==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-JUN-99 1QT5 . COMPND 2 MOLECULE: PROTEIN (T4 LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR R.KUROKI,L.H.WEAVER,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8791.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 73.2 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 7.3 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 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 53.0 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, 0.0 161,-0.0 0.000 360.0 360.0 360.0 146.8 43.6 -1.9 9.0 2 2 A N > - 0 0 68 156,-0.0 4,-3.0 95,-0.0 5,-0.2 -0.927 360.0 -83.6-150.2 176.9 40.4 -0.8 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.808 123.5 52.4 -55.6 -37.3 38.4 2.3 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.925 113.4 42.3 -69.0 -44.3 40.4 3.6 14.1 5 5 A E H > S+ 0 0 96 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.878 113.6 54.4 -67.4 -37.8 43.7 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.961 112.8 40.8 -60.9 -51.3 42.1 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.4 0.842 108.5 60.1 -66.9 -30.9 40.8 7.8 10.9 8 8 A R H X S+ 0 0 107 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.889 107.8 48.3 -64.4 -34.5 44.0 8.2 12.9 9 9 A I H < S+ 0 0 47 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.955 114.9 43.0 -67.9 -49.7 45.6 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 0.825 125.3 31.6 -67.1 -33.6 43.2 11.0 8.1 11 11 A E H < S- 0 0 43 -4,-2.7 19,-0.4 -5,-0.2 -1,-0.2 0.700 89.8-153.7 -95.9 -29.7 42.9 13.2 11.2 12 12 A G < - 0 0 22 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.2 -0.215 26.3 -86.1 75.8-168.6 46.3 13.0 12.9 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.981 41.6 176.2-141.7 125.7 46.8 13.6 16.6 14 14 A R E -A 28 0A 146 14,-1.4 14,-2.7 -2,-0.4 4,-0.1 -0.987 17.9-163.7-138.6 123.7 47.3 17.0 18.3 15 15 A L E S+ 0 0 69 -2,-0.4 43,-2.1 12,-0.2 2,-0.3 0.496 75.8 56.8 -81.9 -13.9 47.5 17.5 22.0 16 16 A K E S-C 57 0B 104 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.874 101.6 -86.1-119.7 152.4 46.9 21.3 22.0 17 17 A I E + 0 0 4 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.262 57.0 168.5 -55.8 143.0 43.9 23.1 20.6 18 18 A Y E -A 26 0A 27 8,-3.0 8,-3.3 -4,-0.1 2,-0.4 -0.915 36.2-105.1-146.8 174.4 44.3 23.8 16.9 19 19 A K E -A 25 0A 120 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.840 32.4-146.5-103.9 135.1 42.2 25.0 13.9 20 20 A E > - 0 0 57 4,-2.6 3,-2.4 -2,-0.4 -1,-0.0 -0.263 45.7 -68.5 -90.7-166.4 41.2 22.4 11.3 21 21 A T T 3 S+ 0 0 104 1,-0.3 -2,-0.0 2,-0.1 -1,-0.0 0.774 134.4 46.1 -53.9 -35.2 40.9 23.0 7.6 22 22 A E T 3 S- 0 0 73 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.356 123.1-102.2 -84.9 0.7 37.8 25.3 7.8 23 23 A G S < S+ 0 0 36 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.616 75.1 140.3 88.8 17.4 39.4 27.3 10.7 24 24 A Y - 0 0 76 1,-0.1 -4,-2.6 9,-0.0 -1,-0.3 -0.732 58.1-100.7-100.4 147.4 37.5 25.7 13.7 25 25 A Y E +AB 19 34A 33 9,-0.7 8,-2.6 11,-0.4 9,-1.4 -0.409 52.7 158.2 -67.7 133.4 39.0 24.8 16.9 26 26 A T E -AB 18 32A 3 -8,-3.3 -8,-3.0 6,-0.3 2,-0.3 -0.905 18.6-168.8-145.1 168.7 39.7 21.2 17.4 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.3 -2,-0.3 2,-0.2 -0.994 51.2 8.3-158.2 165.4 41.9 18.9 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.7 -14,-1.4 -2,-0.3 2,-1.1 -0.496 121.7 -8.0 69.3-133.5 43.0 15.3 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.734 128.5 -52.3 -98.7 73.5 42.1 13.1 16.7 30 30 A G T 4 S+ 0 0 14 -2,-1.1 2,-1.1 -19,-0.4 -2,-0.2 0.805 83.3 163.2 66.2 32.1 39.8 15.4 14.9 31 31 A H E < -B 27 0A 31 -4,-2.3 -4,-1.6 -20,-0.1 -1,-0.2 -0.701 31.6-142.2 -90.7 102.5 37.6 16.3 17.8 32 32 A L E -B 26 0A 80 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.323 20.1-177.5 -62.4 127.0 35.7 19.4 16.8 33 33 A L E - 0 0 14 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.914 57.4 -24.5 -93.7 -47.1 35.3 21.6 19.8 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.958 35.4-135.3-166.1 154.2 33.3 24.5 18.5 35 35 A K S S+ 0 0 148 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.552 76.5 110.0 -85.9 -13.4 32.4 26.4 15.4 36 36 A S S S- 0 0 40 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.222 71.1-135.3 -69.1 145.5 32.9 29.6 17.3 37 37 A P S S+ 0 0 117 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.675 75.7 102.8 -74.6 -16.1 35.7 32.0 16.7 38 38 A S > - 0 0 51 1,-0.2 4,-1.7 2,-0.1 -2,-0.1 -0.605 56.0-161.2 -82.0 122.1 36.4 32.4 20.4 39 39 A L H > S+ 0 0 58 -2,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.776 95.8 55.3 -64.4 -28.1 39.3 30.5 21.8 40 40 A N H > S+ 0 0 116 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.939 103.6 51.1 -71.7 -42.7 37.9 30.9 25.1 41 41 A A H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.860 111.1 52.0 -59.9 -33.1 34.7 29.4 24.1 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.913 107.0 50.4 -69.3 -41.1 36.9 26.6 22.8 43 43 A K H X S+ 0 0 55 -4,-2.6 4,-2.4 2,-0.2 11,-0.3 0.859 109.2 53.9 -66.2 -30.0 38.7 26.1 26.0 44 44 A S H X S+ 0 0 71 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.950 108.9 47.1 -68.1 -45.0 35.3 26.0 27.8 45 45 A E H X S+ 0 0 65 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.929 111.2 53.1 -62.1 -43.8 34.1 23.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.4 0.949 109.1 46.1 -60.6 -46.2 37.3 21.4 26.0 47 47 A D H X>S+ 0 0 36 -4,-2.4 4,-3.5 1,-0.2 5,-1.5 0.927 113.0 51.7 -59.5 -40.6 37.2 21.5 29.8 48 48 A K H <5S+ 0 0 142 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.884 112.2 45.9 -59.4 -47.2 33.6 20.4 29.7 49 49 A A H <5S+ 0 0 44 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.882 121.6 36.8 -66.2 -37.7 34.5 17.5 27.4 50 50 A I H <5S- 0 0 34 -4,-2.6 -2,-0.2 2,-0.3 -1,-0.2 0.710 101.1-130.4 -87.1 -32.1 37.4 16.4 29.5 51 51 A G T <5S+ 0 0 63 -4,-3.5 2,-0.3 -5,-0.4 -3,-0.2 0.859 74.6 75.8 84.8 28.1 36.0 17.2 32.8 52 52 A R S - 0 0 8 -2,-1.1 3,-1.3 -11,-0.3 -1,-0.2 0.714 32.2-143.8 -87.2 -23.6 42.8 21.7 30.8 55 55 A N T 3 S- 0 0 124 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.851 73.5 -59.2 61.4 30.7 44.2 25.0 29.8 56 56 A G T 3 S+ 0 0 2 -13,-0.2 -39,-1.6 1,-0.2 2,-0.4 0.555 117.5 101.5 76.6 6.3 43.9 23.8 26.1 57 57 A V B < +C 16 0B 75 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.973 44.0 176.8-127.9 136.2 46.1 20.8 26.6 58 58 A I - 0 0 4 -43,-2.1 2,-0.2 -2,-0.4 -30,-0.1 -0.842 27.9-110.1-129.4 167.8 45.2 17.1 27.0 59 59 A T > - 0 0 64 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.493 31.9-105.0 -95.6 174.9 47.0 14.0 27.3 60 60 A K H > S+ 0 0 112 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.927 121.4 52.1 -61.4 -47.0 47.2 11.2 24.7 61 61 A D H > S+ 0 0 116 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.908 109.0 49.9 -57.1 -45.2 44.9 9.0 26.8 62 62 A E H > S+ 0 0 38 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 110.3 51.0 -62.0 -46.7 42.2 11.8 27.0 63 63 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -34,-0.4 0.913 110.4 48.6 -58.4 -39.8 42.5 12.3 23.2 64 64 A E H X S+ 0 0 74 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.832 109.1 54.9 -70.5 -28.6 42.0 8.5 22.6 65 65 A K H X S+ 0 0 137 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.936 108.5 45.5 -70.8 -42.8 39.1 8.7 24.9 66 66 A L H X S+ 0 0 6 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.900 112.4 54.7 -64.2 -38.1 37.4 11.4 23.0 67 67 A F H X S+ 0 0 14 -4,-2.3 4,-2.6 -5,-0.2 5,-0.3 0.920 105.6 49.7 -61.4 -44.5 38.2 9.4 19.8 68 68 A N H X S+ 0 0 90 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.947 112.5 48.9 -59.9 -40.9 36.5 6.3 21.0 69 69 A Q H X S+ 0 0 101 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.874 111.3 49.9 -63.5 -39.2 33.5 8.3 21.9 70 70 A D H X S+ 0 0 32 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.872 111.2 47.3 -69.1 -36.0 33.4 10.0 18.5 71 71 A V H X S+ 0 0 7 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.941 113.1 49.1 -67.9 -47.2 33.7 6.8 16.6 72 72 A D H X S+ 0 0 104 -4,-2.6 4,-2.4 -5,-0.3 -2,-0.2 0.937 111.5 49.3 -55.5 -46.1 31.1 5.3 18.7 73 73 A A H X S+ 0 0 57 -4,-2.3 4,-2.9 -5,-0.2 -1,-0.2 0.886 108.5 54.0 -61.0 -41.0 28.9 8.3 18.1 74 74 A A H X S+ 0 0 9 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.950 110.2 45.2 -61.2 -49.7 29.5 8.2 14.3 75 75 A V H X S+ 0 0 35 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.940 114.9 49.6 -58.1 -46.7 28.3 4.5 14.0 76 76 A R H X S+ 0 0 127 -4,-2.4 4,-1.5 -5,-0.3 -1,-0.2 0.908 107.5 52.8 -62.1 -42.6 25.4 5.2 16.2 77 77 A G H X S+ 0 0 11 -4,-2.9 4,-0.8 1,-0.2 -1,-0.2 0.900 110.2 49.4 -58.8 -41.8 24.4 8.2 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.1 1,-0.2 7,-0.6 0.946 110.4 49.7 -59.3 -52.2 24.5 6.1 10.9 79 79 A L H 3< S+ 0 0 59 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.762 112.6 47.0 -65.3 -23.2 22.4 3.4 12.4 80 80 A R H 3< S+ 0 0 192 -4,-1.5 2,-0.5 -5,-0.2 -1,-0.3 0.540 92.8 95.8 -91.1 -10.4 19.8 5.9 13.6 81 81 A N S+ 0 0 140 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.835 120.9 43.6 -82.3 -33.3 18.9 7.5 4.8 84 84 A L H > S+ 0 0 0 -6,-0.2 4,-2.8 -7,-0.2 3,-0.3 0.883 100.2 63.3 -79.4 -46.9 22.2 6.1 6.2 85 85 A K H X S+ 0 0 82 -4,-3.1 4,-3.5 -7,-0.6 5,-0.2 0.870 99.7 51.8 -51.7 -46.2 21.4 2.9 7.7 86 86 A P H > S+ 0 0 56 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.896 112.6 47.0 -63.2 -34.2 20.2 1.1 4.6 87 87 A V H X S+ 0 0 1 -4,-0.5 4,-0.9 -3,-0.3 3,-0.3 0.966 112.4 48.5 -70.0 -47.2 23.3 1.9 2.8 88 88 A Y H >< S+ 0 0 32 -4,-2.8 3,-1.4 1,-0.2 -1,-0.2 0.942 109.5 54.3 -55.7 -45.3 25.5 0.9 5.6 89 89 A D H 3< S+ 0 0 74 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.817 106.5 51.8 -62.2 -29.3 23.7 -2.3 6.0 90 90 A S H 3< S+ 0 0 39 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.610 96.4 91.2 -82.5 -8.0 24.2 -3.2 2.3 91 91 A L S << S- 0 0 5 -3,-1.4 2,-0.1 -4,-0.9 31,-0.0 -0.531 74.7-115.9 -94.1 164.1 27.9 -2.6 2.4 92 92 A D > - 0 0 55 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.224 43.7 -94.8 -77.8 168.0 30.9 -4.9 3.0 93 93 A A H > S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.868 121.2 48.6 -59.6 -39.3 33.1 -4.2 6.0 94 94 A V H > S+ 0 0 26 62,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.941 113.0 47.6 -66.2 -46.2 35.7 -2.1 4.2 95 95 A R H > S+ 0 0 25 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.866 104.9 59.7 -65.9 -32.1 33.2 0.0 2.6 96 96 A R H X S+ 0 0 79 -4,-2.4 4,-2.6 1,-0.3 -1,-0.2 0.930 103.0 54.2 -58.1 -40.6 31.3 0.5 5.9 97 97 A A H X S+ 0 0 7 -4,-1.7 4,-2.2 1,-0.2 -1,-0.3 0.892 103.7 54.6 -61.6 -38.4 34.4 2.0 7.3 98 98 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.896 109.2 47.5 -63.0 -37.5 34.6 4.5 4.4 99 99 A L H X S+ 0 0 1 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.921 109.0 53.6 -70.7 -35.8 31.1 5.7 5.2 100 100 A I H X S+ 0 0 8 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.939 106.4 54.7 -61.2 -41.7 31.9 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.947 108.0 48.1 -57.1 -49.1 34.9 8.2 7.9 102 102 A M H X S+ 0 0 3 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.914 112.6 47.9 -60.9 -42.4 32.7 10.6 6.0 103 103 A V H X S+ 0 0 9 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.916 109.9 51.8 -65.8 -37.4 30.2 10.8 8.8 104 104 A F H < S+ 0 0 32 -4,-3.2 -2,-0.2 -5,-0.2 -1,-0.2 0.956 116.3 43.4 -61.2 -40.8 33.0 11.4 11.4 105 105 A Q H < S+ 0 0 57 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.917 133.4 11.9 -68.9 -45.6 34.3 14.2 9.1 106 106 A M H X S- 0 0 55 -4,-3.1 4,-0.6 -5,-0.2 -3,-0.2 0.507 102.3-110.0-122.0 1.8 31.1 15.9 8.1 107 107 A G H X - 0 0 29 -4,-2.7 4,-2.9 -5,-0.3 5,-0.2 0.169 33.1 -81.6 81.7 155.5 28.3 14.7 10.2 108 108 A E H > S+ 0 0 60 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.892 125.9 53.0 -60.2 -42.0 25.3 12.7 9.5 109 109 A T H > S+ 0 0 121 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.930 108.7 48.0 -65.2 -48.2 23.4 15.4 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-0.6 1,-0.2 -2,-0.2 0.917 113.6 48.4 -63.1 -41.3 26.0 16.3 5.7 111 111 A V H >< S+ 0 0 1 -4,-2.9 3,-2.4 1,-0.2 -2,-0.2 0.908 104.5 57.7 -66.4 -40.0 26.5 12.7 4.5 112 112 A A H 3< S+ 0 0 15 -4,-3.0 -1,-0.2 1,-0.3 3,-0.2 0.725 94.3 70.7 -61.5 -18.2 22.7 12.0 4.1 113 113 A G T << S+ 0 0 56 -4,-0.9 2,-1.1 -3,-0.6 -1,-0.3 0.652 75.7 85.1 -72.4 -11.2 22.8 15.0 1.7 114 114 A F <> + 0 0 41 -3,-2.4 4,-2.8 1,-0.2 5,-0.3 -0.226 56.2 156.0 -88.7 49.7 24.8 12.8 -0.8 115 115 A T H > + 0 0 77 -2,-1.1 4,-2.0 1,-0.3 -1,-0.2 0.797 64.0 43.1 -40.5 -55.4 21.7 11.3 -2.1 116 116 A N H > S+ 0 0 75 -3,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.895 115.7 47.8 -69.4 -40.0 22.7 10.3 -5.5 117 117 A S H > S+ 0 0 0 -3,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.906 109.9 53.2 -69.1 -36.1 26.0 8.8 -4.4 118 118 A L H X S+ 0 0 10 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.906 108.5 50.9 -61.8 -41.5 24.4 6.9 -1.6 119 119 A R H X S+ 0 0 113 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.941 110.1 49.6 -60.3 -42.2 22.0 5.5 -4.0 120 120 A M H <>S+ 0 0 26 -4,-2.1 5,-2.7 1,-0.2 4,-0.3 0.869 110.2 49.9 -63.5 -41.6 24.8 4.4 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.5 3,-2.0 1,-0.2 -1,-0.2 0.946 107.6 53.9 -65.3 -42.8 26.6 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 89 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.907 110.1 47.9 -56.3 -38.3 23.5 0.9 -2.4 123 123 A Q T 3<5S- 0 0 97 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.483 115.1-118.8 -84.8 2.5 23.3 -0.4 -5.9 124 124 A K T < 5 + 0 0 103 -3,-2.0 2,-1.0 -4,-0.3 -3,-0.2 0.807 62.0 150.1 63.3 36.2 27.0 -1.3 -5.9 125 125 A R >< + 0 0 118 -5,-2.7 4,-2.9 1,-0.2 5,-0.2 -0.640 16.9 170.6 -96.1 68.2 27.8 1.0 -8.8 126 126 A W H > + 0 0 50 -2,-1.0 4,-2.1 1,-0.2 -1,-0.2 0.851 69.5 44.9 -50.6 -54.2 31.4 1.7 -7.5 127 127 A D H > S+ 0 0 100 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.911 116.5 46.6 -63.6 -40.7 32.8 3.6 -10.4 128 128 A E H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.880 111.1 50.9 -70.9 -36.2 29.8 5.7 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.9 4,-3.3 2,-0.2 -1,-0.2 0.903 107.8 55.0 -63.6 -40.1 29.6 6.5 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.929 109.2 45.5 -61.0 -44.7 33.2 7.5 -7.1 131 131 A V H X S+ 0 0 82 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.925 114.3 49.2 -67.5 -38.0 32.8 10.0 -9.9 132 132 A N H >< S+ 0 0 45 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.926 106.8 54.8 -65.0 -42.5 29.6 11.4 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.3 6,-0.4 1,-0.2 -1,-0.2 0.849 101.8 59.9 -60.4 -29.8 31.3 11.7 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.4 2,-2.0 -5,-0.2 -1,-0.2 0.691 84.1 80.4 -72.2 -18.7 34.1 13.8 -6.4 135 135 A K S << S+ 0 0 162 -3,-1.2 2,-0.4 -4,-0.6 -1,-0.2 -0.485 81.2 99.6 -85.5 68.2 31.6 16.4 -7.6 136 136 A S S > S- 0 0 14 -2,-2.0 4,-2.3 1,-0.1 5,-0.2 -0.997 83.8-120.4-154.4 156.3 31.5 18.0 -4.1 137 137 A R H > S+ 0 0 146 -2,-0.4 4,-3.1 1,-0.2 5,-0.3 0.906 114.5 63.1 -59.0 -40.2 32.8 20.8 -2.1 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.6 2,-0.2 8,-0.2 0.932 106.3 44.4 -45.7 -53.7 34.2 18.0 0.2 139 139 A Y H 4 S+ 0 0 61 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.906 114.5 47.6 -63.4 -45.6 36.4 16.7 -2.6 140 140 A N H < S+ 0 0 108 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.850 115.7 45.2 -67.9 -30.1 37.6 20.2 -3.7 141 141 A Q H < S+ 0 0 102 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.865 132.1 15.8 -84.1 -35.9 38.4 21.3 -0.1 142 142 A T S X S+ 0 0 24 -4,-2.6 4,-2.9 -5,-0.3 -1,-0.2 -0.594 73.9 162.2-137.0 72.5 40.2 18.2 1.1 143 143 A P H > S+ 0 0 47 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.872 70.5 52.6 -62.2 -42.3 41.1 16.3 -2.0 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.965 116.5 39.9 -63.8 -44.6 43.8 14.0 -0.7 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.956 115.9 51.4 -64.0 -49.1 41.6 12.8 2.1 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-3.1 1,-0.3 5,-0.3 0.908 108.2 53.2 -55.2 -45.0 38.6 12.6 -0.2 147 147 A K H X S+ 0 0 86 -4,-3.1 4,-2.3 1,-0.2 -1,-0.3 0.874 106.7 51.5 -58.7 -39.3 40.6 10.6 -2.7 148 148 A R H X S+ 0 0 54 -4,-1.7 4,-1.4 -3,-0.3 -1,-0.2 0.940 114.2 43.3 -67.7 -38.7 41.5 8.0 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.924 113.3 50.5 -69.6 -44.3 37.9 7.6 1.0 150 150 A I H X S+ 0 0 14 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.892 109.8 51.4 -57.7 -41.9 36.6 7.5 -2.5 151 151 A T H X S+ 0 0 40 -4,-2.3 4,-2.5 -5,-0.3 6,-0.4 0.846 106.9 53.7 -65.7 -34.8 39.2 4.9 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.908 111.2 45.3 -67.9 -40.6 38.2 2.8 -0.6 153 153 A F H < S+ 0 0 2 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 114.3 51.0 -66.4 -36.9 34.5 2.9 -1.8 154 154 A R H < S+ 0 0 104 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.943 124.1 23.5 -63.4 -47.1 35.7 2.2 -5.3 155 155 A T H < S- 0 0 42 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.577 84.8-135.0 -95.8 -24.3 37.8 -0.8 -4.5 156 156 A G S < S+ 0 0 16 -4,-2.5 2,-0.2 1,-0.2 -62,-0.2 0.671 75.1 101.8 70.1 15.3 36.5 -2.2 -1.4 157 157 A T S S- 0 0 44 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.2 -0.766 79.1-122.3-123.8 171.9 40.3 -2.6 -0.2 158 158 A W S >> S+ 0 0 42 -2,-0.2 3,-2.0 1,-0.2 4,-0.8 0.085 70.9 122.2 -96.8 18.1 42.5 -0.5 2.1 159 159 A D G >4 + 0 0 91 1,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.802 65.8 62.5 -52.8 -30.8 45.1 0.1 -0.6 160 160 A A G 34 S+ 0 0 27 -3,-0.3 -1,-0.3 1,-0.3 4,-0.1 0.639 110.7 40.4 -67.8 -17.5 44.8 3.9 -0.3 161 161 A Y G X4 S+ 0 0 3 -3,-2.0 3,-0.5 -13,-0.1 2,-0.4 0.507 85.1 106.8-109.5 -10.1 45.9 3.7 3.2 162 162 A K T << S+ 0 0 109 -4,-0.8 0, 0.0 -3,-0.6 0, 0.0 -0.696 86.6 28.2 -78.4 128.3 48.7 1.1 2.8 163 163 A N T 3 0 0 180 -2,-0.4 -1,-0.2 0, 0.0 -2,-0.1 -0.451 360.0 360.0 116.9 -45.3 52.1 3.0 3.2 164 164 A L < 0 0 123 -3,-0.5 -2,-0.1 -4,-0.1 -3,-0.0 0.517 360.0 360.0 -55.7 360.0 50.6 5.9 5.5