==== 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 128L . 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) . 8677.0 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 1 0 1 2 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 63 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 145.5 43.8 -1.7 9.2 2 2 A N > - 0 0 68 156,-0.0 4,-2.5 95,-0.0 3,-0.2 -0.904 360.0 -82.9-147.9 175.2 40.6 -0.8 10.9 3 3 A I H > S+ 0 0 24 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.838 125.2 52.0 -51.8 -41.1 38.4 2.4 11.3 4 4 A F H > S+ 0 0 80 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.918 112.4 42.6 -66.0 -46.8 40.6 3.7 14.2 5 5 A E H > S+ 0 0 102 -3,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.873 114.7 53.1 -68.0 -35.7 43.9 3.4 12.4 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.941 112.1 42.7 -62.2 -51.8 42.2 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 5,-0.4 0.809 109.7 58.5 -65.7 -31.1 40.9 7.9 11.0 8 8 A R H X S+ 0 0 102 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.870 108.1 47.0 -69.6 -29.6 44.2 8.3 12.9 9 9 A I H < S+ 0 0 88 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.925 116.2 43.4 -74.3 -45.5 46.0 8.6 9.6 10 10 A D H < S+ 0 0 21 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.822 125.8 29.7 -68.6 -34.9 43.5 11.1 8.1 11 11 A E H < S- 0 0 48 -4,-2.0 19,-0.3 -5,-0.1 -3,-0.2 0.724 90.4-156.1 -99.3 -32.8 43.1 13.4 11.2 12 12 A G < - 0 0 21 -4,-1.5 2,-0.4 -5,-0.4 -1,-0.1 -0.182 25.6 -83.5 76.8-171.4 46.5 13.1 12.9 13 13 A L + 0 0 37 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.967 41.6 172.7-138.7 123.1 47.0 13.8 16.6 14 14 A R E -A 28 0A 142 14,-1.6 14,-2.1 -2,-0.4 4,-0.1 -0.994 17.7-164.6-131.9 131.4 47.5 17.2 18.4 15 15 A L E S+ 0 0 69 -2,-0.4 43,-2.0 12,-0.2 2,-0.3 0.329 74.0 64.7 -96.8 4.6 47.5 17.7 22.1 16 16 A K E S-C 57 0B 95 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.960 100.2 -87.4-128.0 145.5 47.1 21.5 22.0 17 17 A I E + 0 0 18 39,-1.4 2,-0.3 -2,-0.3 10,-0.2 -0.252 59.4 166.3 -50.5 133.6 44.0 23.5 20.7 18 18 A Y E -A 26 0A 27 8,-2.5 8,-2.9 -4,-0.1 2,-0.4 -0.888 36.4-103.8-141.7 172.5 44.4 24.0 16.9 19 19 A K E -A 25 0A 122 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.854 31.5-136.7-104.3 139.4 42.4 25.2 14.0 20 20 A D > - 0 0 52 4,-2.9 3,-1.2 -2,-0.4 -1,-0.1 0.005 40.8 -83.1 -77.9-171.9 41.0 22.7 11.4 21 21 A T T 3 S+ 0 0 109 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.739 133.0 50.1 -66.1 -21.9 41.0 23.1 7.6 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.405 123.7-105.2 -90.0 -7.0 37.8 25.2 8.0 23 23 A G S < S+ 0 0 37 -3,-1.2 2,-0.3 1,-0.3 -2,-0.1 0.554 73.6 141.1 91.3 12.8 39.3 27.3 10.6 24 24 A Y - 0 0 77 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.3 -0.700 60.2 -99.2 -94.0 148.6 37.5 25.8 13.6 25 25 A Y E +AB 19 34A 36 9,-0.7 8,-2.9 11,-0.4 9,-1.2 -0.397 54.6 163.4 -63.3 121.1 38.9 25.1 17.1 26 26 A T E -AB 18 32A 4 -8,-2.9 -8,-2.5 6,-0.2 2,-0.3 -0.897 18.9-168.2-135.3 161.8 39.8 21.4 17.4 27 27 A I E > - B 0 31A 0 4,-1.7 4,-2.0 -2,-0.3 -12,-0.2 -0.981 52.1 -3.4-148.3 161.3 41.8 19.2 19.6 28 28 A G E 4 S-A 14 0A 0 -14,-2.1 -14,-1.6 -2,-0.3 2,-0.9 -0.372 122.4 -3.4 68.4-130.1 43.2 15.5 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.663 128.3 -53.4-100.4 70.9 42.2 13.3 16.8 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.782 82.8 161.5 69.6 26.5 39.8 15.5 14.9 31 31 A H E < -B 27 0A 31 -4,-2.0 -4,-1.7 32,-0.0 -1,-0.2 -0.698 33.1-142.3 -83.8 102.3 37.6 16.4 17.9 32 32 A L E -B 26 0A 70 -2,-1.0 -6,-0.2 -6,-0.2 3,-0.1 -0.408 20.3-177.4 -63.0 128.3 35.7 19.6 16.9 33 33 A L E - 0 0 15 -8,-2.9 2,-0.3 1,-0.4 -7,-0.2 0.896 57.5 -26.7 -92.4 -52.7 35.3 21.9 19.9 34 34 A T E -B 25 0A 29 -9,-1.2 -9,-0.7 2,-0.1 -1,-0.4 -0.975 35.4-139.5-160.7 152.3 33.3 24.9 18.6 35 35 A K S S+ 0 0 135 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.499 74.7 111.5 -92.4 -7.8 32.6 26.7 15.3 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.410 74.0-131.2 -67.3 141.5 32.8 30.0 17.3 37 37 A P S S+ 0 0 123 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.436 75.7 106.6 -72.9 0.3 35.7 32.3 16.7 38 38 A S > - 0 0 48 1,-0.2 4,-1.7 2,-0.0 5,-0.1 -0.745 56.3-161.2 -92.1 123.4 36.4 32.6 20.4 39 39 A L H > S+ 0 0 72 -2,-0.7 4,-2.0 1,-0.2 -1,-0.2 0.779 96.6 55.2 -65.2 -21.6 39.4 30.9 21.7 40 40 A N H > S+ 0 0 121 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.910 103.0 50.8 -79.4 -38.0 37.7 31.3 25.1 41 41 A A H > S+ 0 0 37 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.865 111.4 53.1 -62.3 -32.6 34.6 29.6 24.1 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.888 108.4 47.2 -66.8 -44.6 36.9 26.8 22.8 43 43 A K H X S+ 0 0 46 -4,-2.0 4,-2.1 1,-0.2 11,-0.2 0.868 110.5 53.6 -67.3 -35.6 38.8 26.4 26.1 44 44 A S H X S+ 0 0 74 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.934 109.2 46.9 -65.2 -45.0 35.5 26.3 27.9 45 45 A E H X S+ 0 0 65 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.903 111.0 54.4 -60.6 -41.8 34.1 23.5 25.7 46 46 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 5,-0.3 0.909 107.7 46.8 -60.8 -44.5 37.4 21.6 26.2 47 47 A D H X>S+ 0 0 34 -4,-2.1 4,-2.2 1,-0.2 5,-1.1 0.876 112.5 51.9 -66.3 -36.4 37.2 21.7 30.0 48 48 A K H <5S+ 0 0 147 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.898 110.9 48.0 -60.9 -47.0 33.6 20.6 29.8 49 49 A A H <5S+ 0 0 44 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.864 120.5 35.7 -63.9 -38.4 34.6 17.7 27.5 50 50 A I H <5S- 0 0 37 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.698 99.2-128.7 -92.0 -25.8 37.5 16.5 29.8 51 51 A G T <5S+ 0 0 68 -4,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.831 76.5 75.4 81.1 29.1 36.1 17.3 33.2 52 52 A R S - 0 0 9 -2,-1.0 3,-1.4 -11,-0.2 -1,-0.2 0.709 33.6-145.9 -95.4 -25.2 42.9 22.1 31.0 55 55 A N T 3 S- 0 0 113 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.886 76.4 -56.9 55.8 38.0 44.1 25.4 29.9 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.4 1,-0.1 2,-0.4 0.503 115.5 103.3 74.7 8.4 44.0 24.1 26.3 57 57 A V B < +C 16 0B 70 -3,-1.4 2,-0.3 -41,-0.2 -41,-0.2 -0.973 42.3 177.4-127.0 138.7 46.3 21.1 26.7 58 58 A I - 0 0 4 -43,-2.0 2,-0.2 -2,-0.4 -30,-0.1 -0.854 26.0-114.7-129.7 166.0 45.4 17.4 27.0 59 59 A T > - 0 0 68 -2,-0.3 4,-2.3 1,-0.1 3,-0.4 -0.559 35.1-101.3 -95.8 167.6 47.4 14.2 27.4 60 60 A K H > S+ 0 0 111 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.857 121.7 50.3 -53.0 -45.1 47.5 11.3 24.9 61 61 A D H > S+ 0 0 119 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.860 109.1 51.5 -61.2 -41.9 45.0 9.1 26.9 62 62 A E H > S+ 0 0 40 -3,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.897 109.9 49.8 -66.1 -40.6 42.6 12.0 27.1 63 63 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -34,-0.4 0.865 111.0 50.5 -63.8 -39.4 42.8 12.4 23.3 64 64 A E H X S+ 0 0 79 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.804 106.7 53.8 -69.0 -31.3 42.2 8.7 22.9 65 65 A K H X S+ 0 0 132 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.944 108.8 47.5 -70.4 -41.0 39.2 8.7 25.1 66 66 A L H X S+ 0 0 5 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.915 111.0 54.3 -61.7 -40.4 37.5 11.5 23.1 67 67 A F H X S+ 0 0 12 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.934 106.0 50.6 -62.3 -44.8 38.4 9.6 20.0 68 68 A N H X S+ 0 0 88 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.938 112.8 47.4 -58.5 -44.6 36.6 6.4 21.3 69 69 A Q H X S+ 0 0 98 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.870 111.1 51.0 -60.2 -43.9 33.5 8.4 22.1 70 70 A D H X S+ 0 0 33 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.884 111.2 46.7 -65.0 -41.6 33.5 10.1 18.7 71 71 A V H X S+ 0 0 5 -4,-2.3 4,-2.1 2,-0.2 5,-0.2 0.955 113.6 48.9 -66.2 -48.1 33.8 6.8 16.7 72 72 A D H X S+ 0 0 90 -4,-2.6 4,-2.2 -5,-0.2 5,-0.3 0.956 112.1 49.0 -56.3 -49.0 31.1 5.3 18.9 73 73 A A H X S+ 0 0 57 -4,-2.8 4,-3.0 -5,-0.2 -1,-0.2 0.890 109.2 53.8 -56.6 -42.2 28.8 8.3 18.3 74 74 A A H X S+ 0 0 10 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.957 109.6 44.8 -58.5 -55.4 29.5 8.2 14.5 75 75 A V H X S+ 0 0 33 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.942 116.6 48.1 -52.3 -51.6 28.4 4.5 14.1 76 76 A R H X S+ 0 0 147 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.891 107.4 53.1 -60.2 -43.6 25.3 5.1 16.3 77 77 A G H >< S+ 0 0 4 -4,-3.0 3,-0.6 -5,-0.3 4,-0.5 0.953 109.9 50.6 -60.6 -40.5 24.3 8.2 14.5 78 78 A I H >< S+ 0 0 0 -4,-2.3 3,-0.9 1,-0.2 7,-0.3 0.920 109.3 50.5 -58.1 -45.5 24.5 6.2 11.2 79 79 A L H 3< S+ 0 0 73 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.692 111.5 47.6 -69.0 -18.5 22.3 3.4 12.7 80 80 A R T << S+ 0 0 189 -4,-1.5 2,-0.6 -3,-0.6 -1,-0.2 0.378 93.7 96.2 -99.9 -4.3 19.6 5.9 13.9 81 81 A N <> - 0 0 21 -3,-0.9 4,-2.8 -4,-0.5 3,-0.1 -0.820 63.6-152.0 -97.3 122.3 19.5 7.7 10.6 82 82 A A T 4 S+ 0 0 87 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.0 0.785 97.3 44.3 -59.0 -31.0 16.8 6.8 8.0 83 83 A K T 4 S+ 0 0 114 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.796 120.0 37.8 -85.5 -27.2 19.0 7.8 5.1 84 84 A L T > S+ 0 0 0 -7,-0.1 4,-2.4 -6,-0.1 3,-0.4 0.861 100.6 68.2 -90.0 -41.6 22.2 6.3 6.2 85 85 A K H X S+ 0 0 80 -4,-2.8 4,-2.7 -7,-0.3 5,-0.2 0.884 97.5 52.2 -50.5 -45.4 21.3 3.0 7.7 86 86 A P H > S+ 0 0 61 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.891 111.8 47.2 -62.3 -37.5 20.1 1.3 4.5 87 87 A T H > S+ 0 0 0 -4,-0.5 4,-1.0 -3,-0.4 3,-0.3 0.944 112.5 49.1 -66.8 -48.7 23.4 2.2 2.8 88 88 A Y H >< S+ 0 0 32 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.938 109.4 52.0 -54.0 -51.3 25.5 1.0 5.7 89 89 A D H 3< S+ 0 0 76 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.821 107.7 54.8 -57.5 -30.9 23.6 -2.3 6.0 90 90 A S H 3< S+ 0 0 41 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.692 95.6 84.2 -75.2 -24.2 24.2 -3.0 2.3 91 91 A L S << S- 0 0 5 -3,-1.0 31,-0.0 -4,-1.0 30,-0.0 -0.446 76.4-114.1 -86.0 157.4 28.0 -2.6 2.3 92 92 A D > - 0 0 56 -2,-0.1 4,-1.6 1,-0.1 -1,-0.1 -0.163 44.9 -92.0 -73.6 176.1 30.8 -4.9 3.1 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.866 121.5 47.8 -64.3 -38.1 33.1 -4.2 6.1 94 94 A V H > S+ 0 0 27 1,-0.2 4,-1.3 2,-0.2 3,-0.4 0.952 112.6 47.4 -69.7 -45.8 35.7 -2.2 4.5 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.800 105.0 61.6 -66.3 -27.2 33.3 0.1 2.7 96 96 A R H X S+ 0 0 81 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.887 100.7 54.0 -63.0 -39.2 31.4 0.5 6.0 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.1 -3,-0.4 -2,-0.2 0.898 105.5 54.8 -61.2 -37.3 34.7 2.0 7.4 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.871 108.8 46.6 -64.6 -38.7 34.6 4.5 4.5 99 99 A L H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.895 110.2 52.3 -72.1 -35.6 31.2 5.7 5.3 100 100 A I H X S+ 0 0 9 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.908 107.1 55.9 -65.8 -36.5 32.0 6.1 9.0 101 101 A N H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.944 106.8 47.3 -61.0 -47.1 34.9 8.2 7.9 102 102 A M H X S+ 0 0 4 -4,-1.8 4,-2.8 1,-0.2 5,-0.3 0.888 112.9 49.3 -61.8 -41.8 32.8 10.6 6.0 103 103 A V H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.906 108.0 53.4 -65.9 -39.4 30.3 10.9 8.9 104 104 A F H < S+ 0 0 32 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.903 116.6 40.4 -61.3 -39.1 33.1 11.5 11.4 105 105 A Q H < S+ 0 0 58 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.858 132.8 16.7 -77.8 -44.1 34.4 14.4 9.2 106 106 A M H X S- 0 0 54 -4,-2.8 4,-0.7 -5,-0.2 -3,-0.2 0.477 101.9-117.6-117.0 3.1 31.2 16.1 8.1 107 107 A G H X - 0 0 32 -4,-2.1 4,-2.2 -5,-0.3 5,-0.2 0.198 36.3 -74.4 77.1 161.5 28.4 14.9 10.3 108 108 A E H > S+ 0 0 56 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.864 128.1 52.9 -60.7 -38.4 25.3 12.9 9.6 109 109 A T H > S+ 0 0 125 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.960 108.5 48.8 -65.4 -48.7 23.5 15.8 8.0 110 110 A G H >< S+ 0 0 35 -4,-0.7 3,-1.0 1,-0.2 -2,-0.2 0.952 115.4 44.5 -53.1 -54.7 26.3 16.5 5.6 111 111 A V H >< S+ 0 0 1 -4,-2.2 3,-2.9 1,-0.3 -2,-0.2 0.920 105.9 59.5 -58.7 -47.2 26.6 12.9 4.6 112 112 A A H 3< S+ 0 0 14 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.766 96.4 67.0 -55.1 -22.2 22.8 12.4 4.3 113 113 A G T << S+ 0 0 58 -4,-1.2 2,-0.8 -3,-1.0 -1,-0.3 0.541 76.8 82.4 -74.6 -9.0 23.0 15.2 1.7 114 114 A F <> + 0 0 40 -3,-2.9 4,-2.1 1,-0.2 3,-0.3 -0.261 57.7 153.8 -91.5 51.5 25.0 12.9 -0.8 115 115 A T H > + 0 0 81 -2,-0.8 4,-1.7 1,-0.2 -1,-0.2 0.828 65.9 45.2 -44.7 -57.2 21.7 11.3 -1.9 116 116 A N H > S+ 0 0 92 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.858 113.4 50.6 -60.1 -39.9 22.7 10.2 -5.5 117 117 A S H > S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.884 109.7 50.1 -67.7 -41.8 26.0 8.8 -4.3 118 118 A L H X S+ 0 0 11 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.891 109.7 51.3 -62.8 -41.2 24.3 6.7 -1.5 119 119 A R H X S+ 0 0 95 -4,-1.7 4,-1.4 -5,-0.2 -2,-0.2 0.928 111.3 48.4 -64.0 -40.9 21.8 5.4 -4.0 120 120 A M H <>S+ 0 0 26 -4,-2.1 5,-2.1 1,-0.2 4,-0.3 0.889 109.9 50.9 -67.7 -37.6 24.8 4.4 -6.2 121 121 A L H ><5S+ 0 0 1 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.951 107.7 53.5 -64.8 -45.1 26.7 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 82 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.860 109.1 49.3 -56.1 -36.0 23.5 0.6 -2.4 123 123 A Q T 3<5S- 0 0 84 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.487 111.7-124.6 -81.4 -5.5 23.4 -0.5 -6.0 124 124 A K T < 5 + 0 0 100 -3,-2.0 2,-1.3 -4,-0.3 -3,-0.2 0.813 59.4 148.2 65.0 32.4 27.1 -1.5 -5.9 125 125 A R >< + 0 0 118 -5,-2.1 4,-2.6 1,-0.2 5,-0.2 -0.700 20.7 174.6 -97.0 76.2 27.9 0.7 -9.0 126 126 A W H > + 0 0 52 -2,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.885 69.8 45.2 -53.8 -51.6 31.4 1.4 -7.6 127 127 A D H > S+ 0 0 112 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.906 115.1 48.6 -61.8 -43.9 32.9 3.4 -10.5 128 128 A E H > S+ 0 0 116 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.882 110.8 50.3 -64.1 -41.6 29.8 5.5 -10.9 129 129 A A H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.899 107.8 53.9 -64.2 -42.0 29.7 6.3 -7.2 130 130 A A H X S+ 0 0 12 -4,-2.2 4,-1.1 -5,-0.2 -2,-0.2 0.916 109.2 48.0 -58.7 -45.1 33.3 7.3 -7.2 131 131 A V H X S+ 0 0 91 -4,-1.9 4,-0.5 1,-0.2 3,-0.2 0.900 114.4 46.4 -62.6 -42.9 32.8 9.8 -10.0 132 132 A N H >< S+ 0 0 41 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.879 107.0 56.8 -69.5 -37.5 29.7 11.3 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.3 1,-0.2 -1,-0.2 0.835 101.1 59.5 -61.9 -32.5 31.3 11.6 -4.9 134 134 A A H 3< S+ 0 0 27 -4,-1.1 2,-1.8 -3,-0.2 -1,-0.2 0.691 85.3 79.4 -72.6 -17.8 34.2 13.8 -6.5 135 135 A K S << S+ 0 0 154 -3,-0.9 2,-0.3 -4,-0.5 -1,-0.2 -0.563 80.8 97.6 -87.9 69.8 31.7 16.4 -7.6 136 136 A S S > S- 0 0 17 -2,-1.8 4,-1.8 1,-0.1 3,-0.2 -0.988 85.2-116.5-153.9 156.6 31.5 18.0 -4.2 137 137 A R H > S+ 0 0 144 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.871 115.2 62.8 -58.2 -40.4 32.8 20.8 -2.1 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.918 105.1 44.1 -50.4 -50.2 34.3 18.0 0.1 139 139 A Y H 4 S+ 0 0 57 -6,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.855 114.7 49.0 -66.1 -41.6 36.5 16.7 -2.7 140 140 A N H < S+ 0 0 110 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.865 116.1 42.0 -70.3 -35.4 37.6 20.2 -3.8 141 141 A Q H < S+ 0 0 105 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.897 131.6 19.5 -79.4 -44.0 38.5 21.4 -0.3 142 142 A T S X S+ 0 0 25 -4,-2.3 4,-2.6 -5,-0.3 -1,-0.2 -0.580 74.2 161.0-125.6 63.9 40.3 18.2 1.1 143 143 A P H > + 0 0 47 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.823 68.0 52.2 -58.7 -38.1 41.2 16.4 -2.1 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.937 116.1 39.8 -67.2 -44.1 44.0 14.1 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.917 114.9 53.6 -67.8 -44.1 41.8 12.7 2.1 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -8,-0.2 5,-0.2 0.918 107.1 52.3 -54.8 -46.4 38.7 12.6 -0.2 147 147 A K H X S+ 0 0 96 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.890 107.9 51.6 -57.7 -41.4 40.7 10.5 -2.9 148 148 A R H X S+ 0 0 68 -4,-1.5 4,-1.5 2,-0.2 12,-0.2 0.923 113.7 43.1 -60.1 -47.2 41.7 8.0 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.895 114.9 49.8 -65.8 -44.0 38.0 7.6 1.0 150 150 A I H X S+ 0 0 14 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.874 108.5 52.6 -63.7 -41.6 36.8 7.4 -2.6 151 151 A T H X S+ 0 0 37 -4,-2.6 4,-2.5 -5,-0.2 6,-0.3 0.884 106.4 54.2 -63.5 -36.8 39.4 4.8 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.894 110.2 45.8 -63.1 -39.8 38.2 2.7 -0.6 153 153 A F H < S+ 0 0 2 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.874 114.3 49.4 -71.1 -37.4 34.6 2.8 -1.8 154 154 A R H < S+ 0 0 106 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.902 125.1 24.2 -65.9 -45.2 35.8 2.0 -5.4 155 155 A T H < S- 0 0 41 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.654 84.8-136.5 -96.1 -28.3 37.9 -1.0 -4.5 156 156 A G S < S+ 0 0 17 -4,-2.3 2,-0.3 -5,-0.3 -62,-0.2 0.738 73.2 101.2 68.6 25.2 36.7 -2.3 -1.2 157 157 A T S S- 0 0 48 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.855 81.4-118.5-130.9 169.5 40.3 -2.7 -0.1 158 158 A W S > S+ 0 0 37 -2,-0.3 3,-1.6 1,-0.2 4,-0.4 0.042 71.8 123.5 -92.5 22.4 42.7 -0.6 2.2 159 159 A D G > + 0 0 106 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.841 65.1 57.3 -53.7 -42.2 45.1 0.0 -0.6 160 160 A A G 3 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.630 109.2 48.0 -65.6 -15.0 45.0 3.9 -0.3 161 161 A Y G < 0 0 19 -3,-1.6 -1,-0.3 -13,-0.1 -2,-0.2 0.401 360.0 360.0-107.5 1.1 46.1 3.6 3.2 162 162 A K < 0 0 176 -3,-1.5 -2,-0.2 -4,-0.4 -3,-0.1 0.775 360.0 360.0-105.5 360.0 49.0 1.2 2.7