==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 23-SEP-91 1L66 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR D.HEINZ,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8599.0 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 . 9 5.6 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 1 0 0 3 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 73 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.6 43.5 -1.9 9.2 2 2 A N > - 0 0 69 156,-0.0 4,-2.7 95,-0.0 5,-0.2 -0.910 360.0 -81.1-152.6 176.6 40.2 -0.9 10.9 3 3 A I H > S+ 0 0 28 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.813 125.0 53.0 -54.5 -36.3 38.1 2.3 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.947 111.6 42.6 -66.9 -50.1 40.2 3.5 14.1 5 5 A E H > S+ 0 0 93 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.870 113.9 54.1 -64.0 -38.3 43.5 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 3,-0.3 0.981 111.9 41.8 -62.4 -52.2 41.9 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.838 110.3 58.2 -65.6 -31.0 40.6 7.9 10.9 8 8 A R H X S+ 0 0 103 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.898 108.2 47.3 -65.9 -33.0 43.8 8.3 12.9 9 9 A I H < S+ 0 0 85 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.937 116.2 43.7 -70.4 -45.8 45.6 8.5 9.5 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.866 124.0 31.3 -68.8 -38.0 43.1 11.0 8.1 11 11 A E H < S- 0 0 42 -4,-2.7 19,-0.4 -5,-0.2 -1,-0.2 0.689 91.4-152.8 -97.3 -21.1 42.7 13.3 11.0 12 12 A G < - 0 0 23 -4,-1.4 2,-0.4 -5,-0.3 -1,-0.2 -0.154 25.0 -87.6 72.7-169.8 46.1 13.1 12.7 13 13 A L + 0 0 39 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.961 41.6 174.2-140.2 121.2 46.5 13.8 16.4 14 14 A R E -A 28 0A 143 14,-1.8 14,-2.5 -2,-0.4 4,-0.1 -0.999 18.1-163.8-128.5 132.0 47.1 17.2 18.0 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.2 12,-0.2 2,-0.3 0.432 75.5 65.7 -90.8 -4.1 47.1 17.7 21.8 16 16 A K E S-C 57 0B 108 41,-0.2 12,-0.2 12,-0.1 41,-0.2 -0.863 101.0 -92.2-117.1 146.9 46.7 21.5 21.6 17 17 A I E + 0 0 18 39,-1.4 2,-0.3 -2,-0.3 10,-0.2 -0.419 57.6 171.4 -54.5 138.8 43.5 23.3 20.3 18 18 A Y E -A 26 0A 28 8,-2.9 8,-2.9 -4,-0.1 2,-0.5 -0.879 35.1-103.5-139.3 173.0 44.0 23.9 16.6 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.854 34.9-135.4-103.3 138.7 42.0 25.0 13.7 20 20 A D > - 0 0 47 4,-3.0 3,-1.9 -2,-0.5 -1,-0.1 -0.016 39.9 -80.3 -76.8-169.8 40.7 22.5 11.2 21 21 A T T 3 S+ 0 0 108 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.799 135.3 48.3 -65.9 -24.6 40.7 22.7 7.5 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.332 124.0-106.3 -93.4 5.3 37.5 24.9 7.7 23 23 A G S < S+ 0 0 35 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.602 73.7 141.0 81.2 15.7 39.2 27.0 10.3 24 24 A Y - 0 0 77 1,-0.1 -4,-3.0 -5,-0.0 -1,-0.3 -0.758 60.8 -98.4 -95.2 147.0 37.1 25.6 13.2 25 25 A Y E +AB 19 34A 32 9,-0.7 8,-3.0 11,-0.4 9,-1.5 -0.339 55.7 159.4 -63.9 125.6 38.5 25.0 16.6 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.9 6,-0.3 2,-0.3 -0.862 18.7-168.3-141.1 164.6 39.3 21.3 17.0 27 27 A I E > + B 0 31A 0 4,-1.4 4,-2.0 -2,-0.3 2,-0.2 -0.971 51.7 2.0-152.3 163.4 41.5 19.1 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.8 -2,-0.3 2,-1.0 -0.423 123.3 -3.8 68.9-129.7 42.8 15.5 19.4 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.661 127.5 -56.2-103.3 69.7 41.8 13.2 16.6 30 30 A G T 4 S+ 0 0 15 -2,-1.0 2,-1.0 -19,-0.4 -2,-0.2 0.781 82.1 161.5 65.5 31.6 39.5 15.5 14.7 31 31 A H E < -B 27 0A 35 -4,-2.0 -4,-1.4 1,-0.0 -1,-0.2 -0.673 33.7-140.8 -83.9 103.6 37.2 16.3 17.5 32 32 A L E -B 26 0A 72 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.382 19.6-175.5 -63.1 131.5 35.4 19.5 16.5 33 33 A L E - 0 0 14 -8,-3.0 2,-0.3 1,-0.3 -7,-0.2 0.880 57.4 -26.8 -94.6 -46.6 35.0 21.8 19.5 34 34 A T E -B 25 0A 27 -9,-1.5 -9,-0.7 2,-0.1 -1,-0.3 -0.965 34.5-136.4-165.7 153.3 33.0 24.6 18.1 35 35 A K S S+ 0 0 134 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.520 75.6 105.2 -91.4 -5.6 32.1 26.6 15.1 36 36 A S S S- 0 0 42 2,-0.1 -11,-0.4 1,-0.1 -2,-0.1 -0.454 74.8-129.8 -70.3 148.0 32.4 29.9 16.9 37 37 A P S S+ 0 0 117 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.561 75.6 109.8 -76.5 -10.3 35.4 32.1 16.2 38 38 A S > - 0 0 52 1,-0.2 4,-1.8 2,-0.1 -2,-0.1 -0.620 54.5-162.8 -78.8 121.2 36.0 32.5 19.9 39 39 A L H > S+ 0 0 85 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 0.829 98.6 55.6 -65.4 -29.3 39.1 30.7 21.2 40 40 A N H > S+ 0 0 131 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.914 103.9 49.0 -71.6 -40.2 37.3 31.2 24.5 41 41 A A H > S+ 0 0 35 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.864 114.1 50.1 -62.3 -34.3 34.1 29.5 23.4 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.880 107.6 50.1 -68.2 -43.8 36.4 26.7 22.3 43 43 A A H X S+ 0 0 25 -4,-2.5 4,-2.2 1,-0.2 11,-0.3 0.855 111.2 52.3 -65.3 -32.8 38.4 26.4 25.5 44 44 A S H X S+ 0 0 72 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.916 109.5 45.9 -66.6 -50.7 35.1 26.2 27.4 45 45 A E H X S+ 0 0 67 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.882 111.7 56.0 -60.0 -39.2 33.7 23.4 25.2 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.961 108.4 44.1 -58.4 -53.6 37.0 21.7 25.6 47 47 A D H X>S+ 0 0 36 -4,-2.2 4,-2.4 1,-0.2 5,-1.3 0.899 113.6 53.0 -59.2 -37.3 36.9 21.8 29.4 48 48 A K H <5S+ 0 0 141 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.890 109.8 47.8 -63.7 -42.9 33.3 20.7 29.3 49 49 A A H <5S+ 0 0 45 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.874 119.3 38.1 -67.9 -38.8 34.2 17.7 27.1 50 50 A I H <5S- 0 0 34 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.709 101.6-124.7 -89.0 -23.9 37.1 16.6 29.2 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 1,-0.2 -3,-0.2 0.811 77.9 74.5 83.3 28.1 35.7 17.2 32.6 52 52 A R S - 0 0 9 -2,-0.9 3,-1.6 -11,-0.3 -1,-0.2 0.670 32.0-143.0 -97.3 -18.2 42.5 22.1 30.6 55 55 A N T 3 S- 0 0 154 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.881 74.4 -59.5 55.3 35.3 44.0 25.4 29.6 56 56 A G T 3 S+ 0 0 3 -13,-0.2 -39,-1.4 1,-0.2 2,-0.4 0.495 115.9 100.4 75.0 9.5 43.7 24.1 25.9 57 57 A V B < -C 16 0B 63 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.977 44.4-179.4-132.2 139.0 45.9 21.1 26.2 58 58 A I - 0 0 4 -43,-2.2 2,-0.2 -2,-0.4 -30,-0.1 -0.794 24.7-115.6-127.4 167.9 45.0 17.5 26.6 59 59 A T > - 0 0 71 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.528 34.5-103.9 -96.7 174.0 46.9 14.2 27.0 60 60 A K H > S+ 0 0 106 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.865 120.2 54.2 -63.6 -42.9 46.9 11.3 24.5 61 61 A D H > S+ 0 0 124 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.869 108.3 50.1 -56.2 -45.7 44.6 9.2 26.6 62 62 A E H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.902 110.6 50.3 -62.9 -43.8 42.1 12.0 26.7 63 63 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -34,-0.4 0.911 110.2 48.8 -62.5 -42.3 42.3 12.4 23.0 64 64 A E H X S+ 0 0 74 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.823 108.0 55.5 -69.2 -26.0 41.8 8.7 22.5 65 65 A K H X S+ 0 0 136 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.942 108.4 46.2 -69.2 -46.4 38.9 8.9 24.8 66 66 A L H X S+ 0 0 5 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.880 111.8 55.4 -57.9 -40.8 37.2 11.6 22.7 67 67 A F H X S+ 0 0 13 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.930 104.6 49.6 -60.1 -49.6 38.0 9.5 19.7 68 68 A N H X S+ 0 0 90 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.932 113.6 48.0 -56.5 -44.6 36.3 6.3 20.9 69 69 A Q H X S+ 0 0 96 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.872 110.3 52.5 -61.7 -40.7 33.2 8.4 21.7 70 70 A D H X S+ 0 0 34 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.908 109.9 46.0 -64.1 -43.9 33.3 10.0 18.4 71 71 A V H X S+ 0 0 6 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.947 113.5 50.1 -65.4 -45.3 33.5 6.8 16.4 72 72 A D H X S+ 0 0 90 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.937 111.4 47.7 -59.6 -46.4 30.7 5.3 18.5 73 73 A A H X S+ 0 0 45 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.3 0.886 109.2 55.3 -64.1 -34.9 28.5 8.3 18.0 74 74 A A H X S+ 0 0 9 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.977 111.9 42.5 -58.8 -55.7 29.3 8.2 14.2 75 75 A V H X S+ 0 0 34 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.918 114.0 51.0 -56.7 -48.4 28.1 4.6 13.9 76 76 A R H X S+ 0 0 107 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.908 109.2 52.3 -60.2 -39.3 25.0 5.2 16.2 77 77 A G H X S+ 0 0 3 -4,-2.5 4,-0.9 -5,-0.2 3,-0.3 0.934 109.1 49.5 -61.9 -46.9 24.0 8.2 14.0 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.2 7,-0.4 0.965 111.3 47.8 -55.8 -52.8 24.2 6.1 10.9 79 79 A L H 3< S+ 0 0 70 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.742 113.8 49.8 -64.0 -21.1 22.1 3.3 12.4 80 80 A R H 3< S+ 0 0 172 -4,-1.5 2,-0.6 -3,-0.3 -1,-0.3 0.459 92.1 91.2 -90.9 -11.6 19.6 6.0 13.6 81 81 A N S+ 0 0 0 -3,-0.4 4,-2.3 -6,-0.2 3,-0.3 0.800 101.5 69.1 -92.3 -37.7 22.0 6.1 6.0 85 85 A K H X S+ 0 0 82 -4,-2.8 4,-3.1 -7,-0.4 5,-0.3 0.924 98.5 49.9 -50.0 -48.5 21.1 2.8 7.7 86 86 A P H > S+ 0 0 51 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.901 110.7 50.3 -64.5 -34.4 20.0 1.0 4.7 87 87 A V H > S+ 0 0 4 -4,-0.3 4,-1.0 -3,-0.3 -2,-0.2 0.949 111.9 47.8 -65.9 -45.4 23.1 1.9 2.9 88 88 A Y H >< S+ 0 0 30 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.948 109.2 52.9 -58.6 -48.2 25.3 0.8 5.7 89 89 A D H 3< S+ 0 0 75 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.840 107.9 53.0 -59.0 -31.7 23.5 -2.5 6.1 90 90 A S H 3< S+ 0 0 35 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.674 96.1 87.4 -76.2 -22.5 24.0 -3.2 2.4 91 91 A L S << S- 0 0 6 -3,-1.2 2,-0.1 -4,-1.0 31,-0.0 -0.444 75.2-117.9 -83.8 158.6 27.8 -2.7 2.5 92 92 A D > - 0 0 56 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.306 44.8 -89.2 -82.1 172.4 30.6 -5.1 3.3 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.836 123.1 46.3 -54.8 -45.3 32.9 -4.5 6.2 94 94 A V H > S+ 0 0 26 62,-0.2 4,-1.7 1,-0.2 3,-0.3 0.942 113.5 49.6 -64.3 -45.5 35.6 -2.3 4.5 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.858 103.5 59.4 -61.8 -36.4 33.0 -0.1 2.8 96 96 A R H X S+ 0 0 79 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.917 101.7 55.5 -56.8 -42.3 31.2 0.4 6.0 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.5 -3,-0.3 -2,-0.2 0.910 105.2 53.4 -57.4 -41.8 34.5 1.9 7.3 98 98 A A H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.893 108.0 47.6 -62.8 -37.6 34.4 4.4 4.5 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.909 111.0 52.7 -70.6 -37.0 30.8 5.6 5.2 100 100 A I H X S+ 0 0 7 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.936 106.4 53.7 -60.5 -48.3 31.7 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 5,-0.2 0.953 109.3 47.6 -52.8 -50.3 34.7 8.1 7.9 102 102 A M H X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.928 111.6 50.0 -56.5 -45.7 32.5 10.4 5.9 103 103 A V H X S+ 0 0 9 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.897 108.9 53.2 -61.1 -39.8 30.0 10.7 8.7 104 104 A F H < S+ 0 0 32 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.881 116.0 38.8 -63.9 -36.3 32.8 11.5 11.1 105 105 A Q H < S+ 0 0 55 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.899 133.0 19.4 -83.0 -38.8 34.1 14.3 9.0 106 106 A M H X S- 0 0 52 -4,-2.9 4,-0.7 -5,-0.2 -3,-0.2 0.446 102.7-115.7-116.8 2.2 31.0 15.8 7.7 107 107 A G H X - 0 0 33 -4,-2.3 4,-2.2 -5,-0.3 5,-0.2 0.177 33.9 -80.0 79.6 158.3 28.2 14.8 10.0 108 108 A E H > S+ 0 0 52 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.868 127.7 54.2 -59.8 -41.3 25.1 12.6 9.4 109 109 A T H > S+ 0 0 124 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.952 108.4 46.8 -63.8 -46.0 23.3 15.5 7.9 110 110 A G H < S+ 0 0 34 -4,-0.7 3,-0.4 1,-0.2 -2,-0.2 0.961 114.7 46.2 -62.7 -48.5 25.9 16.3 5.3 111 111 A V H >< S+ 0 0 1 -4,-2.2 3,-3.0 1,-0.2 -1,-0.2 0.940 106.1 58.3 -60.2 -44.8 26.4 12.7 4.3 112 112 A A H 3< S+ 0 0 12 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.840 96.4 66.5 -54.9 -29.3 22.6 12.0 4.0 113 113 A G T 3< S+ 0 0 58 -4,-1.5 2,-0.9 -3,-0.4 -1,-0.3 0.559 76.1 84.8 -71.7 -5.3 22.6 14.8 1.5 114 114 A F <> + 0 0 41 -3,-3.0 4,-2.4 1,-0.2 3,-0.3 -0.330 57.4 157.4 -91.1 52.0 24.7 12.8 -0.9 115 115 A T H > + 0 0 84 -2,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.858 65.6 44.6 -43.0 -57.2 21.4 11.2 -2.2 116 116 A N H > S+ 0 0 89 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.894 114.3 47.5 -61.3 -44.0 22.6 10.1 -5.6 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.871 110.7 54.7 -65.5 -38.0 25.9 8.6 -4.4 118 118 A L H X S+ 0 0 13 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.912 107.3 48.9 -61.7 -44.7 24.1 6.8 -1.6 119 119 A R H X S+ 0 0 120 -4,-2.0 4,-1.5 -5,-0.2 -1,-0.2 0.919 111.4 50.6 -62.2 -40.0 21.7 5.1 -4.1 120 120 A M H X>S+ 0 0 26 -4,-1.7 5,-2.2 2,-0.2 4,-0.6 0.884 109.3 49.6 -66.5 -39.4 24.6 4.1 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.935 108.3 53.4 -65.7 -40.4 26.5 2.6 -3.3 122 122 A Q H 3<5S+ 0 0 95 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.832 109.5 49.1 -60.3 -31.0 23.4 0.7 -2.3 123 123 A Q H 3<5S- 0 0 85 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.488 113.4-122.1 -84.5 -7.8 23.2 -0.7 -5.9 124 124 A K T <<5 + 0 0 97 -3,-1.2 2,-1.4 -4,-0.6 -3,-0.2 0.784 61.2 149.0 68.7 32.3 26.8 -1.7 -5.7 125 125 A R >< + 0 0 117 -5,-2.2 4,-2.4 1,-0.2 5,-0.2 -0.719 21.0 175.7 -94.7 75.2 27.7 0.5 -8.7 126 126 A W H > + 0 0 51 -2,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.895 69.4 42.8 -55.6 -51.3 31.2 1.2 -7.4 127 127 A D H > S+ 0 0 110 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.929 115.2 50.7 -68.6 -37.2 32.8 3.1 -10.2 128 128 A E H > S+ 0 0 109 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.928 110.2 49.2 -65.0 -43.5 29.7 5.2 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.900 108.1 55.5 -61.3 -39.8 29.4 6.1 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.1 4,-1.3 -5,-0.2 -1,-0.2 0.903 108.3 47.4 -60.0 -43.9 33.1 7.1 -7.1 131 131 A V H X S+ 0 0 88 -4,-2.0 4,-0.6 2,-0.2 3,-0.2 0.936 113.7 47.2 -64.2 -45.3 32.6 9.5 -9.9 132 132 A N H >< S+ 0 0 39 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.928 107.4 55.8 -62.7 -42.3 29.5 11.0 -8.3 133 133 A L H 3< S+ 0 0 3 -4,-3.0 6,-0.4 1,-0.3 -1,-0.2 0.868 101.5 59.4 -57.3 -38.1 31.2 11.3 -4.9 134 134 A A H 3< S+ 0 0 27 -4,-1.3 2,-1.7 -3,-0.2 -1,-0.3 0.661 86.8 77.9 -67.9 -17.8 34.0 13.4 -6.5 135 135 A K S << S+ 0 0 153 -3,-1.4 2,-0.3 -4,-0.6 -1,-0.2 -0.571 81.0 99.8 -92.6 69.6 31.6 16.1 -7.7 136 136 A S S > S- 0 0 17 -2,-1.7 4,-1.8 1,-0.1 5,-0.2 -0.996 85.3-118.4-152.1 154.2 31.3 17.6 -4.4 137 137 A R H > S+ 0 0 141 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.861 114.5 63.9 -60.2 -35.4 32.6 20.5 -2.4 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.942 105.0 42.6 -51.9 -52.3 34.1 17.8 -0.1 139 139 A Y H 4 S+ 0 0 60 -6,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.881 115.0 49.7 -66.8 -37.2 36.3 16.5 -2.7 140 140 A N H < S+ 0 0 110 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.895 115.6 42.7 -70.4 -36.0 37.4 19.9 -3.9 141 141 A Q H < S+ 0 0 103 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.871 131.2 19.8 -77.5 -43.1 38.2 21.1 -0.4 142 142 A T S X S+ 0 0 21 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 -0.576 73.2 163.4-131.6 72.6 40.0 18.0 0.9 143 143 A P H > + 0 0 45 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.823 68.1 52.4 -62.2 -39.7 41.0 16.2 -2.1 144 144 A N H > S+ 0 0 109 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.920 115.8 40.7 -67.2 -41.1 43.7 13.8 -0.7 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.906 113.3 53.1 -68.0 -45.9 41.4 12.5 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.925 107.8 53.4 -58.3 -41.0 38.4 12.3 -0.3 147 147 A K H X S+ 0 0 88 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.897 107.0 50.8 -61.7 -38.7 40.4 10.2 -2.7 148 148 A R H X S+ 0 0 70 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.933 113.8 43.2 -64.1 -42.3 41.4 7.8 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.954 114.6 51.1 -66.9 -46.2 37.8 7.3 1.0 150 150 A I H X S+ 0 0 13 -4,-2.9 4,-3.1 1,-0.3 -2,-0.2 0.896 108.8 50.1 -56.5 -47.1 36.5 7.2 -2.6 151 151 A T H X S+ 0 0 37 -4,-2.7 4,-2.7 -5,-0.3 6,-0.3 0.863 108.3 54.8 -62.5 -32.7 39.1 4.5 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.921 110.6 44.2 -66.3 -42.5 37.9 2.6 -0.4 153 153 A F H < S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.897 115.3 49.7 -66.7 -41.1 34.4 2.7 -1.7 154 154 A R H < S+ 0 0 108 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.932 124.6 24.4 -62.1 -48.4 35.5 1.8 -5.2 155 155 A T H < S- 0 0 40 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.655 84.9-136.5 -95.2 -25.1 37.8 -1.2 -4.3 156 156 A G S < S+ 0 0 15 -4,-2.4 2,-0.3 -5,-0.3 -62,-0.2 0.725 73.9 101.0 70.7 18.6 36.4 -2.5 -1.0 157 157 A T S S- 0 0 48 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.807 81.0-119.5-125.6 173.3 40.1 -2.9 0.1 158 158 A W S > S+ 0 0 43 -2,-0.3 3,-1.8 1,-0.2 4,-0.5 0.125 71.4 121.2 -97.4 17.1 42.4 -0.8 2.3 159 159 A D G > + 0 0 94 1,-0.3 3,-2.2 2,-0.2 -1,-0.2 0.871 65.7 60.3 -50.3 -41.0 44.9 -0.2 -0.4 160 160 A A G 3 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.687 109.1 46.7 -61.8 -17.1 44.6 3.7 -0.2 161 161 A Y G < 0 0 19 -3,-1.8 -1,-0.3 -13,-0.1 -2,-0.2 0.396 360.0 360.0-106.4 1.5 45.7 3.4 3.3 162 162 A K < 0 0 170 -3,-2.2 -2,-0.2 -4,-0.5 -3,-0.1 0.868 360.0 360.0-102.4 360.0 48.5 1.1 2.7