==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-MAY-09 3HH6 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.LIU,B.W.MATTHEWS . 163 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8958.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 71.2 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 . 10 6.1 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 . 1 0.6 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 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 52.8 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 1 0 0 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 1 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 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 61 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 145.8 43.0 -1.7 8.9 2 2 A N > - 0 0 67 156,-0.0 4,-2.7 95,-0.0 5,-0.2 -0.922 360.0 -80.8-157.5 175.9 39.7 -0.7 10.5 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.834 125.8 52.5 -58.6 -37.2 37.7 2.4 11.1 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.955 113.4 42.4 -64.2 -48.8 39.8 3.6 14.0 5 5 A E H > S+ 0 0 96 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.895 114.1 53.4 -63.1 -39.1 43.1 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.943 112.8 41.5 -61.3 -51.7 41.5 4.9 9.0 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.846 109.7 58.9 -68.7 -32.0 40.2 7.9 10.8 8 8 A R H X S+ 0 0 106 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.914 109.4 45.5 -61.4 -40.1 43.5 8.2 12.8 9 9 A I H < S+ 0 0 85 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.939 117.2 43.4 -63.7 -48.7 45.2 8.5 9.4 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.828 125.1 31.8 -70.8 -32.1 42.7 11.0 8.0 11 11 A E H < S- 0 0 45 -4,-2.8 19,-0.4 1,-0.2 -1,-0.2 0.681 91.6-152.3-101.3 -21.4 42.5 13.2 11.1 12 12 A G < - 0 0 22 -4,-1.9 2,-0.4 -5,-0.3 -1,-0.2 -0.199 24.3 -87.9 73.6-173.6 45.9 13.0 12.7 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.962 44.9 167.3-139.0 119.8 46.5 13.4 16.5 14 14 A R E -A 28 0A 143 14,-1.7 14,-2.3 -2,-0.4 4,-0.1 -1.000 21.1-160.6-133.8 132.4 47.1 16.8 18.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.7 12,-0.2 2,-0.3 0.500 73.8 62.6 -94.8 -4.9 47.1 17.3 21.9 16 16 A K E S-C 57 0B 139 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.906 101.8 -84.1-116.8 149.6 46.5 21.0 21.9 17 17 A I E + 0 0 20 39,-2.0 2,-0.3 -2,-0.3 10,-0.2 -0.235 59.1 167.8 -50.8 131.9 43.6 23.0 20.5 18 18 A Y E -A 26 0A 25 8,-2.8 8,-2.9 -4,-0.1 2,-0.5 -0.866 37.1-101.6-137.9 169.2 44.1 23.5 16.7 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.875 34.3-138.2 -98.6 135.3 41.9 24.7 13.8 20 20 A D > - 0 0 46 4,-2.7 3,-2.0 -2,-0.5 -1,-0.1 0.021 42.1 -77.2 -76.2-171.7 40.5 22.1 11.4 21 21 A T T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.725 134.4 48.6 -65.4 -21.6 40.4 22.3 7.6 22 22 A E T 3 S- 0 0 72 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.353 123.3-102.8 -96.1 1.5 37.3 24.7 7.9 23 23 A G S < S+ 0 0 38 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.586 75.9 139.8 88.1 13.1 39.0 26.9 10.5 24 24 A Y - 0 0 76 1,-0.1 -4,-2.7 9,-0.0 -1,-0.3 -0.730 60.9-101.8 -98.3 138.4 37.1 25.5 13.5 25 25 A Y E +A 19 0A 37 11,-0.4 8,-2.7 9,-0.4 9,-1.3 -0.340 54.7 159.6 -60.8 130.5 38.6 24.8 16.9 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.8 6,-0.3 2,-0.3 -0.884 19.7-165.4-146.1 161.8 39.3 21.1 17.3 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.5 -2,-0.3 2,-0.2 -0.976 51.7 3.8-150.0 163.8 41.5 18.8 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.7 -2,-0.3 2,-0.9 -0.401 123.8 -6.1 73.4-130.4 42.7 15.2 19.5 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.708 129.4 -52.4-103.9 73.6 41.8 13.0 16.6 30 30 A G T 4 S+ 0 0 13 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.801 82.1 163.9 65.0 30.2 39.5 15.4 14.8 31 31 A H E < -B 27 0A 29 -4,-2.5 -4,-1.8 -20,-0.1 2,-0.2 -0.707 31.2-143.3 -81.8 102.3 37.3 16.2 17.8 32 32 A L E -B 26 0A 75 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.464 19.1-176.1 -65.1 129.2 35.4 19.3 16.8 33 33 A L - 0 0 13 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.877 57.5 -33.4 -92.0 -46.3 34.9 21.6 19.8 34 34 A T - 0 0 32 -9,-1.3 -9,-0.4 2,-0.1 -1,-0.4 -0.967 34.5-130.3-169.9 155.8 32.8 24.5 18.4 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.459 75.5 114.4 -91.4 -4.8 32.2 26.5 15.3 36 36 A S - 0 0 42 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.372 69.6-137.5 -63.8 140.5 32.5 29.7 17.4 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.553 77.1 105.1 -73.7 -4.3 35.5 32.0 16.5 38 38 A S > - 0 0 49 1,-0.2 4,-1.9 2,-0.0 5,-0.1 -0.667 56.5-163.5 -82.0 116.2 36.0 32.3 20.3 39 39 A L H > S+ 0 0 72 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.876 94.2 57.5 -62.5 -37.4 38.9 30.4 21.7 40 40 A N H > S+ 0 0 124 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.912 105.3 49.9 -58.8 -41.7 37.5 30.8 25.1 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.893 110.7 50.3 -62.4 -40.7 34.2 29.1 23.9 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.898 109.4 50.7 -63.6 -41.9 36.3 26.3 22.5 43 43 A K H X S+ 0 0 65 -4,-2.6 4,-2.8 2,-0.2 11,-0.2 0.904 108.6 51.9 -62.8 -43.0 38.2 25.8 25.8 44 44 A S H X S+ 0 0 67 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.927 109.4 49.7 -58.4 -45.7 35.0 25.7 27.7 45 45 A E H X S+ 0 0 66 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.905 110.6 51.3 -59.9 -40.4 33.7 23.0 25.3 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.941 109.0 49.0 -62.3 -48.7 37.0 21.1 25.9 47 47 A D H X>S+ 0 0 38 -4,-2.8 4,-2.5 1,-0.2 5,-0.9 0.899 112.4 49.2 -57.7 -42.6 36.7 21.2 29.6 48 48 A K H <5S+ 0 0 142 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.879 112.3 48.3 -62.9 -41.5 33.1 20.0 29.5 49 49 A A H <5S+ 0 0 40 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.873 120.3 35.7 -68.5 -38.8 34.1 17.1 27.1 50 50 A I H <5S- 0 0 36 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.749 103.1-126.5 -87.3 -30.1 37.1 16.0 29.3 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.2 0.695 76.4 75.8 86.4 22.5 35.5 16.7 32.7 52 52 A R S - 0 0 70 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.496 32.5-109.0 -88.9 165.6 46.7 13.6 27.0 60 60 A K H > S+ 0 0 113 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.909 121.1 52.7 -57.8 -43.8 46.9 10.9 24.4 61 61 A D H > S+ 0 0 124 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.907 109.5 49.2 -61.1 -41.0 44.6 8.7 26.5 62 62 A E H > S+ 0 0 41 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.918 110.6 50.2 -64.0 -42.1 42.1 11.6 26.7 63 63 A A H X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.2 -34,-0.4 0.908 111.0 49.4 -61.2 -42.3 42.2 12.2 23.0 64 64 A E H X S+ 0 0 74 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.836 107.5 54.9 -69.0 -30.3 41.6 8.5 22.4 65 65 A K H X S+ 0 0 131 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.939 109.7 45.6 -65.9 -47.8 38.7 8.5 24.7 66 66 A L H X S+ 0 0 5 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.899 111.5 54.4 -59.5 -39.8 37.0 11.3 22.8 67 67 A F H X S+ 0 0 10 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.925 106.8 49.9 -62.1 -46.1 37.8 9.5 19.6 68 68 A N H X S+ 0 0 90 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.910 113.0 47.3 -55.6 -47.6 36.1 6.3 20.8 69 69 A Q H X S+ 0 0 94 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.903 112.1 50.2 -61.5 -41.3 33.0 8.3 21.8 70 70 A D H X S+ 0 0 33 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.886 110.1 48.1 -70.0 -39.2 33.0 10.1 18.4 71 71 A V H X S+ 0 0 7 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.943 113.6 48.7 -64.0 -45.1 33.3 6.9 16.3 72 72 A D H X S+ 0 0 91 -4,-2.2 4,-3.0 -5,-0.2 -2,-0.2 0.917 110.7 51.2 -58.2 -45.2 30.4 5.4 18.4 73 73 A A H X S+ 0 0 56 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.866 108.0 51.9 -62.3 -38.9 28.4 8.6 17.9 74 74 A A H X S+ 0 0 6 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.938 112.9 44.4 -63.2 -46.5 28.9 8.5 14.2 75 75 A V H X S+ 0 0 23 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.940 113.5 50.6 -61.7 -50.2 27.7 4.9 14.0 76 76 A R H X S+ 0 0 124 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.909 109.9 51.5 -50.6 -48.0 24.7 5.6 16.4 77 77 A G H X S+ 0 0 5 -4,-2.5 4,-0.7 1,-0.2 -1,-0.2 0.892 108.8 49.5 -61.0 -45.3 23.8 8.6 14.2 78 78 A I H >< S+ 0 0 4 -4,-2.2 3,-1.1 1,-0.2 7,-0.5 0.938 111.3 49.7 -55.9 -48.9 23.8 6.5 11.0 79 79 A L H 3< S+ 0 0 60 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.764 110.9 49.3 -69.0 -22.7 21.6 3.8 12.6 80 80 A R H 3< S+ 0 0 212 -4,-1.5 2,-0.6 -3,-0.2 -1,-0.3 0.512 94.0 91.5 -88.6 -10.3 19.1 6.5 13.8 81 81 A N S+ 0 0 145 2,-0.1 4,-0.7 3,-0.1 -1,-0.2 0.872 119.8 39.9 -84.2 -40.3 18.1 7.8 4.9 84 84 A L H > S+ 0 0 15 -7,-0.1 4,-2.8 1,-0.1 5,-0.2 0.867 102.9 65.7 -80.6 -39.6 21.5 6.5 6.1 85 85 A K H X S+ 0 0 85 -4,-2.9 4,-3.0 -7,-0.5 5,-0.2 0.908 100.3 48.3 -55.7 -50.0 20.6 3.3 7.9 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.895 114.7 46.5 -61.6 -35.8 19.3 1.3 4.9 87 87 A V H X S+ 0 0 9 -4,-0.7 4,-0.7 2,-0.2 3,-0.3 0.950 113.1 49.0 -68.3 -46.9 22.3 2.2 2.8 88 88 A Y H >< S+ 0 0 34 -4,-2.8 3,-1.4 1,-0.2 -1,-0.2 0.931 109.9 52.1 -55.6 -46.9 24.7 1.4 5.7 89 89 A D H 3< S+ 0 0 69 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.823 105.9 56.2 -58.5 -32.4 22.9 -2.0 6.2 90 90 A S H 3< S+ 0 0 34 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.649 95.6 87.5 -75.1 -17.1 23.4 -2.8 2.5 91 91 A L S << S- 0 0 6 -3,-1.4 2,-0.1 -4,-0.7 31,-0.0 -0.474 77.0-117.1 -88.3 154.8 27.2 -2.3 2.6 92 92 A D > - 0 0 53 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.337 44.0 -94.9 -72.1 167.8 30.0 -4.7 3.4 93 93 A A H > S+ 0 0 77 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.810 122.3 51.5 -62.4 -33.6 32.2 -3.9 6.4 94 94 A V H > S+ 0 0 28 2,-0.2 4,-1.4 1,-0.2 3,-0.3 0.950 112.9 44.5 -69.6 -47.2 34.9 -2.0 4.5 95 95 A R H > S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.844 106.4 61.8 -66.7 -30.8 32.5 0.3 2.8 96 96 A R H X S+ 0 0 81 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.887 101.1 53.9 -58.3 -39.4 30.7 0.7 6.1 97 97 A A H X S+ 0 0 6 -4,-1.3 4,-2.6 -3,-0.3 -1,-0.2 0.902 105.0 53.0 -61.4 -41.3 33.9 2.2 7.4 98 98 A A H X S+ 0 0 0 -4,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.904 109.4 49.8 -59.3 -41.2 33.9 4.7 4.5 99 99 A A H X S+ 0 0 18 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.917 110.6 48.4 -62.8 -46.3 30.4 5.7 5.5 100 100 A I H X S+ 0 0 9 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.909 108.3 56.1 -59.9 -41.5 31.4 6.2 9.1 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.933 108.0 47.4 -56.2 -48.9 34.4 8.3 8.0 102 102 A M H X S+ 0 0 11 -4,-2.1 4,-2.7 1,-0.2 5,-0.4 0.907 113.0 47.5 -60.2 -44.4 32.1 10.7 6.0 103 103 A V H X S+ 0 0 8 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.896 109.9 53.9 -67.0 -37.9 29.7 11.1 9.0 104 104 A F H < S+ 0 0 31 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.920 115.2 40.9 -58.5 -43.5 32.6 11.7 11.3 105 105 A Q H < S+ 0 0 52 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.893 134.8 13.1 -73.2 -42.3 33.9 14.4 9.1 106 106 A M H X S- 0 0 44 -4,-2.7 4,-0.6 -5,-0.2 -3,-0.2 0.508 100.5-119.6-121.0 -5.9 30.6 16.2 8.1 107 107 A G H X - 0 0 22 -4,-2.4 4,-0.9 -5,-0.4 5,-0.2 0.054 40.2 -67.6 85.2 164.8 27.9 14.9 10.4 108 108 A E H 4 S+ 0 0 62 1,-0.2 4,-0.5 2,-0.2 -1,-0.1 0.849 137.8 33.2 -57.7 -39.5 24.6 13.1 9.7 109 109 A T H >> S+ 0 0 112 2,-0.2 3,-1.1 1,-0.2 4,-0.7 0.879 103.4 71.6 -84.1 -44.5 23.1 16.1 8.0 110 110 A G H 3< S+ 0 0 40 -4,-0.6 -2,-0.2 1,-0.3 -3,-0.2 0.749 106.8 43.9 -42.2 -23.1 26.4 17.4 6.5 111 111 A V T 3< S+ 0 0 8 -4,-0.9 -1,-0.3 1,-0.1 -2,-0.2 0.742 82.3 98.9 -92.9 -30.3 25.8 14.3 4.4 112 112 A A T X4 S+ 0 0 55 -3,-1.1 2,-2.8 -4,-0.5 3,-0.9 0.783 74.8 68.4 -20.9 -56.3 22.1 15.0 3.8 113 113 A G T 3< S+ 0 0 65 -4,-0.7 -1,-0.3 1,-0.2 -4,-0.0 -0.439 82.6 76.5 -70.2 72.9 23.3 16.5 0.5 114 114 A F T 3> + 0 0 23 -2,-2.8 4,-2.7 22,-0.0 3,-0.3 0.194 48.5 129.0-164.1 11.7 24.3 13.0 -0.8 115 115 A T H <> S+ 0 0 74 -3,-0.9 4,-2.0 1,-0.2 5,-0.1 0.840 77.9 45.3 -42.0 -50.4 20.9 11.4 -1.7 116 116 A N H > S+ 0 0 85 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.893 112.9 50.4 -69.1 -37.7 21.9 10.4 -5.2 117 117 A S H > S+ 0 0 3 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.905 109.3 52.7 -61.0 -45.1 25.3 9.0 -4.1 118 118 A L H X S+ 0 0 30 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.898 108.0 50.2 -60.3 -44.0 23.5 7.0 -1.4 119 119 A R H X S+ 0 0 126 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.933 110.8 49.1 -60.5 -47.3 21.1 5.5 -3.9 120 120 A M H <>S+ 0 0 34 -4,-2.1 5,-2.5 1,-0.2 4,-0.4 0.873 110.9 50.9 -61.8 -38.3 24.0 4.5 -6.2 121 121 A L H ><5S+ 0 0 6 -4,-2.4 3,-1.2 2,-0.2 -1,-0.2 0.919 109.6 49.1 -64.0 -45.0 25.8 2.9 -3.2 122 122 A Q H 3<5S+ 0 0 97 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.854 110.9 51.1 -62.9 -32.6 22.7 0.9 -2.3 123 123 A Q T 3<5S- 0 0 99 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.535 111.7-125.9 -76.8 -9.7 22.5 -0.2 -5.9 124 124 A K T < 5 + 0 0 97 -3,-1.2 2,-1.3 -4,-0.4 -3,-0.2 0.804 60.0 147.6 63.1 33.8 26.2 -1.2 -5.8 125 125 A R >< + 0 0 91 -5,-2.5 4,-2.8 1,-0.2 5,-0.2 -0.691 21.8 174.4 -93.3 78.5 27.0 0.9 -8.8 126 126 A W H > + 0 0 50 -2,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.860 67.3 44.4 -67.7 -43.4 30.4 1.6 -7.5 127 127 A D H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.908 116.6 48.0 -68.0 -39.6 32.1 3.6 -10.3 128 128 A E H > S+ 0 0 95 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.916 111.5 50.2 -66.1 -41.7 29.0 5.7 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.908 108.9 53.2 -59.9 -42.6 28.7 6.4 -7.0 130 130 A A H X S+ 0 0 12 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.914 109.6 47.1 -61.4 -45.9 32.4 7.3 -7.0 131 131 A V H X S+ 0 0 84 -4,-2.1 4,-0.6 1,-0.2 3,-0.2 0.922 114.3 48.0 -59.4 -45.1 31.9 9.9 -9.8 132 132 A N H >< S+ 0 0 39 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.901 106.9 55.5 -65.8 -40.9 28.8 11.3 -8.0 133 133 A L H 3< S+ 0 0 3 -4,-3.0 6,-0.4 1,-0.2 -1,-0.2 0.824 103.0 57.1 -59.2 -34.0 30.5 11.5 -4.6 134 134 A A H 3< S+ 0 0 25 -4,-1.4 2,-1.8 -3,-0.2 -1,-0.2 0.648 85.4 81.6 -74.4 -16.6 33.3 13.7 -6.2 135 135 A K S << S+ 0 0 158 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.535 81.8 98.1 -85.9 69.3 30.8 16.3 -7.4 136 136 A S S > S- 0 0 20 -2,-1.8 4,-2.1 1,-0.1 5,-0.2 -0.997 86.0-117.3-155.6 151.3 30.7 17.9 -4.0 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.910 115.8 62.3 -54.8 -42.5 32.0 20.7 -1.9 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.928 106.0 41.9 -48.1 -55.4 33.5 17.9 0.3 139 139 A Y H 4 S+ 0 0 63 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.910 114.9 50.9 -64.2 -43.1 35.7 16.6 -2.5 140 140 A N H < S+ 0 0 110 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.890 115.9 40.4 -63.3 -37.4 36.7 20.1 -3.7 141 141 A Q H < S+ 0 0 109 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.844 132.9 21.1 -83.5 -35.1 37.7 21.2 -0.2 142 142 A T S X S+ 0 0 20 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 -0.599 74.4 159.4-128.7 69.8 39.4 18.0 1.0 143 143 A P H > S+ 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.868 70.3 50.2 -67.7 -37.5 40.3 16.2 -2.2 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.940 116.3 41.5 -67.5 -44.1 43.0 13.9 -1.0 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.925 115.6 50.4 -65.0 -45.3 40.9 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.4 1,-0.2 5,-0.2 0.910 107.5 54.8 -61.0 -40.3 37.8 12.4 -0.2 147 147 A K H X S+ 0 0 98 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.904 108.8 48.5 -58.7 -41.0 39.8 10.4 -2.8 148 148 A R H X S+ 0 0 66 -4,-1.8 4,-1.7 2,-0.2 12,-0.2 0.935 114.9 43.9 -63.9 -47.0 40.8 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.932 114.8 49.2 -63.8 -45.8 37.2 7.5 1.1 150 150 A I H X S+ 0 0 14 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.904 108.7 52.8 -61.3 -42.1 35.8 7.3 -2.4 151 151 A T H X S+ 0 0 34 -4,-2.6 4,-2.5 -5,-0.2 6,-0.4 0.872 107.5 53.0 -60.3 -37.0 38.4 4.7 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.927 112.4 43.9 -64.6 -44.3 37.2 2.7 -0.4 153 153 A F H < S+ 0 0 5 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.865 115.2 50.1 -65.1 -37.6 33.6 2.9 -1.6 154 154 A R H < S+ 0 0 106 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.917 126.8 20.4 -68.1 -41.1 34.6 2.2 -5.2 155 155 A T H < S- 0 0 40 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.660 84.9-133.9-106.1 -22.8 36.7 -0.9 -4.4 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 -5,-0.3 -62,-0.2 0.759 74.2 106.8 64.2 23.9 35.6 -2.3 -1.0 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.813 79.7-122.9-122.8 169.6 39.4 -2.6 -0.2 158 158 A W S >> S+ 0 0 41 -2,-0.3 3,-2.3 1,-0.2 4,-0.5 0.117 70.5 123.3 -94.0 19.8 41.8 -0.7 2.0 159 159 A D G >4 + 0 0 116 1,-0.3 3,-0.8 2,-0.2 -1,-0.2 0.803 67.6 57.2 -57.0 -33.0 44.1 0.1 -0.9 160 160 A A G 34 S+ 0 0 32 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.612 109.7 46.4 -74.6 -9.4 43.9 3.9 -0.4 161 161 A Y G <4 S+ 0 0 16 -3,-2.3 2,-0.2 -13,-0.1 -1,-0.2 0.386 92.6 98.5-112.1 1.9 45.2 3.5 3.2 162 162 A K << 0 0 102 -3,-0.8 -3,-0.0 -4,-0.5 0, 0.0 -0.616 360.0 360.0 -94.8 151.0 48.1 1.1 2.6 163 163 A N 0 0 214 -2,-0.2 0, 0.0 0, 0.0 0, 0.0 0.490 360.0 360.0 74.1 360.0 51.8 2.0 2.2