==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 19-APR-95 183L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR A.MORTON,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8727.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 74.7 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 . 16 9.9 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 1 1 0 1 2 0 0 1 1 0 0 0 0 1 0 0 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 77 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 150.8 43.4 -1.9 9.1 2 2 A N > - 0 0 65 1,-0.1 4,-3.0 156,-0.0 5,-0.3 -0.953 360.0 -87.1-153.6 176.0 40.3 -0.6 10.8 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.893 123.6 49.7 -55.0 -44.4 38.0 2.4 11.3 4 4 A F H > S+ 0 0 76 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.932 115.6 41.2 -64.2 -42.2 40.1 3.7 14.2 5 5 A E H > S+ 0 0 96 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.860 114.2 54.4 -72.2 -35.7 43.3 3.4 12.4 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.938 112.8 40.8 -66.1 -47.8 41.8 4.7 9.3 7 7 A L H X S+ 0 0 0 -4,-3.0 4,-2.9 -5,-0.3 5,-0.4 0.894 108.7 60.7 -69.7 -34.1 40.5 7.8 10.9 8 8 A R H X S+ 0 0 95 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.874 108.3 45.3 -59.9 -34.9 43.6 8.3 12.9 9 9 A I H < S+ 0 0 86 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.896 116.4 44.3 -71.5 -44.1 45.5 8.6 9.6 10 10 A D H < S+ 0 0 21 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.854 125.8 31.6 -69.2 -33.8 43.0 10.9 8.1 11 11 A E H < S- 0 0 42 -4,-2.9 19,-0.3 -5,-0.2 -3,-0.2 0.772 91.2-155.3 -95.8 -30.5 42.6 13.1 11.1 12 12 A G < - 0 0 24 -4,-1.9 2,-0.4 -5,-0.4 -1,-0.1 -0.209 25.3 -87.0 77.9-177.1 46.0 13.0 12.8 13 13 A L + 0 0 38 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.953 42.4 171.1-140.5 120.7 46.5 13.7 16.6 14 14 A R E -A 28 0A 140 14,-1.8 14,-2.3 -2,-0.4 4,-0.1 -0.989 19.0-163.7-131.2 132.1 47.0 17.1 18.3 15 15 A L E S+ 0 0 60 -2,-0.4 43,-2.0 12,-0.2 2,-0.4 0.379 74.1 62.7 -94.1 -1.7 46.9 17.7 22.0 16 16 A K E S-C 57 0B 90 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.959 100.4 -87.1-126.7 143.2 46.5 21.4 21.9 17 17 A I E + 0 0 15 39,-1.7 2,-0.3 -2,-0.4 10,-0.2 -0.129 59.1 167.4 -45.1 135.4 43.4 23.3 20.5 18 18 A Y E -A 26 0A 28 8,-3.6 8,-3.0 -4,-0.1 2,-0.5 -0.913 36.3 -98.1-141.8-180.0 43.9 23.9 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.819 33.6-138.4-106.8 132.8 41.9 24.9 13.7 20 20 A D > - 0 0 47 4,-3.2 3,-2.0 -2,-0.5 -1,-0.1 -0.059 40.2 -82.6 -72.9-172.9 40.6 22.4 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.612 135.4 46.4 -66.7 -14.1 40.6 22.6 7.5 22 22 A E T 3 S- 0 0 80 2,-0.2 -1,-0.3 0, 0.0 -2,-0.0 0.370 124.6-105.0-105.7 -1.3 37.5 24.8 7.8 23 23 A G S < S+ 0 0 35 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.609 72.8 141.1 87.2 17.9 39.0 27.0 10.5 24 24 A Y - 0 0 74 1,-0.1 -4,-3.2 9,-0.0 2,-0.3 -0.720 61.1-100.2 -97.0 143.6 37.0 25.5 13.4 25 25 A Y E +AB 19 34A 37 9,-0.9 8,-3.0 11,-0.5 9,-1.5 -0.481 56.0 159.8 -66.0 124.7 38.5 24.9 16.8 26 26 A T E -AB 18 32A 2 -8,-3.0 -8,-3.6 -2,-0.3 2,-0.3 -0.803 17.9-174.0-136.0 168.5 39.3 21.3 17.2 27 27 A I E > + B 0 31A 0 4,-1.3 4,-1.8 -2,-0.3 -12,-0.2 -0.941 51.6 11.0-157.0 166.7 41.5 19.1 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.8 -2,-0.3 2,-0.9 -0.411 123.0 -10.5 69.5-132.6 42.6 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 -0.655 126.7 -51.8-102.6 73.2 41.7 13.2 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.723 82.9 159.3 69.9 21.6 39.4 15.4 14.8 31 31 A H E < -B 27 0A 32 -4,-1.8 -4,-1.3 1,-0.0 2,-0.2 -0.645 33.0-144.5 -84.4 107.5 37.1 16.3 17.6 32 32 A L E -B 26 0A 69 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.460 18.4-177.3 -66.8 127.6 35.3 19.5 16.6 33 33 A L E - 0 0 13 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.844 57.6 -23.6 -94.9 -38.1 34.8 21.6 19.6 34 34 A T E -B 25 0A 29 -9,-1.5 -9,-0.9 1,-0.1 -1,-0.4 -0.927 33.5-139.3-171.4 152.3 32.9 24.5 18.1 35 35 A K S S+ 0 0 135 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.607 74.4 104.8 -88.5 -19.2 32.1 26.5 15.1 36 36 A S S S- 0 0 44 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.305 75.8-128.7 -68.8 150.1 32.2 29.8 16.9 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.554 76.6 106.5 -74.3 -10.8 35.2 32.0 16.4 38 38 A S > - 0 0 54 1,-0.2 4,-1.8 -13,-0.0 -2,-0.1 -0.618 53.8-162.3 -79.0 116.6 35.8 32.4 20.2 39 39 A L H > S+ 0 0 68 -2,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.716 95.3 56.4 -66.4 -23.3 38.8 30.5 21.6 40 40 A N H > S+ 0 0 116 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.893 104.3 49.5 -77.3 -38.8 37.3 30.9 24.9 41 41 A A H > S+ 0 0 33 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.849 113.3 49.7 -60.9 -39.3 34.1 29.3 23.9 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.913 109.6 49.0 -68.6 -42.9 36.3 26.6 22.5 43 43 A K H X S+ 0 0 53 -4,-2.7 4,-1.9 2,-0.2 11,-0.3 0.866 111.9 49.5 -67.3 -30.9 38.3 26.3 25.7 44 44 A S H X S+ 0 0 71 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.919 110.7 49.5 -71.0 -41.3 35.0 26.1 27.7 45 45 A E H X S+ 0 0 65 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.957 109.8 54.2 -60.5 -48.4 33.6 23.4 25.4 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.3 0.927 109.5 44.5 -51.3 -49.3 36.9 21.6 25.9 47 47 A D H X>S+ 0 0 39 -4,-1.9 4,-2.1 1,-0.2 5,-1.1 0.880 111.6 53.5 -67.0 -36.9 36.6 21.6 29.7 48 48 A K H <5S+ 0 0 139 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.908 111.5 45.8 -63.1 -40.3 33.1 20.5 29.5 49 49 A A H <5S+ 0 0 46 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.930 120.4 37.8 -68.9 -43.0 34.0 17.5 27.3 50 50 A I H <5S- 0 0 33 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.692 103.1-126.7 -80.6 -27.3 37.0 16.4 29.4 51 51 A G T <5S+ 0 0 67 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.2 0.796 76.3 72.4 81.4 29.1 35.5 17.2 32.7 52 52 A R S - 0 0 8 -2,-1.1 3,-1.0 -11,-0.3 -1,-0.2 0.686 34.1-142.0 -88.8 -30.1 42.3 21.8 30.7 55 55 A N T 3 S- 0 0 117 1,-0.2 3,-0.1 -12,-0.2 -2,-0.1 0.762 71.3 -56.9 69.0 24.3 43.5 25.1 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.2 2,-0.4 0.546 120.2 97.5 85.3 5.7 43.3 24.1 26.1 57 57 A V B < +C 16 0B 69 -3,-1.0 2,-0.3 -41,-0.2 -1,-0.2 -0.986 46.3 177.3-130.7 137.7 45.6 21.1 26.5 58 58 A I - 0 0 6 -43,-2.0 2,-0.2 -2,-0.4 -30,-0.1 -0.851 28.2-104.6-131.7 170.2 44.7 17.4 27.0 59 59 A T > - 0 0 63 -2,-0.3 4,-3.0 1,-0.1 5,-0.2 -0.477 32.0-109.4 -92.2 167.0 46.6 14.1 27.3 60 60 A K H > S+ 0 0 105 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.915 121.7 52.4 -55.0 -45.2 46.9 11.4 24.8 61 61 A D H > S+ 0 0 123 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.858 109.3 48.5 -57.8 -45.3 44.6 9.2 26.9 62 62 A E H > S+ 0 0 36 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.922 109.7 52.5 -65.0 -44.3 42.0 12.0 27.0 63 63 A A H X S+ 0 0 1 -4,-3.0 4,-1.9 1,-0.2 -34,-0.4 0.891 110.9 47.8 -56.0 -45.5 42.3 12.4 23.2 64 64 A E H X S+ 0 0 73 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.818 106.7 56.3 -68.8 -28.0 41.7 8.8 22.7 65 65 A K H X S+ 0 0 133 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.962 108.7 46.8 -69.5 -43.7 38.8 8.8 25.0 66 66 A L H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.866 109.3 56.2 -58.4 -39.2 37.1 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.962 107.4 47.6 -61.5 -52.0 37.9 9.5 19.7 68 68 A N H X S+ 0 0 87 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.917 112.4 49.9 -52.7 -44.5 36.1 6.4 21.0 69 69 A Q H X S+ 0 0 95 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.900 112.7 46.5 -67.0 -37.9 33.2 8.4 22.0 70 70 A D H X S+ 0 0 36 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.840 110.6 52.1 -71.1 -34.0 33.1 10.0 18.6 71 71 A V H X S+ 0 0 7 -4,-2.8 4,-1.9 2,-0.2 3,-0.3 0.983 112.9 45.4 -66.5 -48.2 33.5 6.7 16.8 72 72 A D H X S+ 0 0 83 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.924 110.3 54.0 -55.0 -49.6 30.6 5.2 18.7 73 73 A A H X S+ 0 0 42 -4,-2.1 4,-2.7 -5,-0.3 -1,-0.2 0.878 107.3 51.5 -55.5 -41.2 28.4 8.3 18.2 74 74 A A H X S+ 0 0 9 -4,-1.6 4,-2.5 -3,-0.3 -1,-0.2 0.952 111.8 43.9 -63.9 -48.9 28.8 8.2 14.5 75 75 A V H X S+ 0 0 35 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.952 114.1 50.9 -60.4 -52.5 27.9 4.6 14.0 76 76 A R H X S+ 0 0 112 -4,-2.9 4,-1.0 -5,-0.2 -1,-0.2 0.928 110.1 51.3 -54.8 -40.1 25.0 5.0 16.4 77 77 A G H >X S+ 0 0 0 -4,-2.7 4,-0.7 -5,-0.3 3,-0.6 0.915 108.6 49.4 -60.7 -48.4 24.0 8.1 14.3 78 78 A I H >< S+ 0 0 4 -4,-2.5 3,-1.0 1,-0.2 7,-0.5 0.940 109.5 54.4 -54.4 -46.5 24.1 6.2 11.0 79 79 A L H 3< S+ 0 0 66 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.717 110.2 45.1 -64.6 -22.0 22.0 3.5 12.6 80 80 A R H << S+ 0 0 174 -4,-1.0 2,-0.7 -3,-0.6 -1,-0.3 0.417 92.4 95.6 -97.3 -10.2 19.3 5.9 13.7 81 81 A N > S+ 0 0 13 -6,-0.2 4,-2.7 -7,-0.2 3,-0.6 0.859 101.9 67.9 -97.6 -44.1 21.4 6.1 6.2 85 85 A K H 3X S+ 0 0 84 -4,-3.3 4,-2.5 -7,-0.5 5,-0.2 0.867 99.0 50.9 -47.6 -50.2 20.8 2.9 7.9 86 86 A P H 3> S+ 0 0 57 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.868 112.4 46.8 -63.9 -34.7 19.6 1.0 5.0 87 87 A V H X> S+ 0 0 8 -3,-0.6 4,-0.8 -4,-0.3 3,-0.7 0.962 112.8 48.7 -70.0 -45.5 22.5 2.0 2.9 88 88 A Y H >< S+ 0 0 26 -4,-2.7 3,-0.7 1,-0.3 -1,-0.2 0.867 107.4 55.6 -59.6 -38.4 25.0 1.2 5.5 89 89 A D H 3< S+ 0 0 72 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.810 102.8 56.9 -68.4 -28.2 23.4 -2.2 6.2 90 90 A S H << S+ 0 0 41 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.675 93.9 92.0 -72.8 -21.5 23.8 -3.1 2.5 91 91 A L S << S- 0 0 8 -4,-0.8 2,-0.1 -3,-0.7 31,-0.0 -0.388 75.6-119.0 -79.8 158.0 27.5 -2.6 2.6 92 92 A D > - 0 0 54 -2,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.300 43.7 -92.7 -82.1 168.2 30.4 -5.0 3.3 93 93 A A H > S+ 0 0 79 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.855 121.4 50.7 -59.1 -38.0 32.7 -4.3 6.3 94 94 A V H > S+ 0 0 29 1,-0.2 4,-1.6 62,-0.2 3,-0.5 0.968 111.6 46.9 -66.7 -49.4 35.3 -2.3 4.5 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.849 105.0 60.6 -62.1 -32.6 32.9 0.1 2.8 96 96 A R H X S+ 0 0 78 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.891 101.3 55.3 -57.9 -39.7 31.1 0.6 6.2 97 97 A A H X S+ 0 0 6 -4,-1.5 4,-2.1 -3,-0.5 3,-0.3 0.926 106.9 50.4 -58.3 -43.7 34.3 2.0 7.5 98 98 A A H X S+ 0 0 0 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.863 107.8 52.2 -60.8 -41.1 34.3 4.4 4.6 99 99 A A H X S+ 0 0 19 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.821 109.5 49.7 -64.8 -32.4 30.8 5.5 5.4 100 100 A I H X S+ 0 0 9 -4,-1.8 4,-3.2 -3,-0.3 5,-0.2 0.903 105.5 57.1 -74.0 -38.9 31.7 6.2 9.1 101 101 A N H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.946 107.8 48.5 -53.3 -48.3 34.7 8.2 8.0 102 102 A M H X S+ 0 0 10 -4,-1.7 4,-2.5 1,-0.2 5,-0.3 0.923 113.7 44.7 -59.4 -50.1 32.4 10.5 6.0 103 103 A V H X S+ 0 0 11 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.856 111.9 53.9 -62.8 -37.6 29.9 11.0 8.8 104 104 A F H < S+ 0 0 31 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.923 115.5 39.9 -63.0 -41.9 32.7 11.5 11.3 105 105 A Q H < S+ 0 0 53 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.834 134.3 15.4 -76.8 -40.7 34.1 14.2 9.1 106 106 A M H X S- 0 0 42 -4,-2.5 4,-0.7 -5,-0.2 -3,-0.2 0.447 98.2-122.1-119.5 1.3 31.0 15.9 8.0 107 107 A G H X - 0 0 30 -4,-2.7 4,-1.9 -5,-0.3 3,-0.4 0.145 38.7 -73.7 77.7 161.9 28.1 14.9 10.2 108 108 A E H 4 S+ 0 0 72 1,-0.3 -1,-0.2 2,-0.2 -4,-0.1 0.821 135.8 51.0 -58.1 -38.1 24.8 13.2 9.3 109 109 A T H >4 S+ 0 0 129 2,-0.2 3,-0.5 1,-0.2 4,-0.4 0.696 105.4 53.9 -73.1 -29.4 23.7 16.5 7.9 110 110 A G H >< S+ 0 0 29 -4,-0.7 3,-0.5 -3,-0.4 -2,-0.2 0.878 106.6 52.7 -74.7 -35.6 26.8 17.0 5.8 111 111 A V G >< S+ 0 0 9 -4,-1.9 3,-0.8 1,-0.2 -1,-0.2 0.340 87.1 92.3 -82.2 5.6 26.2 13.6 4.2 112 112 A A G X S+ 0 0 60 -3,-0.5 3,-0.9 1,-0.2 -1,-0.2 0.921 76.3 55.1 -65.9 -51.3 22.6 14.7 3.4 113 113 A G G < S+ 0 0 74 -3,-0.5 3,-0.3 -4,-0.4 -1,-0.2 0.300 87.7 86.8 -70.9 10.7 23.2 16.1 -0.2 114 114 A F G X> + 0 0 22 -3,-0.8 4,-2.7 1,-0.2 3,-0.7 0.202 48.5 122.8 -96.7 14.6 24.7 12.8 -1.1 115 115 A T H <> S+ 0 0 82 -3,-0.9 4,-2.2 1,-0.3 -1,-0.2 0.834 73.5 48.0 -43.0 -49.4 21.4 11.2 -2.0 116 116 A N H 3> S+ 0 0 86 -3,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.886 113.3 47.3 -67.4 -33.5 22.3 10.3 -5.5 117 117 A S H <> S+ 0 0 3 -3,-0.7 4,-2.5 2,-0.2 5,-0.2 0.902 109.8 55.4 -71.1 -37.8 25.6 8.8 -4.4 118 118 A L H X S+ 0 0 30 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.932 107.0 49.6 -56.0 -49.2 23.8 6.9 -1.6 119 119 A R H X S+ 0 0 125 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.917 110.6 48.8 -61.4 -41.1 21.5 5.4 -4.1 120 120 A M H <>S+ 0 0 31 -4,-1.5 5,-2.3 1,-0.2 4,-0.4 0.861 111.5 50.7 -66.7 -36.3 24.3 4.3 -6.3 121 121 A L H ><5S+ 0 0 6 -4,-2.5 3,-2.2 2,-0.2 -1,-0.2 0.952 108.5 50.4 -64.8 -48.1 26.2 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 96 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.898 108.8 53.4 -55.6 -35.9 23.1 0.9 -2.3 123 123 A Q T 3<5S- 0 0 91 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.537 113.1-123.2 -77.4 -5.0 22.8 -0.4 -5.9 124 124 A K T < 5 + 0 0 95 -3,-2.2 2,-1.6 -4,-0.4 -3,-0.2 0.705 62.0 146.6 68.0 24.7 26.5 -1.6 -5.7 125 125 A R >< + 0 0 104 -5,-2.3 4,-2.3 1,-0.2 5,-0.2 -0.614 20.4 172.6 -91.6 78.8 27.4 0.5 -8.7 126 126 A W H > + 0 0 50 -2,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.870 67.5 45.6 -55.8 -53.7 30.9 1.3 -7.5 127 127 A D H > S+ 0 0 111 1,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.956 115.6 47.5 -63.1 -43.8 32.5 3.0 -10.3 128 128 A E H > S+ 0 0 109 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.899 112.1 49.7 -62.7 -39.6 29.6 5.3 -10.9 129 129 A A H X S+ 0 0 1 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.909 106.5 57.0 -64.5 -38.8 29.3 6.1 -7.3 130 130 A A H X S+ 0 0 11 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.931 109.7 45.4 -58.1 -43.5 33.0 6.9 -7.2 131 131 A V H X S+ 0 0 92 -4,-2.2 4,-0.6 1,-0.2 3,-0.4 0.926 112.4 49.4 -66.6 -48.0 32.5 9.4 -9.9 132 132 A N H >< S+ 0 0 38 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.851 106.0 56.5 -60.9 -36.1 29.4 10.9 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.8 6,-0.4 1,-0.2 -1,-0.2 0.885 100.4 60.1 -65.6 -30.2 31.1 11.3 -4.9 134 134 A A H 3< S+ 0 0 26 -4,-1.2 2,-1.8 -3,-0.4 -1,-0.2 0.638 86.0 79.0 -71.9 -18.6 33.9 13.4 -6.5 135 135 A K S << S+ 0 0 160 -3,-0.8 2,-0.3 -4,-0.6 -1,-0.2 -0.542 81.1 95.6 -88.1 67.5 31.5 16.0 -7.7 136 136 A S S > S- 0 0 17 -2,-1.8 4,-1.8 1,-0.1 5,-0.2 -0.987 85.0-113.1-153.0 161.8 31.2 17.6 -4.5 137 137 A R H > S+ 0 0 144 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.915 115.7 60.2 -59.6 -44.0 32.5 20.4 -2.3 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.8 2,-0.2 8,-0.2 0.929 105.8 46.4 -45.8 -53.3 34.0 17.8 0.0 139 139 A Y H 4 S+ 0 0 54 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.907 113.8 48.1 -60.7 -45.4 36.2 16.5 -2.8 140 140 A N H < S+ 0 0 111 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.892 117.0 42.2 -65.5 -37.7 37.3 19.9 -3.9 141 141 A Q H < S+ 0 0 101 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.904 130.5 20.8 -76.4 -46.7 38.2 21.0 -0.5 142 142 A T S X S+ 0 0 22 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 -0.655 73.7 162.2-126.1 72.4 39.9 17.9 0.9 143 143 A P H > + 0 0 48 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.831 67.4 51.0 -62.1 -43.8 40.9 16.1 -2.2 144 144 A N H > S+ 0 0 116 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.939 115.8 41.6 -66.0 -42.6 43.6 13.7 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.946 113.7 53.5 -66.0 -47.3 41.4 12.4 1.9 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.907 105.7 54.0 -56.6 -40.9 38.4 12.3 -0.4 147 147 A K H X S+ 0 0 100 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.914 108.1 50.6 -61.4 -39.1 40.4 10.2 -2.9 148 148 A R H X S+ 0 0 66 -4,-1.7 4,-1.9 2,-0.2 12,-0.2 0.909 112.4 44.3 -61.2 -47.7 41.2 7.7 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.920 115.0 50.7 -66.9 -38.1 37.6 7.3 1.0 150 150 A I H X S+ 0 0 15 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.908 108.7 50.0 -64.6 -47.5 36.4 7.1 -2.6 151 151 A T H X S+ 0 0 35 -4,-3.0 4,-2.7 1,-0.2 6,-0.4 0.906 108.3 55.4 -59.9 -37.6 39.0 4.4 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.925 111.6 41.8 -63.0 -39.4 37.8 2.6 -0.5 153 153 A F H < S+ 0 0 5 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.935 115.9 50.1 -72.7 -41.2 34.2 2.6 -1.7 154 154 A R H < S+ 0 0 98 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.919 125.4 25.0 -57.3 -50.8 35.1 1.9 -5.3 155 155 A T H < S- 0 0 43 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.606 85.4-137.4 -93.1 -22.5 37.4 -1.1 -4.4 156 156 A G S < S+ 0 0 16 -4,-2.1 2,-0.2 -5,-0.4 -62,-0.2 0.757 72.7 102.2 66.5 17.8 36.1 -2.4 -1.2 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.1 -1,-0.2 -0.773 79.9-119.6-126.5 175.5 39.8 -2.8 -0.1 158 158 A W S >> S+ 0 0 43 -2,-0.2 3,-1.8 1,-0.2 4,-0.5 0.211 72.5 120.3 -98.7 15.8 42.2 -0.8 2.2 159 159 A D G >4 + 0 0 90 1,-0.3 3,-1.6 2,-0.2 -1,-0.2 0.809 67.6 57.4 -47.1 -45.7 44.7 -0.1 -0.6 160 160 A A G 34 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.743 109.6 48.3 -59.2 -25.7 44.4 3.7 -0.4 161 161 A Y G <4 0 0 20 -3,-1.8 -1,-0.3 -13,-0.1 -2,-0.2 0.531 360.0 360.0 -94.6 -2.0 45.4 3.4 3.2 162 162 A K << 0 0 177 -3,-1.6 -2,-0.2 -4,-0.5 -3,-0.1 0.875 360.0 360.0-103.2 360.0 48.4 1.1 2.6