==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 10-AUG-92 1LYJ . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.A.BELL,W.J.BECKTEL,U.SAUER,W.A.BAASE,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8530.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 74.1 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 . 12 7.4 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 76 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 149.9 43.5 -1.7 9.1 2 2 A N > - 0 0 70 156,-0.0 4,-2.4 95,-0.0 3,-0.2 -0.905 360.0 -81.9-152.3 175.8 40.2 -0.8 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.851 124.6 51.4 -55.5 -43.2 38.1 2.3 11.3 4 4 A F H > S+ 0 0 77 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.920 113.9 41.2 -63.6 -47.3 40.2 3.6 14.2 5 5 A E H > S+ 0 0 97 2,-0.2 4,-1.4 -3,-0.2 -1,-0.2 0.814 114.5 54.7 -70.7 -30.4 43.5 3.4 12.4 6 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 3,-0.4 0.976 112.2 41.1 -66.5 -52.4 41.9 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 5,-0.4 0.840 109.3 60.1 -64.7 -32.0 40.6 7.8 10.9 8 8 A R H X S+ 0 0 102 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.893 107.5 46.8 -64.1 -33.8 43.8 8.3 12.9 9 9 A I H < S+ 0 0 86 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.922 116.0 44.1 -71.9 -44.4 45.6 8.6 9.5 10 10 A D H < S+ 0 0 20 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.844 126.2 29.2 -70.4 -34.1 43.1 11.0 8.1 11 11 A E H < S- 0 0 44 -4,-2.5 19,-0.3 -5,-0.2 -3,-0.2 0.728 90.1-156.7 -99.0 -28.1 42.8 13.2 11.1 12 12 A G < - 0 0 21 -4,-1.9 2,-0.4 -5,-0.4 -1,-0.1 -0.189 26.1 -86.1 74.9-168.9 46.2 13.0 12.8 13 13 A L + 0 0 39 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.964 40.4 175.0-143.1 125.3 46.6 13.7 16.6 14 14 A R E -A 28 0A 140 14,-1.7 14,-2.2 -2,-0.4 4,-0.1 -0.995 17.7-163.5-133.2 132.1 47.2 17.1 18.3 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.1 12,-0.2 2,-0.3 0.444 75.2 61.9 -92.1 -3.9 47.3 17.6 21.9 16 16 A K E S-C 57 0B 96 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.917 101.4 -87.4-121.6 147.3 46.8 21.4 21.9 17 17 A I E + 0 0 17 39,-1.4 2,-0.3 -2,-0.3 10,-0.2 -0.309 58.6 170.1 -53.1 136.6 43.8 23.3 20.5 18 18 A Y E -A 26 0A 28 8,-2.5 8,-2.8 -4,-0.1 2,-0.4 -0.858 35.7-103.3-140.0 172.1 44.2 23.8 16.8 19 19 A K E -A 25 0A 127 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.870 33.8-136.9-103.3 135.2 42.2 25.0 13.9 20 20 A D > - 0 0 48 4,-3.3 3,-1.8 -2,-0.4 -1,-0.1 -0.028 41.4 -80.1 -75.6-172.3 40.9 22.5 11.4 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.770 134.4 48.9 -61.9 -23.4 40.8 22.7 7.6 22 22 A E T 3 S- 0 0 76 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.420 123.6-103.4 -94.0 -4.4 37.7 24.9 7.9 23 23 A G S < S+ 0 0 37 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.558 75.0 140.3 91.3 13.7 39.2 27.2 10.6 24 24 A Y - 0 0 78 1,-0.1 -4,-3.3 -5,-0.0 -1,-0.3 -0.758 60.0-103.5 -96.9 144.9 37.4 25.6 13.5 25 25 A Y E +AB 19 34A 35 9,-0.6 8,-2.6 11,-0.4 9,-1.4 -0.399 52.9 161.0 -62.8 122.1 38.8 24.9 16.9 26 26 A T E -AB 18 32A 2 -8,-2.8 -8,-2.5 6,-0.2 2,-0.3 -0.858 19.3-166.2-137.8 164.3 39.5 21.2 17.3 27 27 A I E > - B 0 31A 0 4,-1.3 4,-1.8 -2,-0.3 -12,-0.2 -0.945 53.8 -0.9-149.3 162.9 41.7 19.1 19.6 28 28 A G E 4 S-A 14 0A 1 -14,-2.2 -14,-1.7 -2,-0.3 2,-0.8 -0.322 123.9 -1.6 63.2-125.3 43.0 15.4 19.6 29 29 A I T 4 S- 0 0 4 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.643 126.9 -56.4-104.3 69.8 41.8 13.2 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.8 2,-1.1 -19,-0.3 -2,-0.2 0.748 82.2 163.6 66.1 29.0 39.6 15.5 14.8 31 31 A H E < -B 27 0A 32 -4,-1.8 -4,-1.3 1,-0.0 -1,-0.2 -0.642 32.8-140.7 -80.1 101.5 37.4 16.3 17.7 32 32 A L E -B 26 0A 69 -2,-1.1 -6,-0.2 -6,-0.2 3,-0.1 -0.323 22.1-179.2 -60.0 127.9 35.5 19.5 16.7 33 33 A L E - 0 0 14 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.889 57.9 -24.6 -95.9 -50.6 35.2 21.7 19.8 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.6 2,-0.1 -1,-0.4 -0.983 35.5-140.0-158.9 154.0 33.2 24.7 18.5 35 35 A K S S+ 0 0 136 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.475 73.6 110.5 -92.5 -4.5 32.4 26.6 15.4 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.382 73.7-130.0 -72.4 148.2 32.7 29.9 17.3 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.647 77.6 105.3 -71.3 -13.3 35.7 32.2 16.6 38 38 A S > - 0 0 50 1,-0.2 4,-1.8 2,-0.0 3,-0.2 -0.625 56.2-161.8 -84.1 118.7 36.4 32.4 20.3 39 39 A L H > S+ 0 0 69 -2,-0.6 4,-2.4 1,-0.3 5,-0.2 0.796 97.5 55.0 -60.5 -28.7 39.4 30.6 21.7 40 40 A N H > S+ 0 0 119 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.898 103.2 50.2 -75.4 -39.7 37.7 31.0 25.1 41 41 A A H > S+ 0 0 36 -3,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.851 112.5 53.1 -61.8 -30.7 34.5 29.4 24.0 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.917 108.0 47.1 -67.3 -47.5 36.9 26.6 22.7 43 43 A K H X S+ 0 0 46 -4,-2.4 4,-2.4 2,-0.2 11,-0.3 0.806 111.6 53.2 -64.7 -30.4 38.7 26.2 26.0 44 44 A S H X S+ 0 0 74 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.936 110.1 44.5 -70.6 -48.7 35.4 26.1 27.8 45 45 A E H X S+ 0 0 68 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.929 112.9 55.7 -60.5 -45.4 33.9 23.3 25.6 46 46 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 5,-0.3 0.930 108.8 43.4 -53.8 -53.0 37.3 21.6 26.0 47 47 A D H X>S+ 0 0 34 -4,-2.4 4,-1.9 2,-0.2 5,-1.2 0.825 114.0 52.8 -63.6 -33.0 37.2 21.6 29.8 48 48 A K H <5S+ 0 0 141 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.904 110.5 48.2 -63.2 -46.5 33.4 20.5 29.7 49 49 A A H <5S+ 0 0 44 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.853 120.5 35.4 -64.6 -36.8 34.4 17.6 27.4 50 50 A I H <5S- 0 0 37 -4,-1.9 -2,-0.2 2,-0.3 -1,-0.2 0.679 99.5-127.5 -92.2 -25.9 37.3 16.4 29.6 51 51 A G T <5S+ 0 0 68 -4,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.857 78.4 76.9 78.9 31.8 35.9 17.2 33.1 52 52 A R S - 0 0 9 -2,-0.8 3,-1.6 -11,-0.3 -1,-0.2 0.697 33.3-143.2 -99.2 -15.2 42.7 21.9 30.9 55 55 A N T 3 S- 0 0 117 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.850 75.2 -59.0 53.0 38.9 44.1 25.2 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.4 1,-0.1 2,-0.4 0.505 117.6 99.4 72.4 6.4 43.8 24.1 26.1 57 57 A V B < +C 16 0B 66 -3,-1.6 2,-0.2 -41,-0.2 -41,-0.2 -0.975 45.5 178.3-127.9 135.6 46.1 21.1 26.5 58 58 A I - 0 0 5 -43,-2.1 2,-0.2 -2,-0.4 -30,-0.1 -0.799 26.4-110.6-126.5 167.8 45.2 17.4 27.0 59 59 A A > - 0 0 38 -2,-0.2 4,-2.0 1,-0.1 3,-0.4 -0.537 34.0-105.3 -93.5 163.2 47.0 14.0 27.3 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.865 120.7 52.6 -51.2 -51.3 47.1 11.2 24.8 61 61 A D H > S+ 0 0 106 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.854 109.9 51.1 -54.5 -41.2 44.8 8.9 26.8 62 62 A E H > S+ 0 0 35 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.890 110.0 48.3 -67.6 -39.9 42.3 11.9 26.9 63 63 A A H X S+ 0 0 1 -4,-2.0 4,-1.8 2,-0.2 -34,-0.5 0.876 111.9 50.1 -65.1 -41.8 42.5 12.4 23.2 64 64 A E H X S+ 0 0 78 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.864 107.4 54.0 -67.2 -36.1 41.9 8.7 22.6 65 65 A K H X S+ 0 0 133 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.967 108.6 47.3 -65.0 -45.1 39.0 8.7 24.9 66 66 A L H X S+ 0 0 4 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.901 112.4 52.9 -57.5 -40.4 37.2 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.938 105.4 51.9 -61.7 -50.8 38.1 9.5 19.8 68 68 A N H X S+ 0 0 88 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.944 113.2 46.6 -53.4 -45.1 36.5 6.3 21.1 69 69 A Q H X S+ 0 0 95 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.897 111.1 51.2 -62.4 -44.5 33.3 8.4 21.9 70 70 A D H X S+ 0 0 35 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.856 110.0 47.5 -62.4 -41.0 33.3 10.1 18.6 71 71 A V H X S+ 0 0 5 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.951 114.0 49.3 -65.5 -46.1 33.6 6.8 16.5 72 72 A D H X S+ 0 0 90 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.918 111.0 47.7 -57.7 -46.6 30.8 5.3 18.6 73 73 A A H X S+ 0 0 43 -4,-2.4 4,-2.8 -5,-0.2 -1,-0.2 0.904 109.7 55.0 -63.5 -40.7 28.5 8.3 18.2 74 74 A A H X S+ 0 0 10 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.968 111.0 44.1 -57.5 -54.8 29.3 8.2 14.4 75 75 A V H X S+ 0 0 34 -4,-2.8 4,-2.4 1,-0.2 5,-0.2 0.952 114.5 49.4 -53.5 -51.5 28.2 4.5 14.1 76 76 A R H X S+ 0 0 112 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.908 108.9 52.9 -60.4 -36.9 25.1 5.2 16.3 77 77 A G H X S+ 0 0 2 -4,-2.8 4,-0.6 -5,-0.2 -1,-0.2 0.937 109.0 49.4 -65.0 -41.1 24.1 8.2 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.2 7,-0.5 0.928 111.6 49.7 -59.5 -45.6 24.3 6.1 11.0 79 79 A L H 3< S+ 0 0 68 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.786 113.3 45.8 -69.7 -24.3 22.1 3.4 12.7 80 80 A R H 3< S+ 0 0 175 -4,-1.8 2,-0.6 -5,-0.2 -1,-0.3 0.456 92.9 94.9 -93.5 -6.7 19.6 5.9 13.8 81 81 A N S+ 0 0 123 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.710 119.3 42.6 -90.2 -27.6 18.7 7.4 5.0 84 84 A L H >> S+ 0 0 0 -3,-0.2 4,-2.7 -7,-0.2 3,-0.5 0.902 100.3 66.3 -85.9 -43.4 22.0 6.1 6.2 85 85 A K H 3X S+ 0 0 82 -4,-2.4 4,-3.1 -7,-0.5 5,-0.2 0.865 99.2 50.4 -46.4 -49.1 21.1 2.8 7.9 86 86 A P H 3> S+ 0 0 49 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.893 112.4 48.9 -63.2 -36.2 20.0 1.0 4.7 87 87 A V H XX S+ 0 0 2 -3,-0.5 4,-0.8 -4,-0.5 3,-0.5 0.966 112.4 47.0 -65.0 -52.7 23.2 2.0 3.0 88 88 A Y H >< S+ 0 0 34 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.930 111.2 52.1 -53.3 -48.0 25.3 0.8 5.8 89 89 A D H 3< S+ 0 0 75 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.822 107.9 53.0 -59.6 -31.7 23.4 -2.5 6.1 90 90 A S H << S+ 0 0 33 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.637 96.2 89.2 -78.7 -17.0 23.9 -3.1 2.5 91 91 A L S << S- 0 0 6 -3,-1.3 31,-0.0 -4,-0.8 30,-0.0 -0.541 74.0-119.1 -86.6 154.5 27.7 -2.6 2.6 92 92 A D > - 0 0 56 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.202 45.8 -91.2 -73.9 171.6 30.6 -5.0 3.2 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.875 123.0 47.6 -58.8 -40.0 33.0 -4.3 6.2 94 94 A V H > S+ 0 0 25 2,-0.2 4,-1.4 62,-0.2 3,-0.4 0.951 112.7 46.8 -66.4 -51.8 35.5 -2.2 4.4 95 95 A R H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.871 106.3 60.5 -59.7 -36.5 33.0 0.1 2.6 96 96 A R H X S+ 0 0 80 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.902 101.7 52.9 -56.7 -42.3 31.2 0.5 5.9 97 97 A A H X S+ 0 0 7 -4,-1.4 4,-2.2 -3,-0.4 -1,-0.2 0.891 105.6 55.5 -60.3 -37.6 34.4 2.0 7.4 98 98 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.866 108.7 46.7 -61.9 -38.9 34.4 4.5 4.4 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.898 110.0 52.5 -71.7 -37.7 30.9 5.6 5.3 100 100 A I H X S+ 0 0 8 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.905 107.2 53.5 -63.8 -40.1 31.7 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.955 108.5 48.6 -60.8 -50.6 34.7 8.1 8.0 102 102 A M H X S+ 0 0 3 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.917 112.1 50.2 -54.0 -45.3 32.5 10.5 5.9 103 103 A V H X S+ 0 0 9 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.917 109.2 50.2 -61.5 -39.9 30.1 10.7 8.9 104 104 A F H < S+ 0 0 32 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.860 116.5 42.3 -67.7 -33.4 32.8 11.5 11.4 105 105 A Q H < S+ 0 0 57 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.852 132.7 16.3 -80.9 -42.5 34.1 14.3 9.1 106 106 A M H X S- 0 0 53 -4,-2.8 4,-0.6 -5,-0.2 -3,-0.2 0.495 102.4-115.5-119.3 2.9 31.0 15.8 8.0 107 107 A G H X - 0 0 33 -4,-2.5 4,-2.2 -5,-0.3 5,-0.2 0.273 34.0 -79.9 75.9 156.0 28.2 14.7 10.3 108 108 A E H > S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.872 126.3 55.1 -56.4 -43.8 25.1 12.7 9.6 109 109 A T H > S+ 0 0 122 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.928 108.4 46.8 -60.0 -49.1 23.2 15.5 8.1 110 110 A G H >< S+ 0 0 34 -4,-0.6 3,-0.7 2,-0.2 -2,-0.2 0.929 115.2 44.3 -59.8 -50.2 25.9 16.3 5.5 111 111 A V H >< S+ 0 0 0 -4,-2.2 3,-3.3 1,-0.3 -2,-0.2 0.943 106.4 60.9 -59.6 -47.0 26.4 12.7 4.4 112 112 A A H 3< S+ 0 0 10 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.741 96.4 63.8 -53.4 -24.1 22.7 12.1 4.3 113 113 A G T << S+ 0 0 53 -4,-0.9 2,-1.6 -3,-0.7 -1,-0.3 0.562 74.3 89.6 -81.3 -4.5 22.5 14.8 1.8 114 114 A F <> + 0 0 43 -3,-3.3 4,-2.5 1,-0.2 3,-0.3 -0.312 56.0 161.2 -86.5 54.8 24.6 12.9 -0.8 115 115 A T H > + 0 0 85 -2,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.851 64.6 43.7 -41.1 -57.6 21.4 11.4 -2.1 116 116 A N H > S+ 0 0 89 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.846 115.0 47.5 -63.8 -40.0 22.5 10.2 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.865 109.1 56.0 -68.1 -40.0 25.8 8.7 -4.4 118 118 A L H X S+ 0 0 14 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.908 108.3 47.8 -58.5 -43.8 24.0 6.9 -1.5 119 119 A R H X S+ 0 0 117 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.873 111.2 50.3 -67.2 -38.5 21.7 5.3 -4.0 120 120 A M H <>S+ 0 0 26 -4,-1.7 5,-2.3 2,-0.2 4,-0.3 0.895 110.1 50.0 -68.7 -37.5 24.5 4.3 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.6 3,-2.2 2,-0.2 -2,-0.2 0.953 108.7 52.1 -64.0 -45.8 26.4 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 91 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.894 110.6 49.1 -58.1 -36.6 23.3 0.8 -2.3 123 123 A Q T 3<5S- 0 0 85 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.466 113.0-122.0 -80.2 -3.6 23.0 -0.5 -5.8 124 124 A K T < 5 + 0 0 98 -3,-2.2 2,-1.1 -4,-0.3 -3,-0.2 0.808 61.8 146.1 64.6 33.7 26.7 -1.5 -5.8 125 125 A R >< + 0 0 116 -5,-2.3 4,-2.4 1,-0.2 -1,-0.2 -0.761 20.7 172.6-100.6 79.5 27.6 0.7 -8.8 126 126 A W H > + 0 0 50 -2,-1.1 4,-2.1 1,-0.2 -1,-0.2 0.893 69.8 47.7 -59.4 -49.5 31.1 1.5 -7.5 127 127 A D H > S+ 0 0 114 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.928 115.1 46.4 -63.0 -44.2 32.6 3.2 -10.4 128 128 A E H > S+ 0 0 112 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.875 110.9 50.7 -69.7 -37.1 29.5 5.4 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.896 109.1 53.0 -63.2 -39.8 29.3 6.3 -7.2 130 130 A A H X S+ 0 0 12 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.902 109.3 48.9 -61.5 -43.4 33.0 7.3 -7.1 131 131 A V H X S+ 0 0 92 -4,-1.9 4,-0.6 1,-0.2 3,-0.5 0.946 114.8 44.8 -63.0 -48.1 32.5 9.6 -10.0 132 132 A N H >< S+ 0 0 38 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.857 107.4 57.3 -65.2 -36.1 29.4 11.2 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.3 1,-0.2 -1,-0.2 0.864 99.1 62.7 -63.8 -31.5 31.1 11.5 -4.9 134 134 A A H 3< S+ 0 0 27 -4,-1.2 2,-1.7 -3,-0.5 -1,-0.2 0.713 85.5 76.9 -66.9 -23.4 33.9 13.6 -6.6 135 135 A K S << S+ 0 0 153 -3,-0.8 2,-0.3 -4,-0.6 -1,-0.2 -0.550 80.1 99.3 -87.8 71.3 31.4 16.4 -7.6 136 136 A S S > S- 0 0 17 -2,-1.7 4,-2.1 1,-0.1 5,-0.1 -0.991 84.0-118.3-153.0 154.1 31.2 17.9 -4.2 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.923 114.7 63.4 -58.2 -43.5 32.6 20.7 -2.2 138 138 A W H > S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.899 106.1 42.3 -42.9 -53.9 34.0 17.9 0.1 139 139 A Y H 4 S+ 0 0 56 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.900 115.0 50.7 -65.4 -44.2 36.2 16.6 -2.7 140 140 A N H < S+ 0 0 107 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.851 115.7 41.7 -64.6 -34.5 37.2 20.1 -3.8 141 141 A Q H < S+ 0 0 106 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.862 131.0 20.5 -82.1 -41.4 38.2 21.2 -0.3 142 142 A T S X S+ 0 0 20 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 -0.628 72.4 163.9-129.8 69.7 40.0 18.1 1.0 143 143 A P H > S+ 0 0 47 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.790 70.6 51.4 -57.1 -39.8 41.0 16.3 -2.2 144 144 A N H > S+ 0 0 110 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.930 116.9 39.2 -68.5 -47.3 43.7 13.9 -0.7 145 145 A R H > S+ 0 0 23 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.929 115.6 52.5 -66.8 -46.1 41.4 12.6 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 -8,-0.2 5,-0.2 0.953 109.1 50.5 -54.1 -48.6 38.3 12.5 -0.3 147 147 A K H X S+ 0 0 93 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.856 109.1 51.6 -57.7 -38.8 40.3 10.4 -2.9 148 148 A R H X S+ 0 0 68 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.943 113.0 44.1 -64.6 -44.4 41.3 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.925 114.3 50.3 -63.9 -43.3 37.7 7.5 1.0 150 150 A I H X S+ 0 0 13 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.871 108.0 51.8 -65.4 -38.6 36.5 7.3 -2.6 151 151 A T H X S+ 0 0 34 -4,-2.2 4,-2.6 -5,-0.2 6,-0.3 0.870 106.2 55.5 -66.0 -37.4 39.0 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.854 111.3 44.7 -58.6 -40.1 37.9 2.6 -0.5 153 153 A F H < S+ 0 0 2 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.861 115.4 46.3 -73.1 -39.9 34.3 2.7 -1.9 154 154 A R H < S+ 0 0 104 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.912 126.7 27.5 -69.4 -42.2 35.3 1.9 -5.5 155 155 A T H < S- 0 0 44 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.793 83.1-140.8 -93.0 -38.0 37.6 -0.9 -4.5 156 156 A G S < S+ 0 0 17 -4,-2.1 2,-0.3 1,-0.3 -62,-0.2 0.667 71.7 97.0 78.9 18.9 36.4 -2.4 -1.2 157 157 A T S S- 0 0 46 -6,-0.3 -1,-0.3 -5,-0.2 3,-0.3 -0.831 82.9-116.0-128.5 174.2 40.1 -2.8 -0.1 158 158 A W S > S+ 0 0 44 -2,-0.3 3,-1.8 1,-0.2 4,-0.2 0.052 71.1 124.2 -97.0 21.7 42.4 -0.7 2.1 159 159 A D G > + 0 0 93 1,-0.3 3,-1.6 2,-0.2 -1,-0.2 0.830 66.7 56.4 -50.9 -40.9 44.8 0.0 -0.7 160 160 A A G 3 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.608 108.8 50.4 -68.7 -16.6 44.7 3.9 -0.4 161 161 A Y G < 0 0 19 -3,-1.8 -1,-0.3 -13,-0.1 -2,-0.2 0.328 360.0 360.0-105.8 6.9 45.6 3.5 3.2 162 162 A K < 0 0 176 -3,-1.6 -2,-0.2 -4,-0.2 -3,-0.1 0.775 360.0 360.0-110.8 360.0 48.6 1.3 2.6