==== 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 3HH3 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.LIU,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8835.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 71.3 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 . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 51.8 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 2 0 1 1 2 0 0 1 1 1 0 0 0 0 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 60 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 146.0 43.1 -1.6 8.8 2 2 A N > - 0 0 68 156,-0.0 4,-2.6 95,-0.0 5,-0.2 -0.920 360.0 -80.4-157.7 176.0 39.8 -0.7 10.5 3 3 A I H > S+ 0 0 24 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.836 126.7 52.2 -57.6 -37.5 37.7 2.5 11.0 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.951 113.6 42.3 -64.4 -48.1 39.9 3.6 14.0 5 5 A E H > S+ 0 0 96 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.878 114.7 52.7 -65.7 -36.8 43.1 3.3 12.0 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.942 112.6 42.1 -63.0 -52.4 41.5 4.8 8.9 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.4 0.846 109.0 59.6 -68.1 -31.4 40.3 7.9 10.8 8 8 A R H X S+ 0 0 108 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.916 109.1 45.1 -61.4 -40.4 43.6 8.2 12.7 9 9 A I H < S+ 0 0 48 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.944 117.5 43.5 -63.2 -48.3 45.3 8.5 9.3 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.808 125.2 31.5 -71.8 -30.1 42.8 11.0 7.9 11 11 A E H < S- 0 0 44 -4,-2.8 19,-0.4 -5,-0.2 -1,-0.2 0.679 91.1-153.0-102.9 -21.8 42.5 13.2 11.1 12 12 A G < - 0 0 22 -4,-1.9 2,-0.4 -5,-0.4 -1,-0.1 -0.198 24.3 -88.8 72.3-172.8 46.0 13.0 12.7 13 13 A L + 0 0 43 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.951 44.5 166.9-141.3 118.3 46.6 13.4 16.4 14 14 A R E -A 28 0A 145 14,-1.8 14,-2.4 -2,-0.4 4,-0.1 -1.000 21.8-159.5-133.9 133.7 47.2 16.8 18.0 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.6 12,-0.2 2,-0.3 0.496 74.1 62.8 -94.8 -5.1 47.2 17.3 21.8 16 16 A K E S-C 57 0B 94 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.895 101.2 -85.1-116.8 149.9 46.6 21.1 21.8 17 17 A I E + 0 0 17 39,-1.9 2,-0.3 -2,-0.3 10,-0.2 -0.269 58.7 167.3 -52.4 131.7 43.6 23.0 20.4 18 18 A Y E -A 26 0A 25 8,-2.7 8,-2.8 -4,-0.1 2,-0.5 -0.879 37.7-100.6-138.4 168.9 44.1 23.6 16.6 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.855 34.9-138.1 -97.3 134.4 42.0 24.8 13.7 20 20 A D > - 0 0 45 4,-2.7 3,-2.0 -2,-0.5 -1,-0.1 0.016 42.2 -77.7 -74.8-172.6 40.6 22.1 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.730 134.6 49.1 -64.0 -22.3 40.5 22.4 7.6 22 22 A E T 3 S- 0 0 71 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.340 123.4-103.3 -95.9 2.6 37.4 24.6 7.8 23 23 A G S < S+ 0 0 38 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.596 76.0 139.6 85.8 13.4 39.1 26.9 10.4 24 24 A Y - 0 0 75 1,-0.1 -4,-2.7 9,-0.0 -1,-0.3 -0.735 61.1-101.5 -98.8 138.4 37.2 25.5 13.4 25 25 A Y E +A 19 0A 37 11,-0.4 8,-2.7 9,-0.4 9,-1.3 -0.334 54.7 159.6 -60.1 130.6 38.7 24.8 16.8 26 26 A T E -AB 18 32A 3 -8,-2.8 -8,-2.7 6,-0.3 2,-0.3 -0.889 19.3-166.6-147.0 160.7 39.4 21.1 17.2 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.5 -2,-0.3 2,-0.2 -0.977 51.7 4.2-150.3 164.2 41.6 18.8 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.8 -2,-0.3 2,-0.9 -0.409 123.9 -6.6 72.8-129.7 42.8 15.2 19.4 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.708 129.3 -52.1-104.1 73.8 41.9 13.0 16.5 30 30 A G T 4 S+ 0 0 13 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.800 81.9 163.9 65.1 30.8 39.5 15.4 14.7 31 31 A H E < -B 27 0A 28 -4,-2.5 -4,-1.8 -20,-0.1 2,-0.2 -0.704 30.8-144.4 -82.2 101.3 37.4 16.2 17.7 32 32 A L E -B 26 0A 76 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.476 18.5-175.7 -64.4 127.8 35.5 19.3 16.7 33 33 A L - 0 0 13 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.883 57.2 -34.1 -91.1 -45.8 35.0 21.6 19.7 34 34 A T - 0 0 30 -9,-1.3 -9,-0.4 2,-0.1 -1,-0.4 -0.966 34.6-129.9-171.4 155.5 32.9 24.4 18.2 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.0 -11,-0.1 7,-0.0 0.450 75.4 115.0 -92.5 -3.7 32.3 26.5 15.1 36 36 A S - 0 0 40 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.387 69.6-137.2 -64.7 139.2 32.6 29.6 17.3 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.523 76.7 105.3 -73.8 -1.8 35.5 31.9 16.4 38 38 A S > - 0 0 50 1,-0.2 4,-1.9 2,-0.0 5,-0.1 -0.693 56.5-163.1 -85.1 117.0 36.0 32.3 20.2 39 39 A L H > S+ 0 0 64 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.884 95.0 56.9 -61.9 -38.4 39.0 30.3 21.6 40 40 A N H > S+ 0 0 123 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.911 105.4 50.1 -58.9 -41.7 37.5 30.8 25.1 41 41 A A H > S+ 0 0 32 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.887 110.9 49.7 -61.7 -40.8 34.3 29.1 23.8 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.899 109.2 51.3 -64.5 -42.4 36.4 26.2 22.4 43 43 A K H X S+ 0 0 69 -4,-2.7 4,-2.5 2,-0.2 11,-0.3 0.890 108.8 51.8 -63.0 -39.8 38.3 25.8 25.7 44 44 A S H X S+ 0 0 68 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.924 109.3 49.4 -61.2 -45.7 35.0 25.7 27.6 45 45 A E H X S+ 0 0 66 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.900 110.6 51.3 -60.9 -39.0 33.8 22.9 25.2 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.943 109.1 48.9 -63.2 -47.8 37.0 21.0 25.8 47 47 A D H X>S+ 0 0 38 -4,-2.5 4,-2.5 1,-0.2 5,-0.9 0.902 112.4 49.2 -58.4 -42.6 36.7 21.2 29.6 48 48 A K H <5S+ 0 0 144 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.875 112.6 48.0 -62.2 -41.5 33.1 20.0 29.4 49 49 A A H <5S+ 0 0 41 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.869 120.7 35.1 -69.3 -38.6 34.1 17.1 27.1 50 50 A I H <5S- 0 0 35 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.733 102.6-126.5 -89.1 -28.8 37.1 16.0 29.2 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.2 0.731 76.5 75.2 84.1 24.8 35.6 16.7 32.6 52 52 A R S - 0 0 69 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.504 32.5-108.7 -89.9 166.4 46.8 13.7 27.0 60 60 A K H > S+ 0 0 115 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.907 120.9 53.3 -59.4 -42.4 47.0 11.0 24.3 61 61 A D H > S+ 0 0 127 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.902 109.5 48.9 -60.5 -41.6 44.7 8.8 26.4 62 62 A E H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.913 110.3 50.7 -64.0 -41.5 42.2 11.6 26.6 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -34,-0.4 0.911 111.1 48.7 -61.7 -42.2 42.4 12.1 22.9 64 64 A E H X S+ 0 0 78 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.855 108.2 54.6 -68.6 -33.8 41.8 8.4 22.3 65 65 A K H X S+ 0 0 133 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.940 110.5 44.9 -62.9 -48.5 38.8 8.5 24.7 66 66 A L H X S+ 0 0 5 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.895 111.7 54.3 -60.8 -39.8 37.1 11.3 22.8 67 67 A F H X S+ 0 0 10 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.929 107.0 49.7 -61.4 -46.6 37.9 9.5 19.5 68 68 A N H X S+ 0 0 88 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.916 112.8 47.8 -55.9 -47.4 36.2 6.3 20.7 69 69 A Q H X S+ 0 0 94 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.906 111.7 50.2 -60.9 -42.3 33.2 8.3 21.7 70 70 A D H X S+ 0 0 33 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.885 110.5 47.8 -68.1 -39.6 33.1 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 0.946 113.9 48.5 -64.0 -45.8 33.4 7.0 16.3 72 72 A D H X S+ 0 0 92 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.926 111.0 50.7 -58.8 -46.0 30.6 5.4 18.4 73 73 A A H X S+ 0 0 61 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.867 108.1 52.4 -61.3 -39.1 28.5 8.6 18.0 74 74 A A H X S+ 0 0 8 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.932 113.0 44.2 -62.2 -46.7 28.9 8.5 14.2 75 75 A V H X S+ 0 0 22 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.950 113.6 49.6 -61.2 -52.0 27.8 4.9 14.0 76 76 A R H X S+ 0 0 120 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.878 110.8 52.2 -53.4 -42.5 24.8 5.5 16.3 77 77 A G H X S+ 0 0 9 -4,-2.3 4,-0.8 -5,-0.2 3,-0.4 0.922 107.6 49.7 -61.9 -49.3 23.9 8.5 14.3 78 78 A I H >< S+ 0 0 3 -4,-2.3 3,-1.1 1,-0.2 7,-0.5 0.929 110.7 51.3 -52.9 -47.7 23.9 6.6 11.0 79 79 A L H 3< S+ 0 0 55 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.778 109.8 49.0 -67.9 -24.1 21.7 3.9 12.6 80 80 A R H 3< S+ 0 0 190 -4,-1.3 2,-0.6 -3,-0.4 -1,-0.3 0.535 93.2 92.5 -88.5 -10.5 19.1 6.5 13.8 81 81 A N S+ 0 0 137 2,-0.1 4,-0.6 3,-0.1 -1,-0.2 0.849 119.5 40.1 -84.8 -38.2 18.1 7.8 5.0 84 84 A L H > S+ 0 0 7 -6,-0.2 4,-2.8 1,-0.1 5,-0.2 0.880 102.2 66.8 -82.3 -39.2 21.5 6.6 6.0 85 85 A K H X S+ 0 0 85 -4,-2.8 4,-3.1 -7,-0.5 5,-0.2 0.895 99.8 48.0 -54.5 -50.7 20.6 3.3 7.9 86 86 A P H > S+ 0 0 56 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.895 115.0 46.2 -61.9 -36.2 19.3 1.3 4.9 87 87 A V H X S+ 0 0 9 -4,-0.6 4,-0.7 -3,-0.2 3,-0.4 0.954 114.0 48.1 -68.0 -46.9 22.3 2.3 2.8 88 88 A Y H >< S+ 0 0 32 -4,-2.8 3,-1.4 1,-0.2 -1,-0.2 0.929 109.9 52.5 -56.7 -46.6 24.8 1.5 5.6 89 89 A D H 3< S+ 0 0 67 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.814 104.9 57.4 -59.6 -30.5 23.0 -1.9 6.2 90 90 A S H 3< S+ 0 0 35 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.650 94.8 88.2 -75.1 -16.7 23.4 -2.7 2.6 91 91 A L S << S- 0 0 7 -3,-1.4 2,-0.1 -4,-0.7 31,-0.0 -0.454 77.3-116.6 -87.4 155.0 27.2 -2.3 2.6 92 92 A D > - 0 0 53 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.354 44.0 -95.7 -72.4 167.2 30.1 -4.7 3.4 93 93 A A H > S+ 0 0 77 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.800 122.2 52.4 -63.7 -32.7 32.3 -3.9 6.5 94 94 A V H > S+ 0 0 31 2,-0.2 4,-1.5 1,-0.2 3,-0.3 0.949 112.9 44.2 -68.3 -47.4 35.0 -2.1 4.5 95 95 A R H > S+ 0 0 23 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.843 106.6 61.5 -66.8 -31.0 32.5 0.2 2.8 96 96 A R H X S+ 0 0 80 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.883 101.5 53.7 -58.7 -38.4 30.8 0.7 6.2 97 97 A A H X S+ 0 0 6 -4,-1.4 4,-2.5 -3,-0.3 -2,-0.2 0.920 106.1 51.5 -61.6 -42.4 34.1 2.2 7.4 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.902 109.8 50.8 -59.4 -40.3 34.0 4.6 4.5 99 99 A A H X S+ 0 0 15 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.919 110.1 47.9 -62.3 -47.2 30.5 5.6 5.5 100 100 A I H X S+ 0 0 9 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.906 108.5 56.0 -59.4 -41.7 31.5 6.2 9.1 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.938 107.0 49.2 -56.4 -49.2 34.4 8.3 7.9 102 102 A M H X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.2 5,-0.4 0.912 113.1 45.8 -55.9 -47.7 32.1 10.6 5.9 103 103 A V H X S+ 0 0 11 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.890 109.8 54.9 -67.5 -38.0 29.8 11.1 8.9 104 104 A F H < S+ 0 0 32 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.920 115.8 39.3 -58.2 -43.4 32.7 11.7 11.2 105 105 A Q H < S+ 0 0 53 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.901 134.2 15.6 -74.6 -43.4 33.9 14.5 8.9 106 106 A M H < S- 0 0 53 -4,-2.7 4,-0.5 -5,-0.2 -3,-0.2 0.533 102.6-115.1-117.2 -7.3 30.7 16.2 7.8 107 107 A G X - 0 0 31 -4,-2.3 4,-2.1 -5,-0.4 5,-0.2 0.107 33.1 -78.3 85.3 157.7 28.0 15.0 10.2 108 108 A E H > S+ 0 0 59 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.864 126.6 50.3 -60.2 -46.1 24.8 13.0 9.7 109 109 A T H > S+ 0 0 120 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.916 110.9 50.0 -62.8 -44.1 22.7 15.8 8.2 110 110 A G H >4 S+ 0 0 37 -4,-0.5 3,-0.5 1,-0.2 4,-0.2 0.895 113.8 43.8 -60.8 -45.1 25.4 16.7 5.6 111 111 A V H >< S+ 0 0 7 -4,-2.1 3,-2.0 1,-0.2 -1,-0.2 0.873 105.1 62.5 -69.6 -38.0 25.9 13.1 4.5 112 112 A A H 3< S+ 0 0 11 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.703 95.5 63.8 -61.6 -19.1 22.1 12.4 4.3 113 113 A G T << S+ 0 0 55 -4,-0.7 2,-1.8 -3,-0.5 3,-0.3 0.601 75.0 88.1 -78.6 -14.5 22.0 15.1 1.7 114 114 A F <> + 0 0 39 -3,-2.0 4,-2.7 1,-0.2 5,-0.2 -0.211 56.6 154.7 -73.9 47.5 24.2 13.0 -0.7 115 115 A T H > + 0 0 74 -2,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.847 66.1 43.0 -50.2 -49.3 20.8 11.5 -1.9 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.897 114.9 49.6 -68.8 -39.5 22.0 10.4 -5.4 117 117 A S H > S+ 0 0 2 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.907 110.1 52.3 -60.3 -45.7 25.3 9.1 -4.2 118 118 A L H X S+ 0 0 21 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.890 107.9 50.8 -60.3 -43.1 23.5 7.1 -1.5 119 119 A R H X S+ 0 0 128 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.928 110.4 49.0 -61.3 -46.4 21.2 5.5 -4.0 120 120 A M H <>S+ 0 0 42 -4,-2.0 5,-2.6 1,-0.2 4,-0.4 0.873 110.7 51.4 -62.5 -38.1 24.1 4.5 -6.2 121 121 A L H ><5S+ 0 0 4 -4,-2.4 3,-1.3 2,-0.2 -1,-0.2 0.931 109.9 48.0 -63.5 -45.6 25.9 3.0 -3.2 122 122 A Q H 3<5S+ 0 0 96 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.859 111.0 51.9 -64.3 -32.5 22.8 1.0 -2.3 123 123 A Q T 3<5S- 0 0 86 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.534 111.2-126.6 -74.2 -10.0 22.5 -0.2 -5.9 124 124 A K T < 5 + 0 0 97 -3,-1.3 2,-1.3 -4,-0.4 -3,-0.2 0.814 60.3 146.8 61.5 34.8 26.2 -1.2 -5.7 125 125 A R >< + 0 0 120 -5,-2.6 4,-2.8 1,-0.2 5,-0.2 -0.705 22.2 174.4 -95.1 79.1 27.0 0.8 -8.8 126 126 A W H > + 0 0 49 -2,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.863 67.6 45.4 -68.0 -42.7 30.4 1.5 -7.4 127 127 A D H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.915 116.5 47.3 -66.8 -40.6 32.1 3.4 -10.3 128 128 A E H > S+ 0 0 107 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.911 111.8 50.5 -64.9 -43.9 29.0 5.6 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-2.9 -9,-0.2 -2,-0.2 0.918 109.2 52.2 -58.0 -44.3 28.8 6.3 -7.0 130 130 A A H X S+ 0 0 11 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.906 109.6 48.2 -62.2 -43.0 32.4 7.3 -7.0 131 131 A V H X S+ 0 0 86 -4,-2.1 4,-0.5 1,-0.2 3,-0.3 0.926 114.4 46.9 -60.6 -44.8 32.0 9.7 -9.8 132 132 A N H >< S+ 0 0 37 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.892 106.5 56.8 -67.2 -39.9 28.9 11.2 -8.1 133 133 A L H 3< S+ 0 0 1 -4,-2.9 6,-0.4 1,-0.3 -1,-0.2 0.819 102.3 57.0 -59.4 -33.5 30.6 11.5 -4.7 134 134 A A H 3< S+ 0 0 26 -4,-1.3 2,-1.8 -3,-0.3 -1,-0.3 0.634 85.0 82.3 -75.9 -14.9 33.4 13.6 -6.2 135 135 A K S << S+ 0 0 158 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.527 81.8 98.2 -86.2 69.3 30.9 16.2 -7.5 136 136 A S S > S- 0 0 16 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.997 86.5-117.0-155.9 152.0 30.8 17.9 -4.1 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.910 115.9 62.6 -55.5 -41.9 32.1 20.7 -1.9 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.929 106.1 41.4 -47.5 -56.7 33.5 17.8 0.2 139 139 A Y H 4 S+ 0 0 64 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.912 115.2 50.9 -63.7 -43.1 35.8 16.6 -2.6 140 140 A N H < S+ 0 0 110 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.889 115.9 40.5 -64.0 -37.4 36.8 20.1 -3.7 141 141 A Q H < S+ 0 0 109 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.840 133.2 20.4 -82.8 -36.2 37.8 21.2 -0.3 142 142 A T S X S+ 0 0 20 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 -0.590 74.2 159.9-128.9 70.6 39.5 18.0 0.9 143 143 A P H > S+ 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.873 70.4 50.1 -68.0 -37.3 40.4 16.2 -2.3 144 144 A N H > S+ 0 0 108 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.939 116.6 41.1 -68.1 -43.6 43.1 13.9 -1.0 145 145 A R H > S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.928 116.0 49.9 -66.5 -45.8 41.0 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.2 0.912 107.7 55.0 -60.4 -40.6 37.9 12.4 -0.2 147 147 A K H X S+ 0 0 96 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.902 108.5 48.7 -58.0 -42.0 39.8 10.4 -2.9 148 148 A R H X S+ 0 0 55 -4,-1.7 4,-1.7 2,-0.2 12,-0.2 0.931 114.4 44.2 -62.7 -46.4 40.8 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.934 114.6 49.5 -64.4 -45.2 37.3 7.5 1.1 150 150 A I H X S+ 0 0 14 -4,-3.3 4,-2.7 1,-0.2 -2,-0.2 0.903 108.4 52.7 -61.7 -42.5 35.8 7.3 -2.5 151 151 A T H X S+ 0 0 37 -4,-2.6 4,-2.5 -5,-0.2 6,-0.4 0.867 107.1 53.9 -59.8 -37.2 38.4 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.927 111.9 43.6 -64.1 -43.7 37.3 2.7 -0.4 153 153 A F H < S+ 0 0 4 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.862 114.8 50.9 -65.6 -37.4 33.7 2.9 -1.6 154 154 A R H < S+ 0 0 107 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.924 126.8 19.7 -67.2 -41.4 34.7 2.1 -5.2 155 155 A T H < S- 0 0 40 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.671 84.3-134.3-105.9 -24.0 36.8 -1.0 -4.4 156 156 A G S < S+ 0 0 18 -4,-2.5 2,-0.3 -5,-0.3 -62,-0.2 0.757 74.1 106.7 65.1 23.9 35.7 -2.3 -1.0 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.809 79.8-122.4-123.5 170.1 39.4 -2.6 -0.2 158 158 A W S > S+ 0 0 42 -2,-0.3 3,-2.3 1,-0.2 4,-0.5 0.135 70.8 122.7 -95.1 18.3 41.9 -0.7 2.0 159 159 A D G > + 0 0 115 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.799 67.5 57.6 -55.9 -33.9 44.2 0.0 -0.9 160 160 A A G 3 S+ 0 0 23 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.625 109.0 46.8 -72.3 -11.8 44.0 3.8 -0.5 161 161 A Y G X S+ 0 0 1 -3,-2.3 3,-0.8 -13,-0.1 2,-0.4 0.366 86.3 105.4-110.6 2.9 45.3 3.5 3.1 162 162 A K T < S+ 0 0 104 -3,-0.9 -3,-0.0 -4,-0.5 0, 0.0 -0.746 82.2 27.6 -91.8 134.0 48.2 1.1 2.4 163 163 A N T 3 0 0 155 -2,-0.4 -1,-0.2 0, 0.0 -3,-0.0 0.171 360.0 360.0 91.2 -6.8 51.6 2.7 2.6 164 164 A L < 0 0 122 -3,-0.8 -2,-0.2 0, 0.0 -3,-0.0 0.496 360.0 360.0-105.6 360.0 50.0 5.2 5.0