==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-OCT-97 235L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.XU,W.A.BAASE,E.BALDWIN,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8559.0 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 53.1 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 0 0 1 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 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 80 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 153.2 43.6 -1.9 9.0 2 2 A N > - 0 0 70 156,-0.0 4,-2.6 1,-0.0 5,-0.2 -0.940 360.0 -81.7-156.0 175.0 40.4 -0.8 10.7 3 3 A I H > S+ 0 0 24 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.843 123.8 50.7 -53.4 -41.3 38.2 2.4 11.3 4 4 A F H > S+ 0 0 77 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.947 113.5 42.6 -66.8 -48.1 40.4 3.6 14.1 5 5 A E H > S+ 0 0 98 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.861 114.2 53.3 -65.2 -36.5 43.6 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 3,-0.3 0.961 112.2 42.5 -64.2 -52.6 42.0 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.4 0.857 109.2 59.0 -65.6 -29.2 40.7 7.8 10.9 8 8 A R H X S+ 0 0 98 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.2 0.895 108.0 47.2 -68.4 -28.7 43.9 8.3 12.8 9 9 A I H < S+ 0 0 85 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.929 115.0 45.6 -75.3 -42.3 45.7 8.5 9.5 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.833 123.8 29.7 -69.2 -34.2 43.2 10.9 8.1 11 11 A E H < S- 0 0 45 -4,-2.5 19,-0.3 -5,-0.2 -1,-0.2 0.682 91.2-149.8-102.1 -22.7 42.9 13.3 11.1 12 12 A G < - 0 0 24 -4,-1.6 2,-0.3 -5,-0.4 -1,-0.2 -0.243 23.8 -87.9 79.8-173.8 46.3 13.1 12.8 13 13 A L + 0 0 37 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.957 42.3 173.1-141.8 121.9 46.8 13.6 16.5 14 14 A R E -A 28 0A 139 14,-1.6 14,-2.5 -2,-0.3 4,-0.1 -1.000 18.5-164.5-134.1 129.1 47.3 17.0 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-1.9 12,-0.2 2,-0.3 0.444 73.6 63.3 -93.0 -2.7 47.5 17.6 21.9 16 16 A K E S-C 57 0B 91 41,-0.2 12,-0.2 12,-0.1 41,-0.2 -0.886 101.1 -88.1-118.1 151.7 47.0 21.3 21.8 17 17 A I E + 0 0 16 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.332 59.0 170.9 -56.4 136.6 44.0 23.2 20.6 18 18 A Y E -A 26 0A 27 8,-3.3 8,-2.9 -4,-0.1 2,-0.5 -0.854 34.9-101.4-140.1 176.3 44.4 23.8 16.8 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.868 33.9-138.8-105.2 133.8 42.4 25.0 13.9 20 20 A D > - 0 0 47 4,-2.9 3,-1.9 -2,-0.5 -1,-0.1 -0.087 39.4 -82.7 -76.3-174.4 41.0 22.6 11.4 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.742 133.8 48.5 -61.7 -25.7 40.9 22.9 7.6 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.392 125.0-103.9 -93.6 -1.4 37.8 25.0 7.9 23 23 A G S < S+ 0 0 34 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.637 74.2 142.4 88.4 17.8 39.4 27.2 10.5 24 24 A Y - 0 0 79 1,-0.1 -4,-2.9 9,-0.0 -1,-0.3 -0.754 59.4-101.3 -98.0 145.2 37.5 25.7 13.5 25 25 A Y E +AB 19 34A 37 9,-0.7 8,-2.8 11,-0.4 9,-1.4 -0.394 55.7 158.5 -62.6 124.2 38.9 25.0 16.9 26 26 A T E -AB 18 32A 4 -8,-2.9 -8,-3.3 6,-0.3 2,-0.3 -0.879 19.6-168.3-141.0 167.9 39.7 21.3 17.3 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.0 -2,-0.3 2,-0.2 -0.986 50.8 1.5-156.6 160.6 41.8 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.6 -2,-0.3 2,-0.9 -0.422 123.0 -3.7 68.4-128.0 43.1 15.4 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.630 127.2 -55.0-103.0 70.5 42.0 13.2 16.7 30 30 A G T 4 S+ 0 0 17 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.766 83.4 159.9 69.3 27.2 39.8 15.5 14.8 31 31 A H E < -B 27 0A 33 -4,-2.0 -4,-1.6 1,-0.0 -1,-0.2 -0.718 34.3-141.4 -85.5 104.4 37.5 16.3 17.7 32 32 A L E -B 26 0A 69 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.412 19.8-176.4 -64.2 129.1 35.7 19.5 16.8 33 33 A L E - 0 0 15 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.900 58.8 -28.9 -92.6 -50.2 35.3 21.8 19.8 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.970 34.8-135.6-164.7 155.2 33.3 24.7 18.4 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.486 74.5 112.6 -93.1 -5.7 32.6 26.6 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.401 72.7-132.2 -70.8 141.8 32.9 29.9 17.3 37 37 A P S S+ 0 0 118 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.546 76.7 103.3 -70.0 -8.4 35.7 32.1 16.5 38 38 A S > - 0 0 46 1,-0.2 4,-1.8 2,-0.0 5,-0.1 -0.715 56.6-159.8 -90.9 124.3 36.5 32.4 20.2 39 39 A L H > S+ 0 0 64 -2,-0.6 4,-2.8 1,-0.3 5,-0.2 0.829 97.0 54.8 -63.7 -33.4 39.4 30.6 21.8 40 40 A N H > S+ 0 0 122 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.921 104.4 51.6 -68.3 -40.6 37.9 31.0 25.1 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.902 112.1 50.0 -59.6 -35.8 34.7 29.4 23.9 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.896 109.3 48.9 -68.4 -42.4 37.0 26.6 22.7 43 43 A K H X S+ 0 0 51 -4,-2.8 4,-2.3 2,-0.2 11,-0.2 0.905 111.4 51.4 -65.8 -37.5 38.8 26.3 26.0 44 44 A S H X S+ 0 0 75 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.941 110.6 46.4 -64.6 -48.5 35.5 26.2 27.8 45 45 A E H X S+ 0 0 69 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.909 111.8 54.6 -61.9 -39.5 34.1 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.3 0.941 108.2 45.9 -59.5 -48.0 37.3 21.6 26.0 47 47 A D H X>S+ 0 0 32 -4,-2.3 4,-2.4 1,-0.2 5,-1.2 0.897 112.1 51.7 -63.2 -38.7 37.2 21.6 29.8 48 48 A K H <5S+ 0 0 141 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.839 111.0 48.8 -64.8 -34.6 33.6 20.5 29.8 49 49 A A H <5S+ 0 0 44 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.882 120.1 35.3 -74.7 -34.6 34.5 17.6 27.4 50 50 A I H <5S- 0 0 34 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.720 102.7-125.6 -90.9 -27.0 37.4 16.4 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 -5,-0.3 -3,-0.2 0.798 76.8 72.1 84.4 30.7 36.0 17.1 32.9 52 52 A R S - 0 0 8 -2,-1.0 3,-1.2 -11,-0.2 -1,-0.2 0.695 34.4-142.1 -90.1 -26.5 42.9 21.8 30.8 55 55 A N T 3 S- 0 0 118 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.883 74.1 -58.9 63.2 32.9 44.3 25.1 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.565 118.1 99.4 72.8 11.6 43.9 24.0 26.1 57 57 A V B < +C 16 0B 68 -3,-1.2 2,-0.2 -41,-0.2 -41,-0.2 -0.989 44.7 177.0-131.4 137.6 46.1 20.9 26.4 58 58 A I - 0 0 3 -43,-1.9 2,-0.2 -2,-0.4 -30,-0.1 -0.797 27.7-108.7-129.0 172.3 45.2 17.2 26.9 59 59 A T > - 0 0 66 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.519 33.2-103.6 -97.4 173.7 47.1 14.0 27.1 60 60 A K H > S+ 0 0 104 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.907 122.1 52.4 -59.9 -44.6 47.3 11.2 24.6 61 61 A D H > S+ 0 0 122 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.884 109.1 49.5 -59.6 -41.1 44.9 9.1 26.7 62 62 A E H > S+ 0 0 39 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.911 109.8 52.2 -65.7 -40.4 42.4 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -34,-0.4 0.910 110.2 48.5 -60.2 -44.1 42.6 12.3 23.1 64 64 A E H X S+ 0 0 77 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.815 107.4 54.9 -67.2 -31.2 42.0 8.7 22.6 65 65 A K H X S+ 0 0 139 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.951 109.0 47.0 -68.2 -45.2 39.0 8.7 24.9 66 66 A L H X S+ 0 0 6 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.920 112.2 53.3 -58.7 -40.1 37.4 11.5 22.8 67 67 A F H X S+ 0 0 14 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.938 106.2 49.8 -63.0 -48.7 38.2 9.5 19.7 68 68 A N H X S+ 0 0 92 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.917 113.2 48.2 -57.4 -41.8 36.5 6.4 21.0 69 69 A Q H X S+ 0 0 97 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.904 110.9 50.5 -64.8 -40.1 33.4 8.4 21.8 70 70 A D H X S+ 0 0 34 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.867 110.3 48.3 -67.3 -37.6 33.4 10.1 18.5 71 71 A V H X S+ 0 0 7 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.950 111.7 50.5 -67.2 -44.8 33.7 6.9 16.5 72 72 A D H X S+ 0 0 86 -4,-2.2 4,-2.8 -5,-0.3 5,-0.3 0.936 110.6 49.7 -57.6 -45.0 30.9 5.3 18.6 73 73 A A H X S+ 0 0 47 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.878 107.9 53.3 -62.4 -40.4 28.7 8.3 18.0 74 74 A A H X S+ 0 0 9 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.967 111.6 45.6 -61.4 -50.1 29.3 8.2 14.2 75 75 A V H X S+ 0 0 31 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.946 114.2 48.1 -56.3 -48.3 28.3 4.6 14.1 76 76 A R H X S+ 0 0 114 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.907 109.1 53.8 -63.3 -35.2 25.3 5.3 16.2 77 77 A G H X S+ 0 0 4 -4,-2.8 4,-0.8 -5,-0.3 3,-0.3 0.928 107.9 50.8 -64.9 -41.5 24.3 8.3 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 7,-0.3 0.941 108.8 51.3 -60.0 -46.6 24.4 6.1 11.0 79 79 A L H 3< S+ 0 0 68 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.740 111.8 46.5 -66.9 -21.2 22.2 3.5 12.6 80 80 A R H 3< S+ 0 0 179 -4,-1.5 2,-0.6 -3,-0.3 -1,-0.3 0.501 92.8 95.0 -94.8 -10.3 19.6 6.0 13.6 81 81 A N S+ 0 0 117 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.832 120.2 40.7 -89.5 -29.7 18.9 7.5 4.8 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.3 2,-0.1 3,-0.4 0.859 101.5 65.4 -86.0 -39.0 22.1 6.2 6.1 85 85 A K H X S+ 0 0 83 -4,-3.2 4,-2.7 -7,-0.3 5,-0.2 0.905 98.6 52.4 -52.7 -47.3 21.2 2.9 7.7 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.895 111.2 47.1 -61.5 -35.9 20.1 1.1 4.7 87 87 A V H X S+ 0 0 2 -4,-0.5 4,-0.9 -3,-0.4 3,-0.3 0.945 111.4 50.5 -69.1 -47.5 23.3 1.9 2.8 88 88 A Y H >< S+ 0 0 33 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.929 109.1 52.3 -55.0 -46.5 25.4 0.9 5.7 89 89 A D H 3< S+ 0 0 76 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.834 107.6 52.5 -62.0 -31.6 23.6 -2.4 6.0 90 90 A S H 3< S+ 0 0 38 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.663 97.0 88.2 -79.3 -17.4 24.1 -3.2 2.4 91 91 A L S << S- 0 0 6 -3,-1.0 31,-0.0 -4,-0.9 2,-0.0 -0.508 75.1-116.5 -87.2 162.0 27.8 -2.7 2.4 92 92 A D > - 0 0 56 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.222 43.9 -91.6 -81.2 172.3 30.7 -5.0 3.2 93 93 A A H > S+ 0 0 80 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.864 121.8 48.3 -57.8 -42.5 33.1 -4.3 6.1 94 94 A V H > S+ 0 0 27 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.949 112.8 46.4 -65.5 -48.8 35.6 -2.2 4.3 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.850 105.0 62.3 -64.1 -32.3 33.1 0.1 2.7 96 96 A R H X S+ 0 0 80 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.909 101.3 52.9 -57.5 -41.9 31.3 0.5 6.0 97 97 A A H X S+ 0 0 7 -4,-1.4 4,-2.5 -3,-0.4 -1,-0.2 0.885 105.2 54.6 -61.3 -36.4 34.4 2.0 7.3 98 98 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.879 108.9 47.8 -64.5 -37.2 34.5 4.5 4.4 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.899 109.9 51.9 -71.7 -37.5 31.0 5.6 5.3 100 100 A I H X S+ 0 0 9 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.953 107.7 54.0 -62.1 -43.3 31.9 5.9 9.0 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.931 108.4 47.8 -56.1 -48.5 34.8 8.1 7.9 102 102 A M H X S+ 0 0 3 -4,-2.0 4,-2.7 1,-0.2 5,-0.4 0.911 112.6 49.6 -60.3 -43.0 32.6 10.4 5.9 103 103 A V H X S+ 0 0 7 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.896 109.3 52.0 -63.8 -37.1 30.1 10.7 8.8 104 104 A F H < S+ 0 0 31 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.929 115.7 40.5 -64.0 -42.7 32.9 11.4 11.3 105 105 A Q H < S+ 0 0 57 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.921 131.8 19.1 -73.0 -46.8 34.2 14.2 9.1 106 106 A M H X S- 0 0 53 -4,-2.7 4,-0.7 -5,-0.2 -3,-0.2 0.462 104.0-116.2-110.5 -3.0 31.1 15.9 7.9 107 107 A G H X - 0 0 32 -4,-1.9 4,-2.7 -5,-0.4 5,-0.3 0.132 35.7 -75.9 82.7 157.2 28.4 14.8 10.3 108 108 A E H > S+ 0 0 59 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.869 129.3 51.4 -59.5 -39.6 25.3 12.7 9.7 109 109 A T H > S+ 0 0 113 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.940 110.9 47.8 -66.1 -44.2 23.5 15.5 8.1 110 110 A G H >< S+ 0 0 31 -4,-0.7 3,-0.9 2,-0.2 4,-0.2 0.940 115.0 44.4 -61.6 -50.6 26.2 16.3 5.7 111 111 A A H >< S+ 0 0 1 -4,-2.7 3,-2.2 1,-0.3 -2,-0.2 0.919 108.0 57.8 -61.0 -42.7 26.8 12.7 4.7 112 112 A A H 3< S+ 0 0 6 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.735 93.7 71.7 -60.4 -19.5 23.1 12.1 4.3 113 113 A G T << S+ 0 0 53 -3,-0.9 2,-1.5 -4,-0.9 3,-0.3 0.619 72.3 86.6 -71.8 -11.7 23.1 14.9 1.8 114 114 A F <> + 0 0 37 -3,-2.2 4,-2.6 -4,-0.2 5,-0.3 -0.254 55.3 157.8 -86.5 50.7 24.9 12.7 -0.7 115 115 A T H > + 0 0 88 -2,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.842 66.8 43.3 -43.0 -54.1 21.6 11.4 -2.0 116 116 A N H > S+ 0 0 83 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.896 114.7 48.5 -66.5 -40.9 22.7 10.3 -5.4 117 117 A S H > S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 5,-0.2 0.881 108.9 55.2 -64.0 -40.8 26.0 8.7 -4.3 118 118 A L H X S+ 0 0 12 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.907 106.8 50.0 -60.1 -43.2 24.2 6.8 -1.5 119 119 A R H X S+ 0 0 115 -4,-1.7 4,-1.6 -5,-0.3 -1,-0.2 0.920 111.4 48.7 -64.8 -38.8 21.8 5.3 -3.9 120 120 A M H <>S+ 0 0 27 -4,-1.9 5,-2.3 2,-0.2 4,-0.3 0.852 110.4 50.8 -69.4 -36.5 24.6 4.2 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.3 3,-1.8 1,-0.2 -1,-0.2 0.924 108.0 52.6 -66.5 -41.9 26.5 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 95 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.875 109.2 50.5 -62.0 -29.5 23.5 0.9 -2.3 123 123 A Q T 3<5S- 0 0 88 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.463 111.8-121.8 -86.3 -0.6 23.2 -0.4 -5.8 124 124 A K T < 5 + 0 0 102 -3,-1.8 2,-1.3 -4,-0.3 -3,-0.2 0.791 61.9 147.4 63.7 31.6 26.8 -1.5 -5.8 125 125 A R >< + 0 0 110 -5,-2.3 4,-2.3 1,-0.2 -1,-0.2 -0.701 21.8 176.0 -96.0 78.9 27.7 0.7 -8.8 126 126 A W H > + 0 0 52 -2,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.895 68.8 43.2 -54.9 -54.7 31.2 1.4 -7.6 127 127 A D H > S+ 0 0 106 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.917 114.7 50.7 -64.5 -38.7 32.7 3.4 -10.4 128 128 A E H > S+ 0 0 108 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.915 110.0 49.0 -67.3 -40.1 29.6 5.5 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.906 108.2 54.9 -62.8 -39.8 29.4 6.3 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.887 108.8 48.0 -61.7 -37.7 33.1 7.3 -7.1 131 131 A V H X S+ 0 0 90 -4,-1.9 4,-0.5 1,-0.2 3,-0.3 0.946 114.1 46.1 -68.8 -44.9 32.6 9.7 -9.9 132 132 A N H >< S+ 0 0 39 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.879 106.5 58.0 -64.7 -39.9 29.6 11.2 -8.2 133 133 A L H 3< S+ 0 0 1 -4,-3.0 6,-0.4 1,-0.3 -1,-0.2 0.872 100.6 59.8 -59.8 -32.0 31.2 11.5 -4.9 134 134 A A H 3< S+ 0 0 26 -4,-1.2 2,-1.7 -3,-0.3 -1,-0.3 0.680 84.4 79.0 -72.6 -19.0 33.9 13.6 -6.5 135 135 A K S << S+ 0 0 162 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.565 80.5 97.7 -89.0 73.3 31.5 16.3 -7.6 136 136 A S S > S- 0 0 17 -2,-1.7 4,-2.0 1,-0.1 5,-0.2 -0.997 84.6-116.6-154.5 157.0 31.3 17.9 -4.2 137 137 A R H > S+ 0 0 140 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.910 115.2 64.1 -59.6 -40.9 32.7 20.7 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.924 105.5 42.2 -47.4 -52.6 34.1 17.9 0.1 139 139 A Y H 4 S+ 0 0 58 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.878 115.6 49.2 -65.5 -41.5 36.3 16.6 -2.7 140 140 A N H < S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.877 115.6 43.1 -68.6 -34.7 37.4 20.1 -3.8 141 141 A Q H < S+ 0 0 105 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.891 132.2 17.7 -78.7 -42.7 38.3 21.3 -0.3 142 142 A T S X S+ 0 0 21 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 -0.590 74.0 162.6-131.5 74.7 40.1 18.2 1.0 143 143 A P H > + 0 0 51 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.833 68.8 52.6 -63.6 -40.2 41.0 16.3 -2.1 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.942 115.9 39.9 -67.9 -43.8 43.7 14.0 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.920 115.1 52.2 -68.3 -45.5 41.5 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.936 107.6 53.5 -55.8 -44.5 38.5 12.6 -0.2 147 147 A K H X S+ 0 0 100 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.874 107.0 52.2 -57.8 -39.4 40.4 10.5 -2.8 148 148 A R H X S+ 0 0 69 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.931 112.7 43.1 -64.2 -44.0 41.4 8.0 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.925 113.6 52.4 -65.7 -44.7 37.8 7.5 1.0 150 150 A I H X S+ 0 0 13 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.885 108.3 50.0 -58.5 -43.2 36.5 7.4 -2.6 151 151 A T H X S+ 0 0 38 -4,-2.3 4,-2.6 -5,-0.2 6,-0.4 0.831 108.0 55.0 -63.6 -35.0 39.1 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 5,-0.2 0.929 110.7 44.0 -64.8 -44.2 38.0 2.7 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.890 115.9 49.6 -65.2 -40.4 34.4 2.8 -1.7 154 154 A R H < S+ 0 0 103 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.899 124.2 24.3 -66.4 -45.0 35.4 2.0 -5.2 155 155 A T H < S- 0 0 44 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.622 85.1-135.4 -98.6 -22.9 37.6 -1.0 -4.5 156 156 A G S < S+ 0 0 17 -4,-2.5 2,-0.3 -5,-0.3 -62,-0.2 0.774 73.8 103.5 70.5 18.7 36.4 -2.4 -1.3 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.820 79.2-122.9-126.4 172.9 40.1 -2.6 -0.2 158 158 A W S > S+ 0 0 43 -2,-0.3 3,-2.6 1,-0.2 4,-0.4 0.169 70.6 122.8 -99.0 15.9 42.4 -0.6 2.1 159 159 A D G > + 0 0 93 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.811 66.4 58.0 -49.6 -34.9 44.9 -0.0 -0.7 160 160 A A G 3 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.605 106.8 49.9 -73.6 -11.8 44.7 3.8 -0.4 161 161 A Y G < 0 0 19 -3,-2.6 -1,-0.3 -13,-0.1 -2,-0.2 0.346 360.0 360.0-108.3 6.8 45.8 3.5 3.2 162 162 A K < 0 0 174 -3,-1.3 -2,-0.2 -4,-0.4 -3,-0.1 0.813 360.0 360.0-107.3 360.0 48.8 1.3 2.7