==== 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) 12-NOV-91 1L80 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.H.HURLEY,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8584.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 69.8 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 . 5 3.1 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 . 82 50.6 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 2 1 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 74 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 146.5 43.5 -1.8 9.1 2 2 A N > - 0 0 68 156,-0.0 4,-2.5 95,-0.0 5,-0.2 -0.901 360.0 -80.8-148.3 177.2 40.2 -0.8 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.827 124.9 52.2 -54.2 -41.6 38.1 2.3 11.3 4 4 A F H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.927 112.6 42.3 -61.4 -51.5 40.2 3.6 14.1 5 5 A E H > S+ 0 0 93 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.849 114.8 53.8 -64.7 -35.6 43.5 3.4 12.3 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 3,-0.3 0.965 112.5 40.5 -66.7 -52.3 41.9 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.842 110.1 59.3 -65.2 -33.4 40.5 7.8 10.9 8 8 A R H X S+ 0 0 104 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.865 108.5 46.3 -62.4 -32.9 43.8 8.3 12.9 9 9 A I H < S+ 0 0 86 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.923 116.3 45.3 -71.8 -43.5 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 0.836 124.7 29.7 -67.8 -37.8 43.0 11.0 8.1 11 11 A E H < S- 0 0 42 -4,-2.5 19,-0.4 -5,-0.2 -1,-0.2 0.661 90.0-152.0 -97.7 -25.8 42.7 13.2 11.1 12 12 A G < - 0 0 24 -4,-1.5 2,-0.4 -5,-0.3 -1,-0.1 -0.086 25.1 -92.1 72.0-174.2 46.2 13.1 12.8 13 13 A L + 0 0 37 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.980 40.0 176.0-139.3 127.1 46.5 13.7 16.5 14 14 A R E -A 28 0A 141 14,-1.8 14,-2.5 -2,-0.4 4,-0.1 -0.998 18.3-162.3-134.5 133.1 47.1 17.0 18.2 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.1 12,-0.2 2,-0.4 0.464 75.3 63.0 -92.9 -4.6 47.2 17.6 21.9 16 16 A K E S-C 57 0B 99 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.936 101.1 -88.2-121.2 141.2 46.8 21.4 21.8 17 17 A I E + 0 0 18 39,-1.7 2,-0.3 -2,-0.4 10,-0.2 -0.160 58.3 170.0 -44.0 135.0 43.7 23.2 20.4 18 18 A Y E -A 26 0A 27 8,-3.2 8,-2.9 -4,-0.1 2,-0.5 -0.901 35.5-103.1-142.5 172.9 44.1 23.8 16.7 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.851 34.3-138.9-103.4 138.0 42.1 25.0 13.8 20 20 A D > - 0 0 51 4,-2.9 3,-1.4 -2,-0.5 -1,-0.1 -0.028 40.8 -78.3 -78.8-169.0 40.8 22.5 11.3 21 21 A T T 3 S+ 0 0 107 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.754 134.4 47.1 -64.2 -24.6 40.7 22.7 7.6 22 22 A E T 3 S- 0 0 78 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.444 125.0-101.8 -94.7 -1.9 37.6 25.0 7.8 23 23 A G S < S+ 0 0 36 -3,-1.4 2,-0.3 1,-0.3 -2,-0.1 0.532 74.6 143.6 92.8 13.2 39.2 27.1 10.5 24 24 A Y - 0 0 78 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.3 -0.632 58.4-102.7 -91.0 146.2 37.3 25.6 13.4 25 25 A Y E +AB 19 34A 34 9,-0.7 8,-3.0 11,-0.4 9,-1.2 -0.435 54.8 160.2 -66.4 123.6 38.7 24.9 16.8 26 26 A T E -AB 18 32A 4 -8,-2.9 -8,-3.2 6,-0.3 2,-0.3 -0.907 19.8-168.3-137.8 168.5 39.5 21.3 17.2 27 27 A I E > + B 0 31A 0 4,-1.5 4,-1.9 -2,-0.3 2,-0.2 -0.974 51.7 0.2-155.4 161.0 41.7 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.8 -2,-0.3 2,-0.8 -0.372 121.3 -4.3 69.1-132.8 42.9 15.4 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.674 127.6 -53.1 -99.3 70.2 41.9 13.1 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.8 2,-1.0 -19,-0.4 -2,-0.2 0.756 84.0 160.2 70.1 24.5 39.5 15.3 14.7 31 31 A H E < -B 27 0A 32 -4,-1.9 -4,-1.5 32,-0.0 -1,-0.2 -0.676 33.0-143.9 -83.1 101.8 37.3 16.3 17.7 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.418 18.6-176.5 -64.4 130.4 35.5 19.5 16.7 33 33 A L E - 0 0 15 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.889 56.6 -26.6 -95.2 -47.6 35.1 21.7 19.7 34 34 A T E -B 25 0A 27 -9,-1.2 -9,-0.7 2,-0.1 -1,-0.4 -0.976 35.7-136.8-162.4 155.4 33.1 24.7 18.4 35 35 A K S S+ 0 0 136 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.399 74.9 108.4 -96.3 -1.5 32.3 26.6 15.3 36 36 A S S S- 0 0 42 2,-0.1 -11,-0.4 1,-0.1 -2,-0.1 -0.421 73.5-131.3 -74.3 157.5 32.6 29.9 17.2 37 37 A P S S+ 0 0 116 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.660 75.5 105.7 -81.7 -15.3 35.6 32.1 16.5 38 38 A S > - 0 0 50 1,-0.2 4,-1.7 2,-0.0 -2,-0.1 -0.540 56.7-159.0 -75.5 124.4 36.3 32.5 20.2 39 39 A L H > S+ 0 0 69 -2,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.684 98.1 55.4 -69.1 -19.5 39.2 30.6 21.6 40 40 A N H > S+ 0 0 122 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.885 102.4 51.9 -83.8 -34.4 37.6 31.0 24.9 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.887 112.0 50.7 -61.8 -35.1 34.4 29.4 23.8 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.924 108.8 48.3 -68.7 -44.4 36.7 26.6 22.6 43 43 A K H X S+ 0 0 46 -4,-1.9 4,-2.5 2,-0.2 11,-0.3 0.885 111.2 52.8 -63.1 -38.4 38.6 26.2 25.9 44 44 A S H X S+ 0 0 73 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.931 110.9 44.6 -62.4 -48.9 35.2 26.2 27.7 45 45 A E H X S+ 0 0 68 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.902 112.4 53.7 -63.0 -42.1 33.8 23.3 25.5 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.946 109.4 46.9 -58.9 -47.3 37.1 21.5 25.9 47 47 A D H X>S+ 0 0 36 -4,-2.5 4,-2.1 1,-0.2 5,-1.1 0.892 112.9 51.0 -62.3 -38.1 37.0 21.6 29.7 48 48 A K H <5S+ 0 0 140 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.896 110.9 46.8 -65.9 -39.1 33.4 20.5 29.6 49 49 A A H <5S+ 0 0 46 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 120.2 39.4 -71.7 -33.3 34.2 17.5 27.3 50 50 A I H <5S- 0 0 35 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.676 99.7-128.2 -87.3 -27.1 37.2 16.4 29.5 51 51 A G T <5S+ 0 0 70 -4,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.812 77.6 76.5 77.3 28.5 35.8 17.1 33.0 52 52 A R S - 0 0 10 -2,-0.9 3,-1.5 -11,-0.3 -1,-0.2 0.684 33.1-142.4 -96.9 -19.8 42.6 21.9 30.8 55 55 A N T 3 S- 0 0 117 1,-0.3 3,-0.1 -12,-0.1 -2,-0.1 0.837 75.7 -59.7 58.4 34.9 44.0 25.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.2 2,-0.4 0.557 116.8 101.4 73.8 10.5 43.7 24.0 26.1 57 57 A V B < +C 16 0B 63 -3,-1.5 2,-0.3 -41,-0.2 -41,-0.2 -0.989 43.8 178.5-130.3 135.6 45.9 21.0 26.4 58 58 A I - 0 0 4 -43,-2.1 2,-0.2 -2,-0.4 -30,-0.1 -0.801 26.8-109.5-127.3 168.8 45.0 17.3 26.9 59 59 A T > - 0 0 64 -2,-0.3 4,-2.5 1,-0.1 3,-0.3 -0.609 34.3-105.5 -95.2 162.2 46.9 14.0 27.2 60 60 A K H > S+ 0 0 106 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.891 122.1 52.6 -53.9 -42.7 47.1 11.2 24.6 61 61 A D H > S+ 0 0 125 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.878 108.7 49.1 -57.8 -47.9 44.7 9.1 26.7 62 62 A E H > S+ 0 0 38 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.922 112.1 49.8 -60.2 -42.2 42.1 12.0 26.9 63 63 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -34,-0.4 0.896 111.3 48.7 -62.6 -42.1 42.4 12.4 23.1 64 64 A E H X S+ 0 0 70 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.830 108.6 54.0 -68.8 -30.5 41.9 8.6 22.6 65 65 A K H X S+ 0 0 132 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.950 109.0 46.5 -70.6 -46.0 38.9 8.7 24.9 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.905 112.2 53.7 -57.7 -43.9 37.2 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-2.1 4,-2.6 1,-0.2 5,-0.3 0.934 106.0 49.8 -56.9 -51.1 38.0 9.6 19.8 68 68 A N H X S+ 0 0 89 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.872 113.2 49.7 -57.6 -38.1 36.4 6.3 21.0 69 69 A Q H X S+ 0 0 92 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.903 111.0 48.2 -66.2 -43.3 33.3 8.4 21.9 70 70 A D H X S+ 0 0 35 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.862 110.7 48.1 -68.7 -39.5 33.1 10.0 18.5 71 71 A V H X S+ 0 0 5 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.975 113.5 49.9 -66.8 -44.9 33.5 6.9 16.5 72 72 A D H X S+ 0 0 91 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.934 112.7 46.0 -54.6 -47.9 30.8 5.2 18.6 73 73 A A H X S+ 0 0 44 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.907 110.4 54.8 -62.8 -40.8 28.5 8.3 18.2 74 74 A A H X S+ 0 0 12 -4,-2.5 4,-2.0 2,-0.2 3,-0.2 0.971 112.2 42.9 -55.3 -55.4 29.2 8.3 14.3 75 75 A V H X S+ 0 0 32 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.943 114.5 50.3 -55.1 -52.2 28.2 4.6 14.0 76 76 A R H X S+ 0 0 114 -4,-2.6 4,-1.1 -5,-0.3 -1,-0.2 0.816 108.6 52.4 -57.8 -34.3 25.1 5.1 16.2 77 77 A G H X S+ 0 0 3 -4,-2.2 4,-1.1 -3,-0.2 3,-0.3 0.911 107.8 50.8 -69.4 -40.9 24.0 8.1 14.3 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 7,-0.6 0.952 110.5 50.1 -57.3 -46.6 24.2 6.2 11.0 79 79 A L H 3< S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.711 112.7 46.9 -68.9 -18.1 22.1 3.4 12.6 80 80 A R H 3< S+ 0 0 174 -4,-1.1 2,-0.5 -3,-0.3 -1,-0.3 0.569 93.0 91.7 -93.2 -19.6 19.5 5.9 13.8 81 81 A N > S+ 0 0 3 -6,-0.2 4,-2.5 -7,-0.2 3,-0.9 0.893 100.4 67.5 -86.3 -43.7 21.8 6.1 6.2 85 85 A K H 3X S+ 0 0 77 -4,-2.4 4,-3.0 -7,-0.6 5,-0.2 0.820 98.6 50.9 -47.8 -44.5 21.0 2.9 7.8 86 86 A P H 3> S+ 0 0 54 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.814 112.2 48.6 -68.3 -30.2 19.9 1.0 4.7 87 87 A V H <> S+ 0 0 2 -3,-0.9 4,-1.1 -4,-0.4 3,-0.4 0.954 112.0 47.8 -71.3 -52.8 23.1 2.0 2.9 88 88 A Y H >< S+ 0 0 33 -4,-2.5 3,-1.4 1,-0.2 -3,-0.2 0.951 110.5 52.7 -50.8 -49.5 25.2 0.9 5.8 89 89 A D H 3< S+ 0 0 75 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.806 106.9 53.9 -56.2 -36.3 23.4 -2.4 6.0 90 90 A S H 3< S+ 0 0 35 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.716 95.0 89.3 -74.8 -20.5 24.0 -3.0 2.4 91 91 A L S << S- 0 0 6 -3,-1.4 31,-0.0 -4,-1.1 2,-0.0 -0.402 73.6-119.1 -84.6 160.0 27.7 -2.6 2.5 92 92 A D > - 0 0 56 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.198 45.5 -90.1 -78.5 173.7 30.6 -5.0 3.1 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.870 123.1 46.4 -59.5 -40.2 33.0 -4.4 6.1 94 94 A V H > S+ 0 0 27 62,-0.2 4,-1.9 2,-0.2 3,-0.2 0.947 113.2 47.9 -67.9 -48.8 35.5 -2.2 4.3 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.870 105.7 60.2 -62.2 -34.6 33.0 0.0 2.7 96 96 A R H X S+ 0 0 79 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.918 103.5 50.7 -56.3 -44.8 31.2 0.4 6.0 97 97 A A H X S+ 0 0 7 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.934 107.4 54.8 -59.4 -41.9 34.4 1.9 7.4 98 98 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.872 108.9 47.3 -57.9 -36.8 34.4 4.3 4.4 99 99 A F H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.901 109.2 52.6 -73.8 -38.0 30.9 5.5 5.2 100 100 A I H X S+ 0 0 7 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.919 108.7 52.2 -58.9 -47.0 31.7 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.942 108.3 49.8 -54.2 -55.6 34.8 8.2 7.8 102 102 A L H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.923 114.8 44.2 -49.1 -53.2 32.6 10.3 5.6 103 103 A V H X S+ 0 0 10 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.866 110.1 55.6 -60.2 -43.4 30.0 10.8 8.6 104 104 A F H < S+ 0 0 31 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.920 115.2 40.8 -57.7 -39.4 32.8 11.4 11.2 105 105 A Q H < S+ 0 0 54 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.862 131.7 18.2 -78.1 -42.8 34.0 14.2 8.9 106 106 A M H X S- 0 0 54 -4,-2.5 4,-1.3 -5,-0.2 5,-0.3 0.449 101.2-112.7-121.8 9.1 31.0 15.8 7.8 107 107 A G H X - 0 0 31 -4,-2.7 4,-1.7 2,-0.2 5,-0.1 0.248 33.6 -87.9 75.1 146.5 28.1 14.9 10.1 108 108 A E H 4 S+ 0 0 63 1,-0.2 -1,-0.1 2,-0.1 -4,-0.1 0.732 129.4 57.8 -44.0 -36.2 25.0 12.8 9.4 109 109 A T H >4 S+ 0 0 70 2,-0.1 3,-1.3 -6,-0.1 -1,-0.2 0.912 101.7 39.6 -60.3 -76.1 23.9 16.2 8.4 110 110 A G H >< S+ 0 0 49 -4,-1.3 3,-1.3 1,-0.3 -3,-0.2 0.882 109.9 59.8 -61.7 -37.3 26.1 17.6 5.7 111 111 A I G >< S+ 0 0 1 -4,-1.7 3,-3.2 -5,-0.3 -1,-0.3 0.565 76.2 114.2 -65.6 -3.4 26.4 14.3 3.9 112 112 A A G < S+ 0 0 59 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.740 75.6 43.9 -35.7 -33.2 22.6 14.8 3.8 113 113 A G G < + 0 0 53 -3,-1.3 3,-0.5 1,-0.2 -1,-0.3 0.145 65.0 105.4-113.1 34.2 22.9 15.1 0.1 114 114 A F <> + 0 0 26 -3,-3.2 4,-3.3 1,-0.2 5,-0.2 -0.037 53.2 136.4 -85.2 34.2 25.1 12.5 -1.1 115 115 A T H > S+ 0 0 83 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.900 70.4 39.0 -42.4 -54.0 21.4 11.4 -2.0 116 116 A N H > S+ 0 0 88 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.874 117.2 48.8 -67.3 -41.5 22.5 10.3 -5.5 117 117 A S H > S+ 0 0 2 -4,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.856 109.8 54.4 -64.9 -36.0 25.8 8.8 -4.3 118 118 A L H X S+ 0 0 14 -4,-3.3 4,-2.6 2,-0.2 -2,-0.2 0.916 107.7 48.0 -67.0 -42.0 24.0 6.9 -1.6 119 119 A R H X S+ 0 0 118 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.873 112.1 51.7 -64.8 -35.3 21.6 5.3 -4.0 120 120 A M H <>S+ 0 0 25 -4,-1.9 5,-2.2 2,-0.2 4,-0.3 0.915 109.9 47.6 -68.0 -42.6 24.6 4.4 -6.2 121 121 A L H ><5S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.929 109.5 52.9 -63.7 -44.4 26.4 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 91 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.863 109.7 50.0 -58.6 -33.9 23.3 0.9 -2.3 123 123 A Q T 3<5S- 0 0 86 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.500 112.3-123.7 -82.8 -5.4 23.1 -0.4 -5.9 124 124 A K T < 5 + 0 0 96 -3,-1.7 2,-1.1 -4,-0.3 -3,-0.2 0.830 60.9 146.6 66.5 34.3 26.7 -1.4 -5.8 125 125 A R >< + 0 0 113 -5,-2.2 4,-2.3 1,-0.2 -1,-0.2 -0.732 21.5 175.3-101.6 75.0 27.6 0.7 -8.8 126 126 A W H > + 0 0 49 -2,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.875 69.2 47.0 -52.1 -51.8 31.1 1.4 -7.5 127 127 A D H > S+ 0 0 111 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.913 114.7 46.9 -62.1 -42.9 32.6 3.3 -10.4 128 128 A E H > S+ 0 0 110 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.874 110.8 51.6 -67.9 -37.6 29.6 5.5 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.869 108.3 52.4 -63.8 -40.6 29.4 6.3 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.916 110.5 48.0 -63.9 -42.3 33.1 7.3 -7.1 131 131 A V H < S+ 0 0 88 -4,-2.0 4,-0.5 2,-0.2 3,-0.3 0.931 114.0 46.6 -62.7 -47.3 32.5 9.7 -10.0 132 132 A N H >< S+ 0 0 39 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.914 108.4 55.1 -64.1 -41.3 29.4 11.2 -8.3 133 133 A L H 3< S+ 0 0 1 -4,-2.7 6,-0.4 1,-0.3 -1,-0.2 0.825 99.9 61.8 -60.4 -31.5 31.1 11.5 -4.9 134 134 A A T 3< S+ 0 0 28 -4,-1.2 2,-1.5 -3,-0.3 -1,-0.3 0.668 85.9 76.6 -71.8 -19.7 33.9 13.5 -6.5 135 135 A K S < S+ 0 0 153 -3,-1.4 2,-0.3 -4,-0.5 -1,-0.2 -0.608 80.1 100.2 -88.1 68.3 31.5 16.3 -7.6 136 136 A S S > S- 0 0 19 -2,-1.5 4,-2.0 1,-0.1 3,-0.2 -0.991 84.8-117.8-152.4 150.6 31.2 17.8 -4.2 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.878 115.6 64.5 -53.3 -36.2 32.6 20.7 -2.2 138 138 A W H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.937 103.8 42.4 -51.1 -53.8 34.0 17.9 -0.0 139 139 A Y H 4 S+ 0 0 55 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.902 115.7 48.8 -64.1 -45.4 36.2 16.6 -2.7 140 140 A N H < S+ 0 0 107 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.868 114.6 44.6 -67.9 -33.1 37.4 20.0 -3.8 141 141 A Q H < S+ 0 0 104 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.910 130.5 19.9 -77.4 -44.4 38.2 21.2 -0.3 142 142 A T S X S+ 0 0 22 -4,-2.5 4,-2.7 -5,-0.3 -1,-0.2 -0.569 74.8 164.5-125.2 67.9 40.0 18.1 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.780 69.8 50.1 -59.1 -35.0 41.0 16.3 -2.2 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.917 115.8 40.6 -74.7 -43.1 43.6 13.9 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.919 115.2 53.3 -67.0 -45.6 41.5 12.5 2.0 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.948 107.4 52.5 -54.2 -46.3 38.4 12.5 -0.3 147 147 A K H X S+ 0 0 91 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.888 108.6 49.5 -56.9 -43.1 40.4 10.4 -2.9 148 148 A R H X S+ 0 0 69 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.910 114.3 44.5 -62.4 -43.2 41.4 7.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.936 114.0 50.2 -67.2 -43.4 37.8 7.5 0.9 150 150 A I H X S+ 0 0 15 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.877 108.5 51.8 -61.9 -41.7 36.5 7.3 -2.6 151 151 A T H X S+ 0 0 35 -4,-2.5 4,-2.4 -5,-0.3 6,-0.3 0.847 106.4 54.3 -65.1 -33.0 39.0 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.886 111.0 46.8 -68.0 -37.9 37.9 2.6 -0.5 153 153 A F H < S+ 0 0 2 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.870 114.8 46.3 -70.4 -38.6 34.3 2.8 -1.9 154 154 A R H < S+ 0 0 105 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.900 126.7 25.8 -68.4 -46.3 35.4 2.0 -5.4 155 155 A T H < S- 0 0 41 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.653 84.8-137.6 -95.2 -29.6 37.6 -1.0 -4.5 156 156 A G S < S+ 0 0 16 -4,-2.4 2,-0.2 1,-0.3 -62,-0.2 0.718 72.7 100.2 71.6 22.0 36.3 -2.4 -1.2 157 157 A T S S- 0 0 45 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.814 80.4-119.7-131.4 171.2 40.0 -2.7 -0.1 158 158 A W S > S+ 0 0 43 -2,-0.2 3,-1.8 1,-0.2 4,-0.3 0.057 71.4 122.1 -98.8 20.5 42.4 -0.7 2.1 159 159 A D G > + 0 0 86 1,-0.3 3,-1.6 2,-0.2 -1,-0.2 0.869 67.0 56.6 -53.1 -44.6 44.8 -0.1 -0.6 160 160 A A G 3 S+ 0 0 34 -3,-0.3 -1,-0.3 2,-0.3 -2,-0.1 0.577 110.0 46.9 -61.2 -19.0 44.7 3.7 -0.4 161 161 A Y G < 0 0 18 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.279 360.0 360.0-107.7 12.4 45.6 3.6 3.2 162 162 A K < 0 0 211 -3,-1.6 -2,-0.3 -4,-0.3 -1,-0.2 0.788 360.0 360.0-129.8 360.0 49.0 0.7 2.9