==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 13-MAY-93 1DYA . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR X.ZHANG,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8569.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 71.6 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 . 84 51.9 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 2 1 0 0 1 1 0 0 0 0 0 0 2 0 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 76 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 143.6 43.8 -1.9 8.8 2 2 A N > - 0 0 69 95,-0.0 4,-2.6 1,-0.0 3,-0.3 -0.888 360.0 -89.6-141.3 171.8 40.8 -0.9 10.8 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.810 123.6 51.6 -53.6 -39.4 38.5 2.2 11.2 4 4 A F H > S+ 0 0 77 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.904 110.9 44.5 -66.9 -47.6 40.7 3.6 13.9 5 5 A E H > S+ 0 0 102 -3,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.908 113.9 53.8 -65.4 -35.7 44.0 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.919 111.6 41.3 -61.7 -51.0 42.2 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.4 0.830 109.8 59.5 -68.7 -32.6 40.9 7.9 10.8 8 8 A R H X S+ 0 0 106 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.923 107.6 47.0 -62.0 -36.8 44.2 8.3 12.6 9 9 A I H < S+ 0 0 90 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.926 116.5 43.6 -69.5 -42.6 45.9 8.6 9.2 10 10 A D H < S+ 0 0 20 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.808 125.3 29.1 -73.7 -31.7 43.3 11.0 7.9 11 11 A E H < S- 0 0 39 -4,-2.4 19,-0.3 1,-0.1 -3,-0.2 0.710 91.2-149.3-103.5 -26.7 43.0 13.4 10.9 12 12 A G < - 0 0 25 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.205 23.4 -88.1 79.4-175.2 46.4 13.3 12.6 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.999 42.3 173.3-133.7 130.1 47.0 13.7 16.4 14 14 A R E -A 28 0A 135 14,-1.0 14,-2.1 -2,-0.4 4,-0.1 -0.989 20.5-161.9-142.5 125.4 47.5 17.1 18.0 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.2 12,-0.2 2,-0.4 0.339 75.5 62.9 -88.7 5.4 47.7 17.6 21.8 16 16 A K E S-C 57 0B 95 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.980 98.0 -90.1-136.8 140.6 47.0 21.3 21.6 17 17 A I E + 0 0 17 39,-1.7 2,-0.3 -2,-0.4 10,-0.2 -0.175 56.8 167.3 -46.2 142.1 44.0 23.2 20.3 18 18 A Y E -A 26 0A 30 8,-2.8 8,-2.9 -4,-0.1 2,-0.4 -0.878 37.4 -98.3-149.8 173.9 44.3 24.0 16.7 19 19 A K E -A 25 0A 128 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.857 34.8-136.3-102.1 135.5 42.3 25.2 13.8 20 20 A D > - 0 0 46 4,-3.4 3,-1.1 -2,-0.4 -1,-0.1 -0.023 39.3 -86.5 -74.9-173.6 40.9 22.6 11.4 21 21 A T T 3 S+ 0 0 111 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.768 131.9 50.4 -67.5 -24.1 41.0 23.0 7.6 22 22 A E T 3 S- 0 0 79 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.443 126.1-100.3 -90.1 -6.7 37.8 25.0 7.8 23 23 A G S < S+ 0 0 37 -3,-1.1 2,-0.2 1,-0.3 -2,-0.1 0.370 76.1 141.0 99.0 6.7 39.2 27.3 10.5 24 24 A Y - 0 0 77 -5,-0.1 -4,-3.4 1,-0.1 -1,-0.3 -0.575 59.5-102.5 -90.2 152.4 37.5 25.6 13.4 25 25 A Y E +AB 19 34A 30 9,-0.8 8,-3.5 11,-0.3 9,-1.3 -0.465 54.0 161.0 -68.9 121.3 38.8 25.0 16.9 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.8 6,-0.3 2,-0.3 -0.881 19.0-172.4-138.9 164.3 39.8 21.3 17.2 27 27 A I E > + B 0 31A 0 4,-1.2 4,-1.7 -2,-0.3 -12,-0.2 -0.971 52.9 1.2-154.3 163.8 42.0 19.1 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.1 -14,-1.0 -2,-0.3 2,-0.8 -0.314 122.3 -6.9 62.1-129.4 43.2 15.4 19.5 29 29 A I T 4 S- 0 0 3 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.667 126.9 -50.6-103.5 75.5 42.1 13.2 16.5 30 30 A G T 4 S+ 0 0 18 -2,-0.8 2,-1.1 -19,-0.3 -2,-0.2 0.746 83.5 158.5 70.4 19.4 39.6 15.4 14.6 31 31 A H E < -B 27 0A 36 -4,-1.7 -4,-1.2 32,-0.0 -1,-0.2 -0.655 33.8-145.7 -81.2 99.0 37.5 16.3 17.7 32 32 A L E -B 26 0A 69 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.405 17.5-175.3 -61.1 129.7 35.7 19.6 16.6 33 33 A L E - 0 0 13 -8,-3.5 2,-0.3 1,-0.4 -7,-0.2 0.899 56.5 -26.9 -94.7 -46.1 35.4 21.8 19.6 34 34 A T E -B 25 0A 29 -9,-1.3 -9,-0.8 2,-0.1 -1,-0.4 -0.973 35.2-136.7-163.1 155.0 33.3 24.8 18.4 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.339 75.0 113.6 -95.3 1.2 32.6 26.7 15.2 36 36 A S S S- 0 0 40 2,-0.1 -11,-0.3 1,-0.1 6,-0.1 -0.536 72.0-132.6 -78.7 138.5 32.9 29.8 17.2 37 37 A P S S+ 0 0 123 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.624 75.9 104.4 -64.8 -10.4 35.7 32.3 16.6 38 38 A S > - 0 0 48 1,-0.2 4,-2.2 2,-0.1 3,-0.2 -0.647 56.4-161.3 -89.8 123.3 36.6 32.5 20.2 39 39 A L H > S+ 0 0 70 -2,-0.7 4,-1.7 1,-0.3 -1,-0.2 0.726 101.6 53.9 -59.2 -24.3 39.6 30.7 21.5 40 40 A N H > S+ 0 0 120 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.883 101.7 52.4 -81.2 -39.1 37.9 31.2 24.7 41 41 A A H > S+ 0 0 36 -3,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.901 114.2 48.9 -61.3 -32.1 34.7 29.6 23.6 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.814 107.1 51.8 -71.6 -42.3 37.0 26.7 22.6 43 43 A K H X S+ 0 0 52 -4,-1.7 4,-1.5 2,-0.2 11,-0.3 0.860 111.6 48.1 -67.5 -31.6 38.9 26.4 25.8 44 44 A S H X S+ 0 0 75 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.916 109.8 50.6 -73.8 -43.3 35.7 26.2 27.8 45 45 A E H X S+ 0 0 63 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.889 109.5 54.4 -60.5 -39.4 34.2 23.5 25.5 46 46 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 5,-0.3 0.901 107.5 46.9 -64.3 -40.7 37.4 21.6 25.9 47 47 A D H X>S+ 0 0 36 -4,-1.5 4,-2.1 2,-0.2 5,-0.6 0.862 111.5 52.0 -70.6 -32.8 37.3 21.6 29.7 48 48 A K H <5S+ 0 0 148 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.919 112.1 47.7 -65.1 -44.2 33.6 20.6 29.6 49 49 A A H <5S+ 0 0 45 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.869 120.7 34.5 -64.5 -40.9 34.6 17.7 27.3 50 50 A I H <5S- 0 0 37 -4,-2.3 -1,-0.2 2,-0.3 -2,-0.2 0.738 100.3-125.6 -90.4 -28.8 37.6 16.5 29.4 51 51 A G T <5S+ 0 0 69 -4,-2.1 2,-0.3 1,-0.4 -3,-0.2 0.725 78.6 75.9 91.3 14.1 36.3 17.2 32.9 52 52 A R S - 0 0 10 -2,-0.7 3,-1.0 -11,-0.3 -1,-0.2 0.703 34.4-145.5-103.7 -31.1 43.2 21.9 30.4 55 55 A N T 3 S- 0 0 111 1,-0.3 -2,-0.1 -12,-0.2 -12,-0.1 0.942 75.6 -52.3 56.2 53.5 44.1 25.3 29.3 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.582 119.4 98.9 64.4 15.4 44.0 24.1 25.7 57 57 A V B < +C 16 0B 66 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.990 44.7 177.5-137.1 137.8 46.3 21.1 26.2 58 58 A I - 0 0 4 -43,-2.2 2,-0.2 -2,-0.4 -30,-0.1 -0.867 27.3-109.8-132.3 165.3 45.5 17.4 26.7 59 59 A T > - 0 0 65 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.503 33.6-108.4 -90.0 162.9 47.3 14.1 27.1 60 60 A K H > S+ 0 0 101 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.875 121.0 54.2 -55.0 -45.8 47.4 11.2 24.5 61 61 A D H > S+ 0 0 117 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.899 108.3 49.2 -55.3 -45.4 45.2 9.2 26.6 62 62 A E H > S+ 0 0 36 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.874 109.9 51.1 -66.0 -38.0 42.7 12.0 26.7 63 63 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -34,-0.5 0.838 111.3 48.1 -65.8 -35.6 42.8 12.4 22.9 64 64 A E H X S+ 0 0 77 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.795 108.0 54.4 -75.7 -31.2 42.2 8.7 22.5 65 65 A K H X S+ 0 0 134 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.927 110.5 46.3 -67.5 -43.8 39.3 8.7 24.9 66 66 A L H X S+ 0 0 4 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.893 111.9 52.6 -63.9 -39.4 37.7 11.4 22.9 67 67 A F H X S+ 0 0 11 -4,-1.6 4,-2.2 2,-0.2 5,-0.3 0.954 106.5 51.4 -62.9 -49.1 38.4 9.5 19.7 68 68 A N H X S+ 0 0 95 -4,-2.8 4,-1.9 1,-0.2 5,-0.2 0.922 111.7 48.7 -56.2 -40.9 36.8 6.3 21.0 69 69 A Q H X S+ 0 0 93 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.891 110.8 50.3 -62.5 -43.0 33.6 8.3 21.9 70 70 A D H X S+ 0 0 35 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.864 110.7 47.2 -65.2 -38.3 33.5 10.0 18.5 71 71 A V H X S+ 0 0 7 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.927 115.1 46.9 -70.0 -43.8 33.8 6.7 16.5 72 72 A D H X S+ 0 0 88 -4,-1.9 4,-3.0 -5,-0.3 5,-0.3 0.951 112.8 48.7 -62.1 -47.4 31.1 5.1 18.6 73 73 A A H X S+ 0 0 43 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.910 111.7 51.8 -60.1 -41.0 28.9 8.2 18.3 74 74 A A H X S+ 0 0 8 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.965 111.1 45.2 -61.4 -51.4 29.5 8.0 14.5 75 75 A V H X S+ 0 0 36 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.945 114.2 48.6 -59.2 -46.4 28.5 4.3 14.2 76 76 A R H X S+ 0 0 112 -4,-3.0 4,-0.9 1,-0.2 -1,-0.2 0.881 108.4 55.7 -62.2 -34.5 25.4 4.8 16.4 77 77 A G H < S+ 0 0 3 -4,-2.2 3,-0.5 -5,-0.3 -1,-0.2 0.910 107.7 47.1 -65.0 -43.2 24.4 7.8 14.4 78 78 A I H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 7,-0.4 0.921 112.2 49.9 -61.0 -44.1 24.5 5.8 11.1 79 79 A L H 3< S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.638 114.0 47.0 -73.5 -13.0 22.5 2.9 12.6 80 80 A R T 3< S+ 0 0 169 -4,-0.9 2,-0.6 -3,-0.5 -1,-0.3 0.232 93.5 93.5-104.5 -3.5 19.9 5.4 13.9 81 81 A N <> - 0 0 21 -3,-1.3 4,-2.7 -4,-0.2 -4,-0.0 -0.886 65.5-149.0-101.7 126.8 19.6 7.3 10.7 82 82 A A T 4 S+ 0 0 90 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.0 0.739 99.4 41.8 -65.9 -19.2 16.8 6.3 8.3 83 83 A K T > S+ 0 0 124 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.836 121.1 39.2 -93.0 -34.3 18.8 7.3 5.3 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.5 2,-0.1 3,-0.3 0.867 102.0 68.4 -82.8 -40.4 22.2 6.0 6.3 85 85 A K H X S+ 0 0 80 -4,-2.7 4,-2.6 -7,-0.4 5,-0.2 0.912 99.0 49.1 -47.5 -54.0 21.2 2.7 8.0 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.879 112.7 48.6 -58.6 -36.6 20.0 0.9 4.8 87 87 A V H X S+ 0 0 2 -4,-0.5 4,-0.7 -3,-0.3 -2,-0.2 0.962 111.1 49.4 -67.8 -48.7 23.3 1.9 3.0 88 88 A Y H >< S+ 0 0 35 -4,-2.5 3,-1.9 1,-0.2 -1,-0.2 0.948 110.7 50.2 -53.2 -52.9 25.4 0.7 5.8 89 89 A D H 3< S+ 0 0 78 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.822 107.7 54.7 -59.1 -35.2 23.6 -2.7 6.0 90 90 A S H 3< S+ 0 0 36 -4,-1.6 -1,-0.3 -5,-0.2 2,-0.2 0.612 97.1 88.8 -71.8 -13.9 24.0 -3.2 2.3 91 91 A L S << S- 0 0 6 -3,-1.9 31,-0.0 -4,-0.7 30,-0.0 -0.637 73.7-117.8 -97.4 156.5 27.8 -2.7 2.3 92 92 A D > - 0 0 55 -2,-0.2 4,-1.8 1,-0.1 5,-0.1 -0.074 44.8 -92.1 -71.6 174.3 30.8 -5.0 2.8 93 93 A A H > S+ 0 0 74 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.845 121.0 46.3 -64.2 -35.0 33.2 -4.5 5.7 94 94 A V H > S+ 0 0 27 62,-0.2 4,-1.2 2,-0.2 3,-0.5 0.948 113.1 47.3 -72.1 -47.8 35.7 -2.2 4.0 95 95 A R H > S+ 0 0 23 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.825 104.4 62.6 -62.0 -33.8 33.2 0.1 2.4 96 96 A R H X S+ 0 0 78 -4,-1.8 4,-2.2 1,-0.2 -1,-0.3 0.894 100.7 53.8 -58.5 -39.2 31.4 0.3 5.8 97 97 A C H X S+ 0 0 19 -4,-1.1 4,-2.5 -3,-0.5 -1,-0.2 0.895 104.3 55.1 -61.0 -38.5 34.6 1.9 7.1 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.876 108.1 48.0 -64.5 -38.2 34.5 4.5 4.3 99 99 A L H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.890 110.3 51.1 -70.4 -42.5 31.0 5.6 5.3 100 100 A I H X S+ 0 0 7 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.922 107.1 55.8 -61.6 -38.8 32.0 5.8 8.9 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 5,-0.2 0.967 109.0 45.5 -57.5 -51.1 35.0 8.0 7.8 102 102 A M H X S+ 0 0 3 -4,-1.9 4,-3.4 1,-0.2 5,-0.3 0.878 112.9 51.4 -58.6 -39.8 32.7 10.6 6.0 103 103 A V H X S+ 0 0 9 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.949 108.5 49.9 -65.8 -45.8 30.2 10.6 8.9 104 104 A F H < S+ 0 0 30 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.897 119.8 38.5 -52.9 -47.4 33.0 11.3 11.5 105 105 A Q H < S+ 0 0 61 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.880 132.5 20.5 -73.7 -48.7 34.3 14.2 9.3 106 106 A M H X S- 0 0 50 -4,-3.4 4,-0.6 -5,-0.2 -3,-0.2 0.464 102.3-117.1-112.0 1.0 31.1 15.7 8.0 107 107 A G H X - 0 0 34 -4,-2.8 4,-2.2 -5,-0.3 5,-0.2 0.156 32.6 -81.0 77.5 154.7 28.3 14.6 10.4 108 108 A E H > S+ 0 0 50 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.904 128.2 52.4 -59.2 -48.0 25.3 12.5 9.8 109 109 A T H > S+ 0 0 126 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.914 108.6 51.5 -58.7 -42.9 23.3 15.3 8.3 110 110 A G H >< S+ 0 0 30 -4,-0.6 3,-1.2 1,-0.2 4,-0.2 0.958 113.6 41.2 -58.6 -55.9 26.0 16.1 5.9 111 111 A V H >< S+ 0 0 1 -4,-2.2 3,-2.4 1,-0.3 -1,-0.2 0.899 106.9 62.8 -62.1 -39.0 26.4 12.6 4.5 112 112 A A H 3< S+ 0 0 12 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.740 96.1 63.6 -60.7 -17.0 22.7 12.1 4.5 113 113 A G T << S+ 0 0 56 -3,-1.2 2,-1.2 -4,-0.8 -1,-0.3 0.505 75.7 86.6 -81.7 -9.0 22.6 14.9 2.0 114 114 A F X> + 0 0 43 -3,-2.4 4,-2.2 -4,-0.2 3,-0.5 -0.299 57.3 162.0 -87.9 53.6 24.6 13.1 -0.7 115 115 A T H 3> + 0 0 86 -2,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.779 66.2 44.5 -39.3 -52.6 21.3 11.5 -1.9 116 116 A N H 3> S+ 0 0 86 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.847 113.2 49.1 -66.9 -41.6 22.5 10.3 -5.4 117 117 A S H <> S+ 0 0 1 -3,-0.5 4,-2.3 2,-0.2 5,-0.2 0.876 109.9 52.8 -63.1 -45.5 25.8 8.8 -4.2 118 118 A L H X S+ 0 0 15 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.901 108.5 51.1 -59.6 -41.6 24.0 6.9 -1.4 119 119 A R H X S+ 0 0 123 -4,-1.5 4,-1.4 -5,-0.3 -2,-0.2 0.910 111.7 47.3 -65.7 -37.4 21.6 5.5 -4.0 120 120 A M H <>S+ 0 0 25 -4,-1.9 5,-2.2 2,-0.2 -1,-0.2 0.857 109.9 50.9 -74.3 -35.2 24.5 4.4 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.925 109.1 53.0 -67.2 -39.0 26.5 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 91 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.897 109.8 47.3 -62.7 -33.4 23.4 0.9 -2.4 123 123 A Q T 3<5S- 0 0 83 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.427 112.7-123.0 -86.1 2.2 23.1 -0.4 -5.9 124 124 A K T < 5 + 0 0 101 -3,-1.9 2,-1.3 -4,-0.2 -3,-0.2 0.746 60.6 148.0 59.9 33.6 26.8 -1.3 -5.9 125 125 A R >< + 0 0 112 -5,-2.2 4,-2.1 1,-0.2 -1,-0.2 -0.730 22.3 175.8 -96.3 75.8 27.5 0.9 -8.9 126 126 A W H > + 0 0 48 -2,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.849 68.3 44.8 -51.5 -57.1 31.0 1.6 -7.6 127 127 A D H > S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.903 115.3 50.5 -60.4 -40.5 32.6 3.6 -10.4 128 128 A E H > S+ 0 0 108 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.901 109.9 47.8 -68.1 -40.8 29.5 5.7 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.828 110.5 54.0 -68.1 -30.9 29.3 6.5 -7.1 130 130 A A H X S+ 0 0 1 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.911 109.2 48.0 -69.0 -43.0 33.0 7.4 -7.1 131 131 A D H < S+ 0 0 92 -4,-2.3 4,-0.4 1,-0.2 3,-0.2 0.894 113.7 46.4 -64.3 -39.5 32.5 9.9 -9.9 132 132 A N H >< S+ 0 0 42 -4,-1.9 3,-1.1 1,-0.2 -2,-0.2 0.857 106.3 57.6 -72.5 -36.3 29.5 11.5 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-2.1 6,-0.3 1,-0.2 -1,-0.2 0.852 98.9 62.0 -62.2 -31.4 31.1 11.8 -4.8 134 134 A A T 3< S+ 0 0 28 -4,-1.1 2,-1.6 -3,-0.2 -1,-0.2 0.710 86.2 78.4 -69.9 -19.3 34.0 13.9 -6.5 135 135 A K S < S+ 0 0 157 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.2 -0.510 79.9 95.8 -89.2 65.7 31.4 16.5 -7.4 136 136 A S S > S- 0 0 19 -2,-1.6 4,-1.8 1,-0.1 3,-0.3 -0.991 84.8-115.7-152.0 157.5 31.2 18.1 -4.0 137 137 A R H > S+ 0 0 149 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.897 114.5 64.0 -59.2 -38.5 32.6 20.9 -2.0 138 138 A W H > S+ 0 0 18 1,-0.3 4,-2.2 2,-0.2 8,-0.2 0.905 104.1 43.7 -51.6 -50.2 34.1 18.1 0.2 139 139 A Y H 4 S+ 0 0 55 -6,-0.3 -1,-0.3 -3,-0.3 -2,-0.2 0.818 114.7 50.3 -67.5 -37.2 36.3 16.8 -2.6 140 140 A N H < S+ 0 0 111 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.862 113.8 44.5 -72.5 -34.7 37.3 20.3 -3.6 141 141 A Q H < S+ 0 0 102 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.880 131.5 17.1 -75.2 -43.9 38.2 21.4 -0.1 142 142 A T S X S+ 0 0 21 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 -0.545 72.4 165.1-130.2 71.0 40.2 18.3 1.0 143 143 A P H > S+ 0 0 49 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.788 70.2 53.0 -58.1 -39.5 41.1 16.5 -2.2 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.921 116.0 39.9 -66.1 -44.7 43.8 14.1 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.3 -3,-0.2 3,-0.3 0.933 114.8 53.4 -67.2 -49.6 41.6 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.2 0.945 109.3 50.5 -49.3 -50.0 38.4 12.7 -0.3 147 147 A K H X S+ 0 0 87 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.860 107.3 52.2 -57.7 -40.9 40.4 10.6 -2.9 148 148 A R H X S+ 0 0 69 -4,-1.4 4,-1.7 -3,-0.3 -1,-0.2 0.952 114.5 42.8 -60.0 -49.0 41.5 8.1 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.910 113.3 52.2 -60.6 -48.1 37.8 7.6 0.9 150 150 A I H X S+ 0 0 6 -4,-3.3 4,-1.9 -5,-0.2 -1,-0.2 0.786 107.9 50.2 -59.1 -37.0 36.5 7.5 -2.6 151 151 A T H X S+ 0 0 41 -4,-1.6 4,-2.8 -5,-0.2 5,-0.4 0.858 105.2 58.0 -70.8 -36.5 39.0 4.9 -3.7 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.886 111.1 43.0 -59.5 -37.4 38.0 2.8 -0.7 153 153 A F H < S+ 0 0 0 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.879 114.2 50.2 -74.3 -40.4 34.4 2.9 -2.1 154 154 A R H < S+ 0 0 82 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.937 126.6 21.5 -64.2 -46.0 35.4 2.3 -5.6 155 155 A T H < S- 0 0 60 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.728 84.2-135.2 -97.1 -34.9 37.6 -0.8 -4.9 156 156 A G S < S+ 0 0 18 -4,-2.2 2,-0.2 -5,-0.4 -62,-0.2 0.645 71.9 101.0 82.1 14.7 36.6 -2.2 -1.6 157 157 A T S S- 0 0 48 -6,-0.3 3,-0.4 -63,-0.1 -1,-0.3 -0.755 80.5-117.9-125.9 171.4 40.3 -2.6 -0.5 158 158 A W S > S+ 0 0 39 -2,-0.2 3,-2.3 1,-0.2 4,-0.3 0.176 72.8 122.4 -95.8 14.9 42.6 -0.7 1.8 159 159 A D G > + 0 0 99 1,-0.3 3,-1.8 2,-0.2 -1,-0.2 0.810 65.0 58.2 -46.0 -43.9 44.9 0.1 -1.0 160 160 A A G 3 S+ 0 0 36 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.695 109.8 47.1 -64.6 -17.4 44.7 3.9 -0.7 161 161 A Y G < 0 0 18 -3,-2.3 -1,-0.3 -13,-0.1 -2,-0.2 0.299 360.0 360.0-108.5 7.6 45.9 3.6 2.8 162 162 A K < 0 0 168 -3,-1.8 -2,-0.2 -4,-0.3 -3,-0.1 0.710 360.0 360.0-117.1 360.0 48.7 1.4 2.2