143.3 124.9 46.6 13.6 16.5 14 14 A R E -A 28 0A 141 14,-1.5 14,-2.2 -2,-0.4 4,-0.1 -1.000 17.2-163.8-131.9 133.1 47.1 17.0 18.2 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.1 12,-0.2 2,-0.3 0.420 73.9 62.1 -99.1 0.7 47.2 17.5 21.9 16 16 A K E S-C 57 0B 155 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.907 102.4 -85.5-121.4 148.2 46.8 21.3 21.9 17 17 A I E + 0 0 20 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.260 59.3 169.8 -51.6 140.2 43.7 23.2 20.5 18 18 A Y E -A 26 0A 27 8,-2.9 8,-3.1 -4,-0.1 2,-0.5 -0.895 35.7-103.5-144.0 173.6 44.1 23.8 16.7 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.883 33.5-136.2-104.1 136.0 42.1 25.0 13.8 20 20 A D > - 0 0 48 4,-3.1 3,-1.6 -2,-0.5 -1,-0.1 -0.034 42.3 -80.5 -74.3-172.8 40.7 22.4 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.736 134.4 50.2 -60.8 -23.8 40.8 22.7 7.5 22 22 A E T 3 S- 0 0 74 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.347 123.8-102.9 -95.6 -0.7 37.6 24.9 7.9 23 23 A G S < S+ 0 0 38 -3,-1.6 2,-0.3 1,-0.3 -2,-0.1 0.587 75.2 141.1 90.5 12.0 39.1 27.2 10.5 24 24 A Y - 0 0 78 1,-0.1 -4,-3.1 -5,-0.0 -1,-0.3 -0.705 59.7-102.9 -95.3 144.3 37.3 25.6 13.5 25 25 A Y E +AB 19 34A 36 9,-0.6 8,-3.0 11,-0.4 9,-1.2 -0.400 53.5 161.8 -61.8 127.2 38.7 24.9 16.9 26 26 A T E -AB 18 32A 2 -8,-3.1 -8,-2.9 6,-0.3 2,-0.3 -0.854 19.2-167.7-141.2 164.7 39.5 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-1.9 -2,-0.3 -12,-0.2 -0.977 52.0 0.3-151.4 160.6 41.6 19.0 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.2 -14,-1.5 -2,-0.3 2,-0.9 -0.381 121.9 -6.1 69.4-132.0 42.9 15.4 19.6 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.635 128.1 -51.2 -98.9 71.6 41.9 13.2 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-0.9 -19,-0.3 -2,-0.2 0.756 84.4 159.4 74.3 20.2 39.5 15.3 14.8 31 31 A H E < -B 27 0A 31 -4,-1.9 -4,-1.5 1,-0.0 -1,-0.2 -0.654 33.9-142.7 -83.9 102.7 37.3 16.3 17.8 32 32 A L E -B 26 0A 71 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.432 19.5-176.9 -66.9 130.3 35.5 19.5 16.8 33 33 A L E - 0 0 15 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.915 58.3 -28.6 -91.8 -52.3 35.1 21.8 19.8 34 34 A T E -B 25 0A 27 -9,-1.2 -9,-0.6 2,-0.1 -1,-0.4 -0.969 35.5-138.8-159.8 154.6 33.1 24.7 18.5 35 35 A K S S+ 0 0 136 -2,-0.3 7,-0.0 -11,-0.2 -1,-0.0 0.413 74.0 112.5 -95.6 -3.3 32.5 26.6 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.451 74.5-129.8 -72.9 145.2 32.6 29.8 17.2 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.597 76.9 105.3 -67.5 -9.5 35.5 32.1 16.6 38 38 A S > - 0 0 50 1,-0.2 4,-1.4 2,-0.1 -2,-0.1 -0.653 54.6-162.7 -86.2 126.6 36.2 32.4 20.3 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.809 96.5 54.1 -68.7 -27.1 39.2 30.6 21.7 40 40 A N H > S+ 0 0 121 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.876 103.6 53.1 -75.4 -33.4 37.7 31.0 25.1 41 41 A A H > S+ 0 0 35 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.837 110.7 49.8 -66.7 -28.9 34.5 29.4 24.0 42 42 A A H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 -2,-0.2 0.903 108.6 50.2 -75.6 -42.4 36.7 26.4 22.7 43 43 A K H X S+ 0 0 54 -4,-2.3 4,-2.3 1,-0.2 11,-0.3 0.907 112.0 50.1 -63.0 -36.0 38.6 26.1 26.0 44 44 A S H X S+ 0 0 70 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.914 110.8 46.9 -69.4 -40.5 35.3 26.1 27.8 45 45 A E H X S+ 0 0 69 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.921 112.9 53.4 -65.7 -41.3 33.9 23.3 25.5 46 46 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 5,-0.3 0.904 108.0 46.3 -59.4 -46.6 37.1 21.4 26.0 47 47 A D H X>S+ 0 0 33 -4,-2.3 4,-2.5 1,-0.2 5,-0.8 0.881 113.0 50.9 -66.9 -35.1 37.0 21.5 29.8 48 48 A K H <5S+ 0 0 141 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.881 110.9 48.6 -67.3 -37.6 33.4 20.4 29.7 49 49 A A H <5S+ 0 0 44 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 120.9 35.7 -69.2 -39.4 34.3 17.5 27.4 50 50 A I H <5S- 0 0 35 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.741 100.1-126.8 -88.5 -30.1 37.2 16.4 29.6 51 51 A G T <5S+ 0 0 69 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.756 77.6 72.3 88.4 22.4 35.9 17.0 33.0 52 52 A R S - 0 0 9 -2,-0.8 3,-1.6 -11,-0.3 -1,-0.2 0.673 31.0-145.3 -98.4 -19.0 42.6 21.9 30.8 55 55 A N T 3 S- 0 0 117 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.841 75.2 -58.1 54.6 33.2 44.0 25.2 29.8 56 56 A G T 3 S+ 0 0 6 -13,-0.2 -39,-1.5 1,-0.2 2,-0.4 0.509 116.2 99.0 78.3 6.6 43.8 23.9 26.2 57 57 A V B < +C 16 0B 75 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.983 44.5 179.0-128.1 139.0 46.0 20.9 26.5 58 58 A I - 0 0 4 -43,-2.1 2,-0.2 -2,-0.4 -30,-0.1 -0.829 25.8-111.0-128.7 169.1 45.1 17.2 26.9 59 59 A T > - 0 0 66 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.497 33.7-103.0 -93.7 169.9 46.9 14.0 27.2 60 60 A K H > S+ 0 0 106 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.913 122.2 51.3 -56.9 -47.0 47.1 11.1 24.8 61 61 A D H > S+ 0 0 123 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.854 109.2 50.4 -57.2 -44.3 44.6 9.0 26.9 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.888 110.8 49.4 -65.3 -40.5 42.2 11.9 27.0 63 63 A A H X S+ 0 0 1 -4,-2.2 4,-2.1 1,-0.2 -34,-0.4 0.931 112.2 48.6 -61.7 -46.0 42.4 12.3 23.1 64 64 A E H X S+ 0 0 77 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.813 108.0 54.6 -65.5 -29.6 41.8 8.6 22.6 65 65 A K H X S+ 0 0 131 -4,-1.4 4,-2.1 -5,-0.2 -2,-0.2 0.949 109.2 46.0 -72.5 -41.4 38.9 8.7 24.9 66 66 A L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.902 112.0 54.8 -62.7 -35.8 37.2 11.4 23.0 67 67 A F H X S+ 0 0 12 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.925 105.5 50.2 -65.2 -45.5 38.0 9.5 19.8 68 68 A N H X S+ 0 0 88 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.915 112.1 48.5 -60.7 -40.5 36.4 6.4 21.1 69 69 A Q H X S+ 0 0 93 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.905 111.1 50.0 -66.0 -39.3 33.2 8.4 21.9 70 70 A D H X S+ 0 0 36 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.874 110.8 48.0 -67.7 -37.8 33.1 10.1 18.5 71 71 A V H X S+ 0 0 7 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.953 113.8 48.2 -65.6 -48.8 33.5 6.8 16.6 72 72 A D H X S+ 0 0 88 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.922 112.8 48.4 -57.8 -46.6 30.8 5.2 18.7 73 73 A A H X S+ 0 0 44 -4,-2.7 4,-2.8 -5,-0.2 -1,-0.2 0.920 109.3 52.0 -63.5 -40.3 28.6 8.2 18.2 74 74 A A H X S+ 0 0 11 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.954 112.3 46.5 -59.3 -50.0 29.2 8.2 14.4 75 75 A V H X S+ 0 0 31 -4,-2.6 4,-2.4 2,-0.2 3,-0.2 0.952 114.3 47.1 -53.9 -54.2 28.2 4.5 14.2 76 76 A R H X S+ 0 0 108 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.896 110.4 52.6 -57.7 -41.4 25.1 5.0 16.4 77 77 A G H X S+ 0 0 3 -4,-2.8 4,-0.6 -5,-0.2 -1,-0.2 0.865 108.6 50.7 -65.0 -36.2 24.0 8.1 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-0.9 -3,-0.2 7,-0.4 0.944 111.1 48.7 -64.4 -45.1 24.3 6.1 11.1 79 79 A L H 3< S+ 0 0 66 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.746 112.9 46.8 -70.9 -19.3 22.1 3.3 12.6 80 80 A R H 3< S+ 0 0 177 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.3 0.496 92.8 96.4 -93.2 -10.9 19.5 5.8 13.8 81 81 A N S+ 0 0 114 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.761 119.9 39.6 -88.0 -36.2 18.7 7.4 5.1 84 84 A L H > S+ 0 0 0 -6,-0.2 4,-2.6 -7,-0.2 5,-0.3 0.838 101.7 68.6 -83.6 -39.8 22.0 6.1 6.2 85 85 A K H X S+ 0 0 79 -4,-2.7 4,-2.7 -7,-0.4 5,-0.2 0.904 99.2 48.2 -48.9 -52.6 21.0 2.9 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.867 113.3 49.8 -61.8 -32.5 19.9 1.0 4.7 87 87 A V H >X S+ 0 0 3 -4,-0.5 4,-1.1 -3,-0.2 3,-0.5 0.984 111.8 46.8 -65.7 -53.9 23.1 2.0 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.906 111.0 52.6 -50.6 -46.8 25.3 0.9 5.8 89 89 A D H 3< S+ 0 0 77 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.832 107.4 53.5 -63.0 -32.1 23.4 -2.5 6.1 90 90 A S H << S+ 0 0 34 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.687 96.5 86.1 -76.7 -20.6 23.9 -3.1 2.4 91 91 A L S << S- 0 0 5 -4,-1.1 31,-0.0 -3,-0.8 2,-0.0 -0.464 75.5-117.5 -87.9 158.3 27.7 -2.6 2.5 92 92 A D > - 0 0 57 -2,-0.1 4,-1.8 1,-0.1 5,-0.2 -0.220 46.1 -90.1 -76.5 172.4 30.6 -5.0 3.2 93 93 A A H > S+ 0 0 80 1,-0.2 4,-1.6 2,-0.2 -2,-0.1 0.866 123.4 48.7 -56.3 -43.3 33.0 -4.3 6.2 94 94 A V H > S+ 0 0 25 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.911 112.6 45.5 -63.6 -50.7 35.4 -2.2 4.4 95 95 A R H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.788 105.8 61.5 -66.4 -27.9 32.9 0.1 2.7 96 96 A R H X S+ 0 0 79 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.923 102.5 52.1 -63.2 -41.0 31.1 0.4 6.0 97 97 A A H X S+ 0 0 5 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.858 105.3 55.9 -61.0 -36.5 34.3 2.0 7.4 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.900 109.0 46.6 -61.5 -42.0 34.3 4.4 4.4 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.885 110.0 52.0 -69.3 -37.0 30.8 5.6 5.3 100 100 A I H X S+ 0 0 9 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.942 107.8 54.2 -63.6 -42.0 31.7 6.0 9.0 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.934 108.3 47.7 -57.3 -48.6 34.7 8.1 8.0 102 102 A M H X S+ 0 0 3 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.899 113.5 48.3 -61.8 -39.7 32.5 10.5 5.9 103 103 A V H X S+ 0 0 8 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.917 109.6 52.5 -67.9 -37.4 30.0 10.8 8.8 104 104 A F H < S+ 0 0 30 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.919 116.1 41.3 -64.1 -38.3 32.8 11.4 11.3 105 105 A Q H < S+ 0 0 59 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.925 132.5 16.1 -74.7 -49.9 34.1 14.2 9.1 106 106 A M H X S- 0 0 56 -4,-2.8 4,-0.6 -5,-0.2 -3,-0.2 0.477 103.3-110.9-112.4 0.2 30.9 15.9 8.0 107 107 A G H X - 0 0 32 -4,-2.4 4,-2.0 -5,-0.3 5,-0.2 0.206 35.1 -82.0 84.3 151.7 28.1 14.8 10.3 108 108 A E H > S+ 0 0 51 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.835 126.4 54.4 -61.1 -36.2 25.2 12.6 9.6 109 109 A T H > S+ 0 0 122 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.948 108.3 48.8 -65.0 -46.3 23.1 15.4 8.1 110 110 A G H >< S+ 0 0 33 -4,-0.6 3,-1.0 1,-0.2 4,-0.2 0.933 114.2 44.8 -58.0 -50.5 25.8 16.3 5.6 111 111 A V H >< S+ 0 0 1 -4,-2.0 3,-2.5 1,-0.3 -1,-0.2 0.906 106.2 59.6 -61.8 -41.5 26.3 12.7 4.4 112 112 A A H 3< S+ 0 0 9 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.674 96.0 67.9 -62.5 -14.0 22.6 12.1 4.2 113 113 A G T << S+ 0 0 55 -3,-1.0 2,-1.4 -4,-0.7 -1,-0.3 0.564 74.7 84.1 -81.0 -9.8 22.6 14.9 1.7 114 114 A F <> + 0 0 40 -3,-2.5 4,-2.4 -4,-0.2 3,-0.3 -0.276 57.8 160.2 -89.5 57.5 24.6 12.9 -0.8 115 115 A T H > + 0 0 85 -2,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.816 66.3 43.3 -45.1 -52.6 21.3 11.4 -2.1 116 116 A N H > S+ 0 0 86 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.865 113.7 50.2 -69.1 -38.5 22.4 10.1 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.874 109.8 52.2 -68.2 -37.1 25.8 8.7 -4.4 118 118 A L H X S+ 0 0 13 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.881 108.4 50.7 -65.7 -39.5 24.0 6.8 -1.6 119 119 A R H X S+ 0 0 115 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.921 111.5 48.5 -64.2 -40.6 21.6 5.3 -4.0 120 120 A M H X>S+ 0 0 22 -4,-2.0 5,-2.2 2,-0.2 4,-0.5 0.913 110.4 50.4 -66.6 -42.2 24.5 4.3 -6.2 121 121 A L H ><5S+ 0 0 1 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.950 108.8 51.5 -61.6 -47.8 26.4 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 90 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.874 110.4 50.4 -56.5 -33.9 23.3 0.8 -2.3 123 123 A Q H 3<5S- 0 0 87 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.528 112.5-121.9 -82.1 -5.7 23.1 -0.5 -5.8 124 124 A K T <<5 + 0 0 98 -3,-1.7 2,-1.3 -4,-0.5 -3,-0.2 0.748 62.0 146.7 68.2 31.5 26.7 -1.5 -5.8 125 125 A R >< + 0 0 112 -5,-2.2 4,-2.6 1,-0.2 -1,-0.2 -0.671 19.7 172.2 -96.6 75.9 27.5 0.7 -8.8 126 126 A W H > + 0 0 48 -2,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.895 69.1 46.2 -56.7 -52.0 31.0 1.4 -7.5 127 127 A D H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.926 115.5 46.6 -63.5 -40.7 32.5 3.3 -10.4 128 128 A E H > S+ 0 0 112 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 110.8 51.9 -68.5 -39.0 29.5 5.5 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.879 107.4 53.8 -61.5 -40.7 29.3 6.2 -7.1 130 130 A A H X S+ 0 0 12 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.905 109.1 48.3 -61.1 -38.8 33.0 7.3 -7.2 131 131 A V H < S+ 0 0 89 -4,-1.8 4,-0.4 1,-0.2 3,-0.2 0.934 113.8 45.9 -69.0 -43.4 32.4 9.7 -10.0 132 132 A N H >< S+ 0 0 39 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.896 107.6 56.9 -66.8 -40.6 29.3 11.2 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.8 6,-0.4 1,-0.2 -1,-0.2 0.862 101.3 58.7 -57.0 -36.6 31.1 11.5 -4.8 134 134 A A T 3< S+ 0 0 27 -4,-1.4 2,-1.7 -3,-0.2 -1,-0.2 0.601 86.0 79.9 -70.3 -17.5 33.9 13.6 -6.5 135 135 A K S < S+ 0 0 158 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.2 -0.557 81.7 96.6 -88.5 71.2 31.4 16.3 -7.6 136 136 A S S > S- 0 0 17 -2,-1.7 4,-2.2 1,-0.1 5,-0.2 -0.997 85.3-117.2-156.7 156.0 31.2 17.9 -4.3 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-3.5 1,-0.2 5,-0.3 0.899 115.5 61.7 -56.7 -44.3 32.6 20.7 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.919 106.8 42.3 -46.4 -52.0 34.0 17.9 0.1 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.892 116.7 48.2 -68.2 -40.1 36.1 16.5 -2.7 140 140 A N H < S+ 0 0 108 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.895 116.6 41.6 -70.2 -34.3 37.2 20.0 -3.8 141 141 A Q H < S+ 0 0 105 -4,-3.5 -2,-0.2 1,-0.2 -1,-0.2 0.864 131.5 21.5 -80.2 -39.6 38.1 21.2 -0.3 142 142 A T S X S+ 0 0 20 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 -0.569 74.0 162.0-128.7 70.3 39.9 18.1 1.0 143 143 A P H > + 0 0 49 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.817 69.4 51.1 -64.0 -36.2 40.9 16.2 -2.1 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.917 116.2 40.4 -71.5 -39.7 43.5 13.9 -0.7 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.910 115.3 51.8 -69.7 -45.5 41.3 12.6 2.0 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-3.4 -8,-0.2 5,-0.3 0.946 107.7 52.7 -54.9 -49.2 38.3 12.4 -0.2 147 147 A K H X S+ 0 0 91 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.867 108.9 50.7 -56.9 -40.2 40.3 10.4 -2.9 148 148 A R H X S+ 0 0 71 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.931 114.6 42.3 -64.9 -43.8 41.3 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.918 114.6 50.7 -67.0 -44.7 37.7 7.5 1.0 150 150 A I H X S+ 0 0 14 -4,-3.4 4,-2.4 -5,-0.2 -2,-0.2 0.883 109.2 51.5 -59.8 -41.7 36.4 7.4 -2.6 151 151 A T H X S+ 0 0 34 -4,-2.3 4,-2.3 -5,-0.3 6,-0.3 0.859 106.7 55.4 -65.4 -32.7 39.0 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 5,-0.2 0.910 110.1 44.7 -66.2 -40.5 37.8 2.7 -0.5 153 153 A F H < S+ 0 0 2 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.914 115.1 49.9 -69.5 -37.8 34.2 2.7 -1.8 154 154 A R H < S+ 0 0 104 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.874 125.0 23.3 -68.2 -39.7 35.4 1.9 -5.3 155 155 A T H < S- 0 0 44 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.661 85.3-135.4-103.2 -24.3 37.6 -1.0 -4.5 156 156 A G S < S+ 0 0 17 -4,-2.2 2,-0.3 1,-0.3 -62,-0.2 0.761 74.1 103.2 68.1 26.8 36.3 -2.4 -1.2 157 157 A T S S- 0 0 46 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.847 80.5-121.7-131.0 169.4 40.0 -2.7 -0.1 158 158 A W S >> S+ 0 0 45 -2,-0.3 3,-2.5 1,-0.2 4,-0.6 0.128 70.8 124.1 -96.0 16.2 42.3 -0.6 2.2 159 159 A D G >4 + 0 0 94 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.849 65.5 56.5 -47.1 -41.3 44.7 -0.0 -0.6 160 160 A A G 34 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.607 108.1 50.0 -70.3 -12.3 44.6 3.8 -0.4 161 161 A Y G <4 0 0 19 -3,-2.5 -1,-0.3 -13,-0.1 -2,-0.2 0.370 360.0 360.0-106.1 0.2 45.7 3.6 3.2 162 162 A K << 0 0 169 -3,-1.3 -2,-0.2 -4,-0.6 -3,-0.1 0.788 360.0 360.0-110.3 360.0 48.6 1.3 2.8