==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-AUG-99 1CX7 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR N.C.GASSNER,W.A.BAASE,J.LINDSTROM,J.LU,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8666.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 72.2 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 . 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.0 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 2 0 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 81 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 151.2 43.5 -1.9 9.3 2 2 A N > - 0 0 64 156,-0.0 4,-2.9 95,-0.0 5,-0.2 -0.922 360.0 -77.3-155.8 177.9 40.2 -0.8 10.7 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.837 124.0 54.2 -52.5 -41.7 38.2 2.4 11.1 4 4 A F H > S+ 0 0 80 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.968 112.8 40.6 -63.3 -49.6 40.3 3.6 14.1 5 5 A E H > S+ 0 0 99 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.875 113.4 56.6 -66.8 -34.8 43.5 3.4 12.3 6 6 A M H >X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 3,-0.7 0.980 110.6 40.7 -61.6 -51.2 42.0 4.7 9.2 7 7 A L H 3X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.4 0.833 108.4 61.8 -66.9 -29.1 40.7 7.8 10.8 8 8 A R H 3X S+ 0 0 97 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.856 107.0 48.0 -66.0 -26.5 43.9 8.2 12.8 9 9 A I H << S+ 0 0 86 -4,-1.6 -2,-0.2 -3,-0.7 -1,-0.2 0.914 114.5 42.9 -75.7 -46.7 45.7 8.5 9.5 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.827 124.3 32.4 -70.6 -32.1 43.3 11.0 8.1 11 11 A E H < S- 0 0 46 -4,-2.7 19,-0.4 -5,-0.2 -1,-0.2 0.689 90.0-154.2 -97.7 -28.8 42.9 13.2 11.1 12 12 A G < - 0 0 21 -4,-1.4 2,-0.3 -5,-0.4 -1,-0.2 -0.248 24.5 -82.6 82.0-174.4 46.3 13.1 12.8 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.978 43.9 169.5-138.9 119.1 46.9 13.7 16.6 14 14 A R E -A 28 0A 134 14,-1.7 14,-2.7 -2,-0.3 4,-0.1 -1.000 17.7-168.7-133.4 124.5 47.3 17.2 18.2 15 15 A L E S+ 0 0 58 -2,-0.4 43,-1.6 12,-0.2 2,-0.3 0.410 71.9 68.3 -93.8 -0.8 47.2 17.6 21.8 16 16 A K E S-C 57 0B 104 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.900 99.9 -90.1-117.8 145.5 47.0 21.4 21.6 17 17 A I E + 0 0 22 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.292 59.3 171.2 -51.1 135.7 43.8 23.3 20.4 18 18 A Y E -A 26 0A 25 8,-3.3 8,-3.0 -4,-0.1 2,-0.6 -0.904 35.7-104.8-142.1 170.3 44.2 23.9 16.6 19 19 A K E -A 25 0A 127 -2,-0.3 6,-0.3 6,-0.2 8,-0.0 -0.862 33.3-139.4-101.5 131.8 42.3 25.1 13.7 20 20 A D > - 0 0 48 4,-4.1 3,-0.8 -2,-0.6 -1,-0.1 0.109 39.5 -81.8 -72.3-166.8 41.0 22.6 11.4 21 21 A T T 3 S+ 0 0 116 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.619 134.4 48.2 -72.8 -17.9 41.0 22.9 7.5 22 22 A E T 3 S- 0 0 87 2,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.341 126.5-103.4 -97.7 -6.6 37.7 25.0 7.7 23 23 A G S < S+ 0 0 35 -3,-0.8 2,-0.3 1,-0.3 -2,-0.1 0.609 74.2 144.9 88.7 22.5 39.4 27.2 10.4 24 24 A Y - 0 0 80 1,-0.1 -4,-4.1 9,-0.0 2,-0.3 -0.730 57.5-105.5 -96.6 141.2 37.5 25.5 13.4 25 25 A Y E +AB 19 34A 33 9,-0.7 8,-2.7 11,-0.4 9,-1.2 -0.503 53.7 160.2 -64.3 124.0 38.9 25.0 16.7 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-3.3 -2,-0.3 2,-0.3 -0.861 18.9-171.6-138.1 169.5 39.7 21.3 17.1 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.1 -2,-0.3 2,-0.3 -0.989 51.4 10.9-157.3 164.5 41.8 19.1 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.7 -14,-1.7 -2,-0.3 2,-0.8 -0.489 122.5 -11.0 72.0-131.9 42.9 15.4 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -2,-0.3 -17,-0.1 -0.706 127.8 -49.5-105.9 77.0 42.1 13.2 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.0 -19,-0.4 -2,-0.2 0.788 84.1 160.3 67.8 30.2 39.8 15.5 14.7 31 31 A H E < -B 27 0A 32 -4,-2.1 -4,-1.7 2,-0.0 -1,-0.2 -0.736 32.9-144.5 -88.7 105.2 37.5 16.4 17.6 32 32 A L E -B 26 0A 66 -2,-1.0 -6,-0.2 -6,-0.2 3,-0.1 -0.438 17.5-175.2 -65.1 128.3 35.7 19.6 16.6 33 33 A L E - 0 0 14 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.846 58.1 -31.2 -92.8 -43.5 35.2 21.8 19.6 34 34 A T E -B 25 0A 29 -9,-1.2 -9,-0.7 2,-0.1 -1,-0.4 -0.945 37.4-129.7-170.7 155.0 33.2 24.6 18.3 35 35 A K S S+ 0 0 134 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.435 74.0 112.2 -93.1 3.1 32.4 26.7 15.2 36 36 A S S S- 0 0 41 2,-0.1 -11,-0.4 1,-0.1 -2,-0.1 -0.378 73.0-128.7 -80.5 151.2 32.8 29.9 17.0 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.543 79.0 97.6 -71.1 -9.2 35.6 32.3 16.4 38 38 A S > - 0 0 49 1,-0.1 4,-1.7 -13,-0.0 -2,-0.1 -0.752 58.2-157.8 -95.5 130.1 36.6 32.5 20.1 39 39 A L H > S+ 0 0 68 -2,-0.4 4,-2.8 1,-0.2 5,-0.2 0.678 95.3 61.8 -72.8 -15.5 39.3 30.5 21.6 40 40 A N H > S+ 0 0 110 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.960 100.9 47.7 -78.9 -43.6 37.6 31.0 24.8 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.895 113.7 52.0 -59.3 -38.9 34.6 29.4 23.9 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-3.5 2,-0.2 -2,-0.2 0.941 108.6 48.1 -60.6 -50.2 36.8 26.6 22.6 43 43 A K H X S+ 0 0 58 -4,-2.8 4,-1.8 1,-0.2 11,-0.2 0.876 112.9 50.4 -59.2 -34.5 38.7 26.3 25.8 44 44 A S H X S+ 0 0 70 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.927 108.9 49.2 -70.9 -43.5 35.5 26.2 27.5 45 45 A E H X S+ 0 0 67 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.900 110.7 53.5 -64.3 -39.1 34.0 23.5 25.3 46 46 A L H X S+ 0 0 0 -4,-3.5 4,-2.4 2,-0.2 5,-0.3 0.909 107.3 48.4 -61.0 -43.9 37.2 21.5 25.8 47 47 A D H X>S+ 0 0 36 -4,-1.8 4,-2.2 1,-0.2 5,-1.0 0.909 110.6 52.4 -64.3 -37.6 37.0 21.7 29.6 48 48 A K H <5S+ 0 0 147 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.863 112.5 45.2 -63.5 -39.2 33.4 20.6 29.5 49 49 A A H <5S+ 0 0 46 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.864 119.6 38.9 -75.1 -34.6 34.3 17.6 27.3 50 50 A I H <5S- 0 0 34 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.741 101.2-128.8 -86.3 -29.0 37.4 16.5 29.4 51 51 A G T <5S+ 0 0 67 -4,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.770 74.7 69.4 82.7 27.5 35.9 17.2 32.8 52 52 A R S - 0 0 7 -2,-1.1 3,-1.0 -11,-0.2 -1,-0.2 0.770 31.2-148.1 -84.3 -29.4 42.7 21.8 30.7 55 55 A N T 3 S- 0 0 119 1,-0.2 3,-0.1 -12,-0.2 -2,-0.1 0.786 74.2 -57.3 66.7 19.7 44.0 25.2 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.2 2,-0.4 0.584 119.1 94.3 84.2 10.7 43.8 24.1 26.0 57 57 A V B < -C 16 0B 63 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.993 46.5-179.8-137.1 136.0 46.0 21.0 26.3 58 58 A I - 0 0 4 -43,-1.6 2,-0.1 -2,-0.4 -30,-0.1 -0.847 27.3-111.1-126.8 167.2 45.1 17.3 26.8 59 59 A T > - 0 0 70 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.446 35.8-101.0 -92.8 170.9 47.1 14.2 27.1 60 60 A K H > S+ 0 0 107 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.874 120.0 54.7 -58.5 -41.3 47.2 11.4 24.6 61 61 A D H > S+ 0 0 121 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.882 107.9 49.4 -63.3 -37.0 44.9 9.2 26.6 62 62 A E H > S+ 0 0 39 -3,-0.3 4,-2.5 2,-0.2 5,-0.2 0.889 108.7 53.5 -67.4 -41.0 42.2 11.9 26.7 63 63 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -34,-0.4 0.910 110.1 48.0 -59.0 -43.0 42.6 12.4 23.0 64 64 A E H X S+ 0 0 75 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.849 107.5 56.8 -68.5 -31.0 41.9 8.7 22.6 65 65 A K H X S+ 0 0 134 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.957 108.8 43.7 -63.6 -52.3 39.0 8.9 24.9 66 66 A L H X S+ 0 0 5 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.907 111.4 57.5 -57.8 -41.0 37.3 11.6 22.7 67 67 A F H X S+ 0 0 12 -4,-2.1 4,-2.3 -5,-0.2 5,-0.2 0.937 105.1 48.4 -59.3 -48.3 38.2 9.6 19.7 68 68 A N H X S+ 0 0 91 -4,-2.5 4,-2.7 1,-0.3 5,-0.2 0.932 113.2 48.7 -55.9 -46.9 36.4 6.4 20.9 69 69 A Q H X S+ 0 0 97 -4,-1.9 4,-2.1 1,-0.2 -1,-0.3 0.884 111.1 49.3 -61.0 -43.2 33.4 8.4 21.7 70 70 A D H X S+ 0 0 39 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.868 111.2 48.0 -69.9 -33.4 33.3 10.1 18.4 71 71 A V H >X S+ 0 0 5 -4,-2.3 4,-2.4 -5,-0.2 3,-0.6 0.980 112.7 49.5 -70.2 -48.8 33.7 7.0 16.4 72 72 A D H 3X S+ 0 0 87 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.903 111.0 50.2 -51.7 -43.2 30.9 5.3 18.4 73 73 A A H 3X S+ 0 0 48 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.833 107.2 54.0 -67.2 -31.9 28.7 8.3 17.9 74 74 A A H < S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.2 7,-0.4 0.947 110.6 51.1 -65.7 -48.8 24.3 6.3 10.8 79 79 A L H 3< S+ 0 0 65 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.729 109.4 50.2 -62.7 -28.3 22.2 3.6 12.3 80 80 A R T 3< S+ 0 0 178 -4,-1.5 2,-0.6 -5,-0.1 -1,-0.3 0.474 92.0 97.7 -84.5 -10.9 19.6 6.1 13.6 81 81 A N <> - 0 0 17 -3,-1.3 4,-3.1 -4,-0.5 -4,-0.0 -0.709 63.9-154.4 -89.6 118.5 19.4 7.7 10.2 82 82 A A T 4 S+ 0 0 84 -2,-0.6 -1,-0.2 1,-0.2 -4,-0.0 0.837 94.0 41.8 -58.0 -32.5 16.5 6.5 8.0 83 83 A K T 4 S+ 0 0 152 1,-0.1 4,-0.4 2,-0.1 -1,-0.2 0.838 120.4 39.1 -87.0 -31.7 18.3 7.3 4.8 84 84 A M T >> S+ 0 0 0 -6,-0.2 4,-2.5 1,-0.1 3,-1.0 0.876 98.0 71.7 -85.6 -35.9 21.6 6.1 5.6 85 85 A K H 3X S+ 0 0 85 -4,-3.1 4,-2.4 -7,-0.4 5,-0.2 0.873 99.1 48.6 -46.4 -45.3 21.1 2.9 7.6 86 86 A P H 3> S+ 0 0 58 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.819 110.7 50.9 -69.2 -29.8 19.9 0.9 4.7 87 87 A V H <4 S+ 0 0 5 -3,-1.0 4,-0.4 -4,-0.4 3,-0.3 0.934 112.2 46.7 -71.6 -43.5 22.8 2.0 2.6 88 88 A Y H >< S+ 0 0 27 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.890 109.6 55.3 -62.9 -41.5 25.3 1.0 5.3 89 89 A D H 3< S+ 0 0 69 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.809 102.4 57.1 -66.7 -24.8 23.6 -2.3 5.9 90 90 A S T 3< S+ 0 0 39 -4,-0.9 -1,-0.3 -3,-0.3 2,-0.2 0.609 96.4 81.1 -80.9 -12.8 24.0 -3.3 2.4 91 91 A M S < S- 0 0 5 -3,-1.3 2,-0.1 -4,-0.4 31,-0.0 -0.615 77.1-112.3 -98.5 161.6 27.7 -2.9 2.3 92 92 A D > - 0 0 57 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.237 45.0 -92.3 -78.5 174.4 30.7 -5.0 3.3 93 93 A A H > S+ 0 0 79 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.775 120.5 50.9 -61.0 -37.8 33.0 -4.0 6.2 94 94 A V H > S+ 0 0 25 62,-0.2 4,-1.8 2,-0.2 3,-0.3 0.962 112.3 45.7 -66.9 -56.1 35.5 -2.1 4.3 95 95 A R H > S+ 0 0 28 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.859 108.6 57.1 -57.1 -35.8 33.0 0.1 2.5 96 96 A R H X S+ 0 0 79 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.927 103.9 55.0 -59.0 -38.5 31.1 0.7 5.8 97 97 A A H X S+ 0 0 5 -4,-1.5 4,-2.2 -3,-0.3 -1,-0.2 0.891 103.9 53.7 -61.8 -41.4 34.4 2.0 7.2 98 98 A A H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -1,-0.3 0.884 109.1 48.7 -60.6 -38.5 34.5 4.4 4.3 99 99 A M H X S+ 0 0 2 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.862 108.5 52.4 -67.5 -39.0 31.0 5.7 5.2 100 100 A I H X S+ 0 0 9 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.935 107.1 53.9 -61.5 -43.7 31.9 6.1 8.8 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.948 108.7 49.0 -56.8 -47.6 34.9 8.2 7.8 102 102 A M H X S+ 0 0 7 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.938 113.4 45.2 -60.4 -45.3 32.7 10.5 5.8 103 103 A V H X S+ 0 0 10 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.907 110.0 55.4 -62.3 -42.0 30.2 11.0 8.6 104 104 A F H < S+ 0 0 30 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.925 117.0 37.3 -54.9 -43.0 33.0 11.5 11.2 105 105 A Q H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.878 130.6 25.2 -78.7 -43.0 34.4 14.4 9.0 106 106 A M H X S- 0 0 44 -4,-2.6 4,-1.0 -5,-0.2 -3,-0.2 0.517 100.5-116.8-109.2 -3.7 31.2 15.9 7.7 107 107 A G H X - 0 0 29 -4,-3.1 4,-2.0 -5,-0.2 5,-0.2 0.193 38.0 -81.8 79.4 148.9 28.4 15.2 10.1 108 108 A E H > S+ 0 0 72 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.759 132.1 57.6 -58.0 -27.7 25.4 13.2 9.3 109 109 A T H > S+ 0 0 124 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.996 104.2 44.3 -69.7 -61.3 24.2 16.3 7.9 110 110 A G H < S+ 0 0 34 -4,-1.0 -2,-0.2 1,-0.2 -1,-0.2 0.850 121.0 42.2 -49.2 -42.0 26.9 16.9 5.3 111 111 A V H >< S+ 0 0 2 -4,-2.0 3,-2.7 1,-0.2 -1,-0.2 0.930 101.0 64.0 -73.2 -50.7 26.9 13.2 4.3 112 112 A A H 3< S+ 0 0 26 -4,-2.1 3,-0.3 1,-0.3 -1,-0.2 0.848 92.3 72.4 -43.9 -30.4 23.3 12.8 4.3 113 113 A G T 3< S+ 0 0 66 -4,-1.4 -1,-0.3 1,-0.2 3,-0.2 0.357 79.9 75.8 -68.5 8.0 23.7 15.5 1.3 114 114 A F <> + 0 0 30 -3,-2.7 4,-2.4 1,-0.2 5,-0.3 -0.215 55.0 143.6-109.1 38.9 25.2 12.8 -1.1 115 115 A T H > + 0 0 87 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.884 67.1 52.6 -47.5 -51.3 21.9 11.1 -1.9 116 116 A N H > S+ 0 0 96 1,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.922 111.1 44.5 -55.5 -48.3 22.7 10.4 -5.4 117 117 A S H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.865 111.3 55.5 -65.8 -39.2 26.0 8.6 -4.6 118 118 A M H X S+ 0 0 12 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.883 104.3 52.9 -61.8 -35.5 24.4 6.7 -1.8 119 119 A R H X S+ 0 0 120 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.945 111.0 46.7 -63.4 -42.4 21.8 5.4 -4.1 120 120 A M H <>S+ 0 0 28 -4,-1.7 5,-1.9 1,-0.2 4,-0.4 0.901 110.2 55.4 -66.0 -38.0 24.5 4.2 -6.5 121 121 A M H ><5S+ 0 0 5 -4,-2.6 3,-2.8 1,-0.2 -1,-0.2 0.981 105.0 49.7 -58.2 -53.4 26.2 2.8 -3.6 122 122 A Q H 3<5S+ 0 0 95 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.877 109.6 53.3 -54.7 -32.0 23.3 0.7 -2.5 123 123 A Q T 3<5S- 0 0 76 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.475 113.5-120.4 -82.3 0.8 23.0 -0.5 -6.1 124 124 A K T < 5 + 0 0 101 -3,-2.8 2,-1.5 -4,-0.4 3,-0.2 0.643 65.1 143.3 66.7 24.6 26.6 -1.6 -6.0 125 125 A R >< + 0 0 114 -5,-1.9 4,-2.1 1,-0.2 5,-0.2 -0.606 21.0 170.6 -92.9 71.9 27.6 0.6 -8.9 126 126 A W H > + 0 0 41 -2,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.850 65.6 51.0 -56.3 -49.8 31.0 1.4 -7.4 127 127 A D H > S+ 0 0 110 1,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.950 113.7 46.9 -59.6 -40.4 32.7 3.2 -10.3 128 128 A E H > S+ 0 0 101 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.906 108.6 51.9 -67.1 -43.4 29.8 5.5 -10.7 129 129 A A H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 -1,-0.2 0.915 108.9 53.7 -56.7 -43.5 29.4 6.3 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.864 109.2 48.1 -59.5 -39.7 33.1 7.2 -7.1 131 131 A V H >X S+ 0 0 97 -4,-1.8 3,-1.0 1,-0.2 4,-0.6 0.985 113.6 46.0 -68.8 -52.2 32.7 9.6 -10.0 132 132 A N H >< S+ 0 0 40 -4,-3.0 3,-1.6 1,-0.3 -2,-0.2 0.909 107.7 56.8 -55.3 -45.8 29.7 11.2 -8.4 133 133 A M H 3< S+ 0 0 1 -4,-3.1 6,-0.3 1,-0.3 -1,-0.3 0.839 98.7 63.1 -58.6 -28.8 31.3 11.6 -5.0 134 134 A A H << S+ 0 0 29 -3,-1.0 2,-1.4 -4,-1.0 -1,-0.3 0.680 84.9 77.0 -70.5 -19.5 34.2 13.5 -6.7 135 135 A K S << S+ 0 0 169 -3,-1.6 2,-0.3 -4,-0.6 -1,-0.2 -0.656 80.2 103.0 -91.9 77.4 31.8 16.3 -7.7 136 136 A S S > S- 0 0 19 -2,-1.4 4,-1.9 1,-0.1 5,-0.2 -0.993 83.6-119.7-155.3 152.3 31.7 17.9 -4.3 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.3 2,-0.2 5,-0.3 0.903 113.7 64.6 -59.7 -37.7 33.0 20.7 -2.4 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.7 2,-0.2 8,-0.2 0.938 104.8 42.2 -48.9 -50.7 34.4 17.9 -0.1 139 139 A Y H 4 S+ 0 0 55 -6,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.883 113.7 51.9 -66.1 -43.0 36.7 16.6 -2.7 140 140 A N H < S+ 0 0 106 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.858 115.7 42.7 -64.3 -34.7 37.7 20.1 -3.9 141 141 A Q H < S+ 0 0 104 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.913 131.4 17.4 -79.9 -46.9 38.6 21.1 -0.3 142 142 A T S X S+ 0 0 24 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 -0.672 73.3 163.1-127.6 73.5 40.4 18.0 0.9 143 143 A P H > + 0 0 49 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.871 68.4 52.0 -62.4 -44.0 41.3 16.2 -2.2 144 144 A N H > S+ 0 0 116 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.954 116.1 41.3 -64.7 -39.8 44.0 13.8 -0.9 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.935 113.7 53.8 -69.4 -46.2 41.8 12.5 1.9 146 146 A A H X S+ 0 0 0 -4,-2.2 4,-3.2 1,-0.2 5,-0.2 0.926 107.4 51.7 -52.1 -46.0 38.7 12.4 -0.4 147 147 A K H X S+ 0 0 94 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.883 108.0 51.4 -59.8 -40.8 40.7 10.3 -2.8 148 148 A R H X S+ 0 0 70 -4,-1.7 4,-1.4 2,-0.2 12,-0.2 0.894 113.6 43.5 -62.4 -44.8 41.6 7.9 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.891 113.0 52.4 -69.0 -43.3 38.0 7.5 1.0 150 150 A I H X S+ 0 0 14 -4,-3.2 4,-3.1 -5,-0.2 5,-0.2 0.921 109.3 48.5 -59.6 -45.3 36.7 7.3 -2.6 151 151 A T H X S+ 0 0 39 -4,-2.4 4,-2.8 -5,-0.2 6,-0.4 0.885 110.5 52.3 -62.6 -36.4 39.1 4.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.6 1,-0.2 5,-0.2 0.936 114.3 43.0 -65.1 -41.7 38.2 2.5 -0.4 153 153 A M H < S+ 0 0 1 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.904 116.3 47.1 -67.7 -45.4 34.6 2.9 -1.4 154 154 A R H < S+ 0 0 96 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.906 126.1 27.5 -60.8 -47.9 35.2 2.0 -5.0 155 155 A T H < S- 0 0 43 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.597 85.4-136.2 -91.4 -23.1 37.4 -1.0 -4.3 156 156 A G S < S+ 0 0 16 -4,-2.6 2,-0.3 -5,-0.2 -62,-0.2 0.703 73.3 103.7 66.6 20.1 36.3 -2.4 -1.0 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.2 -0.855 76.8-125.4-127.6 166.2 40.1 -2.7 -0.1 158 158 A W S >> S+ 0 0 43 -2,-0.3 3,-2.4 1,-0.2 4,-0.6 0.136 70.3 120.6 -94.5 18.4 42.4 -0.8 2.1 159 159 A D G >4 + 0 0 94 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.825 66.2 60.0 -53.6 -33.6 44.9 -0.2 -0.6 160 160 A A G 34 S+ 0 0 34 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.619 107.7 48.5 -68.8 -14.6 44.7 3.6 -0.4 161 161 A Y G <4 0 0 21 -3,-2.4 -1,-0.2 -13,-0.1 -2,-0.2 0.454 360.0 360.0-104.8 -1.5 45.9 3.4 3.2 162 162 A K << 0 0 181 -3,-1.1 -2,-0.2 -4,-0.6 -3,-0.1 0.840 360.0 360.0-101.0 360.0 48.8 1.0 2.7