==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-MAY-98 2BQK . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.TAKANO,Y.YAMAGATA,K.YUTANI . 130 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 11 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 19.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 25.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 4.6 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 0 1 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 K 0 0 80 0, 0.0 39,-2.8 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 141.0 1.5 20.3 21.6 2 2 A V B -A 39 0A 96 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.935 360.0-145.5-106.8 110.5 4.2 19.5 19.0 3 3 A F - 0 0 10 35,-2.8 2,-0.3 -2,-0.7 3,-0.0 -0.397 10.0-125.4 -72.7 150.0 7.1 22.0 19.2 4 4 A E > - 0 0 156 1,-0.1 4,-2.6 -2,-0.1 5,-0.2 -0.714 34.6-106.6 -90.3 150.7 9.0 23.1 16.2 5 5 A R H > S+ 0 0 88 -2,-0.3 4,-2.4 1,-0.2 -1,-0.1 0.906 114.7 36.3 -42.0 -65.5 12.8 22.7 16.6 6 6 A a H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.850 113.4 59.0 -65.3 -30.0 14.0 26.2 17.1 7 7 A E H > S+ 0 0 67 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.934 110.5 43.0 -62.9 -45.3 10.9 27.2 19.1 8 8 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.900 109.4 58.4 -66.2 -42.1 11.7 24.4 21.6 9 9 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.946 109.8 41.9 -53.4 -53.6 15.5 25.4 21.6 10 10 A R H X S+ 0 0 115 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.846 113.8 54.2 -63.7 -34.0 14.8 29.0 22.7 11 11 A T H X S+ 0 0 18 -4,-1.6 4,-1.6 -5,-0.2 -2,-0.2 0.931 109.9 45.4 -65.0 -51.2 12.1 27.8 25.2 12 12 A L H <>S+ 0 0 0 -4,-2.8 5,-2.1 2,-0.2 6,-0.3 0.896 112.8 52.3 -62.6 -38.5 14.6 25.4 26.9 13 13 A K H ><5S+ 0 0 96 -4,-2.3 3,-2.0 -5,-0.3 5,-0.3 0.955 109.1 48.6 -62.0 -48.2 17.2 28.1 26.9 14 14 A R H 3<5S+ 0 0 184 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.798 107.0 57.9 -61.4 -27.3 14.8 30.6 28.6 15 15 A L T 3<5S- 0 0 52 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.291 121.1-109.0 -86.5 10.1 14.0 27.8 31.1 16 16 A G T < 5S+ 0 0 41 -3,-2.0 -3,-0.2 -5,-0.1 -2,-0.1 0.821 78.3 130.6 68.7 35.5 17.7 27.6 32.1 17 17 A M > < + 0 0 0 -5,-2.1 3,-1.9 2,-0.1 2,-0.5 0.697 36.3 104.9 -91.0 -22.0 18.5 24.2 30.5 18 18 A D T 3 S- 0 0 75 -6,-0.3 6,-0.2 1,-0.3 4,-0.1 -0.477 102.0 -4.4 -67.5 113.0 21.6 25.3 28.7 19 19 A G T > S+ 0 0 44 4,-1.9 3,-1.7 -2,-0.5 2,-0.3 0.586 87.4 164.5 82.7 12.9 24.5 23.8 30.6 20 20 A Y B X S-B 23 0B 54 -3,-1.9 3,-2.2 3,-0.9 -1,-0.3 -0.499 78.3 -13.2 -68.6 122.6 22.4 22.5 33.4 21 21 A R T 3 S- 0 0 158 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.848 134.3 -52.0 51.2 39.6 24.5 20.0 35.4 22 22 A G T < S+ 0 0 76 -3,-1.7 2,-0.7 1,-0.2 -1,-0.3 0.506 106.9 135.4 79.0 7.7 27.0 20.1 32.5 23 23 A I B < -B 20 0B 11 -3,-2.2 -4,-1.9 -6,-0.1 -3,-0.9 -0.790 48.0-139.0 -98.5 116.3 24.4 19.4 29.9 24 24 A S >> - 0 0 43 -2,-0.7 4,-1.7 -5,-0.2 3,-1.0 -0.256 20.9-117.9 -68.6 151.3 24.4 21.4 26.7 25 25 A L H 3> S+ 0 0 4 1,-0.3 4,-2.7 2,-0.2 3,-0.4 0.909 115.6 59.9 -53.4 -44.4 21.2 22.7 25.1 26 26 A A H 3> S+ 0 0 12 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.822 103.8 50.5 -55.2 -35.0 22.0 20.6 22.0 27 27 A N H <> S+ 0 0 30 -3,-1.0 4,-2.3 2,-0.2 -1,-0.3 0.873 109.2 49.5 -72.4 -37.5 22.0 17.5 24.2 28 28 A W H X S+ 0 0 0 -4,-1.7 4,-2.5 -3,-0.4 -2,-0.2 0.897 112.4 49.9 -66.4 -36.3 18.6 18.3 25.7 29 29 A M H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.936 109.7 49.5 -66.0 -46.7 17.3 18.9 22.1 30 30 A b H X S+ 0 0 0 -4,-2.4 4,-1.8 -5,-0.2 5,-0.2 0.907 111.4 51.3 -60.1 -40.0 18.7 15.6 21.0 31 31 A L H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.955 111.2 44.6 -61.7 -54.2 17.0 13.9 23.9 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-1.4 0.891 110.2 57.3 -58.3 -40.9 13.5 15.4 23.3 33 33 A K H X5S+ 0 0 73 -4,-2.4 4,-0.5 4,-0.2 -1,-0.2 0.917 115.3 34.6 -57.2 -47.9 13.7 14.6 19.6 34 34 A W H <5S+ 0 0 92 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.809 119.0 49.7 -81.8 -28.9 14.3 10.9 20.1 35 35 A E H <5S- 0 0 43 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.928 138.9 -10.5 -77.1 -40.9 12.1 10.5 23.2 36 36 A S H <5S- 0 0 20 -4,-2.5 -3,-0.2 20,-0.4 -2,-0.2 0.508 83.1-111.2-136.4 -10.6 9.0 12.2 21.8 37 37 A G S < -A 2 0A 42 -7,-0.3 3,-1.1 -37,-0.2 -37,-0.2 -0.880 39.6-163.2-108.0 115.3 5.6 16.2 21.4 40 40 A T T 3 S+ 0 0 1 -39,-2.8 16,-0.2 -2,-0.6 -1,-0.1 0.685 88.2 50.8 -69.1 -20.5 4.2 17.1 24.9 41 41 A R T 3 S+ 0 0 182 -40,-0.3 -1,-0.2 14,-0.2 44,-0.1 0.432 77.7 127.6-100.6 5.3 1.4 14.6 24.9 42 42 A A < + 0 0 21 -3,-1.1 13,-2.3 12,-0.1 2,-0.3 -0.299 33.4 179.3 -61.8 136.7 3.5 11.5 24.0 43 43 A T E -C 54 0C 82 11,-0.2 2,-0.4 15,-0.1 11,-0.2 -0.996 12.6-164.7-139.9 142.3 3.1 8.6 26.4 44 44 A N E -C 53 0C 73 9,-2.1 9,-2.5 -2,-0.3 2,-0.5 -0.977 9.7-150.1-131.8 119.0 4.6 5.1 26.3 45 45 A Y E -C 52 0C 120 -2,-0.4 2,-1.0 7,-0.2 7,-0.2 -0.775 7.7-148.8 -89.6 128.3 3.4 2.2 28.3 46 46 A N E >>> -C 51 0C 40 5,-3.3 4,-1.7 -2,-0.5 5,-0.9 -0.814 11.1-172.2 -98.8 94.9 6.0 -0.3 29.3 47 47 A A T 345S+ 0 0 78 -2,-1.0 -1,-0.2 1,-0.2 5,-0.0 0.793 79.6 65.3 -55.9 -31.2 4.1 -3.6 29.4 48 48 A G T 345S+ 0 0 86 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.845 122.1 12.1 -62.2 -42.8 7.2 -5.3 30.9 49 49 A D T <45S- 0 0 68 -3,-0.7 -2,-0.2 2,-0.2 -1,-0.2 0.310 99.3-118.0-120.5 8.3 7.3 -3.3 34.2 50 50 A R T <5S+ 0 0 159 -4,-1.7 2,-0.2 1,-0.2 -3,-0.2 0.728 71.8 126.1 62.9 28.3 3.8 -1.7 34.1 51 51 A S E < -C 46 0C 0 -5,-0.9 -5,-3.3 19,-0.1 2,-0.4 -0.682 47.8-142.4-111.0 166.7 5.3 1.9 34.1 52 52 A T E -C 45 0C 8 -7,-0.2 9,-2.3 -2,-0.2 2,-0.5 -0.989 5.0-140.1-134.5 141.5 4.6 4.7 31.7 53 53 A D E -CD 44 60C 24 -9,-2.5 -9,-2.1 -2,-0.4 2,-0.4 -0.875 27.0-155.1-100.6 130.4 6.8 7.5 30.2 54 54 A Y E > -CD 43 59C 26 5,-2.5 5,-2.1 -2,-0.5 3,-0.4 -0.914 32.2 -24.7-118.6 135.6 5.2 10.9 30.0 55 55 A G T > 5S- 0 0 0 -13,-2.3 3,-1.2 -2,-0.4 -16,-0.2 -0.180 99.0 -25.7 80.2-165.4 5.6 14.0 27.9 56 56 A I T 3 5S+ 0 0 1 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.811 139.9 36.8 -60.1 -33.7 8.3 15.6 25.8 57 57 A F T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.1 -2,-0.2 0.272 105.6-123.8-104.9 9.1 11.1 14.1 27.9 58 58 A Q T < 5 - 0 0 15 -3,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.939 36.4-165.3 45.4 61.1 9.4 10.7 28.4 59 59 A I E < -D 54 0C 3 -5,-2.1 -5,-2.5 25,-0.1 2,-0.3 -0.595 16.8-116.7 -80.7 133.9 9.7 10.9 32.2 60 60 A N E >>> -D 53 0C 25 -2,-0.3 4,-2.3 -7,-0.2 5,-0.9 -0.587 7.6-148.6 -82.5 134.4 9.0 7.6 34.0 61 61 A S T 345S+ 0 0 0 -9,-2.3 6,-0.3 -2,-0.3 13,-0.3 0.591 91.6 67.9 -70.8 -16.9 6.2 7.0 36.5 62 62 A R T 345S+ 0 0 42 11,-0.2 12,-2.1 -10,-0.1 -1,-0.2 0.848 122.8 4.7 -74.2 -31.1 8.1 4.5 38.6 63 63 A Y T <45S+ 0 0 128 -3,-0.7 13,-3.3 10,-0.2 14,-0.3 0.678 131.8 36.6-125.4 -26.0 10.6 7.1 40.0 64 64 A W T <5S+ 0 0 32 -4,-2.3 13,-0.6 11,-0.3 15,-0.5 0.754 112.2 20.1-107.9 -28.5 9.8 10.7 38.9 65 65 A c E S- 0 0 12 -9,-0.2 3,-1.3 -18,-0.0 -19,-0.1 -0.765 72.6-123.4 -91.4 120.2 2.6 2.0 38.6 71 71 A P T 3 S+ 0 0 57 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.257 89.2 1.0 -58.2 140.3 3.6 -0.9 40.9 72 72 A G T 3 S+ 0 0 74 1,-0.1 -2,-0.0 0, 0.0 -10,-0.0 0.718 96.6 166.2 49.0 31.2 6.3 -0.1 43.5 73 73 A A < - 0 0 35 -3,-1.3 2,-0.3 -5,-0.1 -10,-0.2 -0.237 23.3-169.7 -78.4 161.6 6.4 3.5 42.4 74 74 A V - 0 0 98 -12,-2.1 2,-0.5 -13,-0.3 -9,-0.3 -0.926 20.6-133.5-141.3 156.8 8.0 6.5 44.0 75 75 A N + 0 0 36 -2,-0.3 -11,-0.3 1,-0.2 -9,-0.1 -0.791 32.5 161.9-121.2 87.3 7.7 10.2 43.1 76 76 A A S S+ 0 0 19 -13,-3.3 -12,-0.2 -2,-0.5 -1,-0.2 0.917 82.7 43.4 -70.2 -46.0 11.1 11.8 43.2 77 77 A A S S- 0 0 23 -13,-0.6 -1,-0.2 -14,-0.3 -12,-0.1 0.736 104.3-136.9 -72.1 -19.9 10.2 14.8 41.1 78 78 A H + 0 0 151 1,-0.2 2,-0.3 -14,-0.2 -13,-0.1 0.923 58.0 124.2 61.8 51.4 7.0 15.1 43.3 79 79 A L E -e 65 0D 37 -15,-0.5 -13,-2.6 16,-0.0 2,-0.3 -0.925 67.8-110.6-134.3 154.3 4.6 15.8 40.4 80 80 A S E > -e 66 0D 67 -2,-0.3 3,-1.3 -15,-0.2 4,-0.5 -0.692 30.7-127.1 -81.1 140.8 1.5 14.2 39.0 81 81 A c G > S+ 0 0 2 -15,-2.1 3,-1.3 -2,-0.3 -1,-0.1 0.790 108.0 73.0 -59.5 -23.9 2.3 12.6 35.7 82 82 A S G > S+ 0 0 83 -16,-0.4 3,-1.9 1,-0.3 -1,-0.3 0.872 86.1 63.0 -56.9 -38.7 -0.6 14.6 34.4 83 83 A A G X S+ 0 0 17 -3,-1.3 3,-0.9 1,-0.3 9,-0.3 0.758 94.8 61.7 -59.4 -24.9 1.5 17.8 34.7 84 84 A L G < S+ 0 0 4 -3,-1.3 -28,-0.3 -4,-0.5 -1,-0.3 0.264 94.3 61.8 -86.3 8.3 3.9 16.4 32.1 85 85 A L G < S+ 0 0 58 -3,-1.9 -1,-0.2 -30,-0.1 -2,-0.2 0.231 80.6 111.7-115.7 10.6 1.2 16.3 29.4 86 86 A Q S < S- 0 0 85 -3,-0.9 6,-0.1 2,-0.2 -3,-0.0 -0.340 74.5-125.7 -79.5 161.9 0.6 20.1 29.3 87 87 A D S S+ 0 0 99 -2,-0.1 2,-0.8 1,-0.1 -1,-0.1 0.756 99.6 76.1 -78.3 -28.0 1.5 22.4 26.5 88 88 A N S > S- 0 0 107 1,-0.1 3,-0.5 -48,-0.0 4,-0.3 -0.792 70.9-163.6 -85.1 116.2 3.4 24.5 28.9 89 89 A I T 3> + 0 0 5 -2,-0.8 4,-2.6 1,-0.2 5,-0.2 0.321 57.6 108.7 -85.6 8.2 6.6 22.5 29.5 90 90 A A H 3> S+ 0 0 42 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.893 84.3 43.8 -50.5 -45.8 7.7 24.3 32.7 91 91 A D H <> S+ 0 0 61 -3,-0.5 4,-2.0 -8,-0.2 -1,-0.2 0.882 111.3 52.3 -69.5 -41.1 6.9 21.3 34.9 92 92 A A H > S+ 0 0 5 -9,-0.3 4,-2.3 -4,-0.3 -1,-0.2 0.862 110.9 50.0 -62.3 -38.3 8.5 18.7 32.5 93 93 A V H X S+ 0 0 5 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.924 108.9 50.2 -66.0 -46.1 11.6 20.8 32.5 94 94 A A H X S+ 0 0 51 -4,-2.0 4,-1.5 -5,-0.2 -2,-0.2 0.863 113.2 47.4 -60.8 -34.3 11.7 21.0 36.3 95 95 A A H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.877 109.8 52.1 -73.9 -38.9 11.2 17.2 36.4 96 96 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.877 107.4 53.4 -64.4 -36.7 14.0 16.7 33.8 97 97 A K H < S+ 0 0 42 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.922 109.0 49.6 -64.6 -40.6 16.3 18.9 36.0 98 98 A R H >< S+ 0 0 64 -4,-1.5 3,-1.1 1,-0.2 4,-0.3 0.883 106.2 56.2 -63.1 -42.7 15.5 16.6 38.9 99 99 A V H >< S+ 0 0 3 -4,-2.1 3,-1.3 1,-0.2 6,-0.3 0.953 109.0 46.0 -56.1 -50.2 16.3 13.4 36.9 100 100 A V T 3< S+ 0 0 1 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.424 92.8 77.9 -76.2 -1.1 19.8 14.6 36.0 101 101 A R T < S+ 0 0 122 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.526 80.8 86.7 -80.4 -10.6 20.6 15.7 39.6 102 102 A D S X S- 0 0 70 -3,-1.3 3,-1.6 -4,-0.3 6,-0.1 -0.592 102.3-101.4 -81.9 156.1 21.1 12.0 40.2 103 103 A P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.734 117.0 63.4 -50.7 -31.9 24.7 10.6 39.4 104 104 A Q T > S- 0 0 106 1,-0.2 3,-1.5 -5,-0.2 -4,-0.1 0.808 82.1-179.6 -64.6 -33.0 23.7 9.1 36.1 105 105 A G G X - 0 0 15 -3,-1.6 3,-1.8 -6,-0.3 -1,-0.2 -0.358 64.7 -9.9 70.6-140.4 22.9 12.5 34.7 106 106 A I G > S+ 0 0 12 1,-0.3 3,-1.3 -6,-0.2 -1,-0.3 0.670 125.3 78.2 -65.9 -17.8 21.6 12.6 31.1 107 107 A R G < + 0 0 112 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.551 66.4 88.5 -70.1 -7.2 22.6 8.9 30.9 108 108 A A G < S+ 0 0 36 -3,-1.8 2,-0.7 1,-0.1 -1,-0.3 0.729 80.3 68.1 -61.7 -22.7 19.4 8.0 32.8 109 109 A W S X> S- 0 0 21 -3,-1.3 3,-1.4 1,-0.2 4,-1.1 -0.900 72.8-158.7-101.5 110.0 17.7 7.9 29.3 110 110 A V H >> S+ 0 0 75 -2,-0.7 4,-2.2 1,-0.3 3,-0.6 0.891 91.1 63.9 -53.9 -41.6 19.1 4.9 27.3 111 111 A A H 3> S+ 0 0 22 1,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.809 97.3 56.1 -53.4 -34.5 17.9 6.6 24.1 112 112 A W H <>>S+ 0 0 16 -3,-1.4 4,-2.5 -6,-0.2 5,-2.4 0.919 108.9 47.4 -63.4 -42.5 20.4 9.5 24.8 113 113 A R H <<5S+ 0 0 100 -4,-1.1 -2,-0.2 -3,-0.6 -1,-0.2 0.884 114.5 47.2 -63.1 -43.0 23.2 6.9 24.9 114 114 A N H <5S+ 0 0 95 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.868 131.4 12.4 -68.7 -44.6 22.0 5.2 21.7 115 115 A R H <5S+ 0 0 113 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.429 131.1 33.6-121.2 4.8 21.5 8.3 19.6 116 116 A b T ><5S+ 0 0 2 -4,-2.5 3,-0.9 -5,-0.3 -3,-0.2 0.690 84.1 96.9-124.0 -41.7 23.1 11.4 21.2 117 117 A Q T 3 + 0 0 19 -2,-1.0 3,-1.7 1,-0.2 4,-0.4 0.282 45.4 103.2-104.4 8.8 24.6 17.2 18.0 122 122 A R G >> + 0 0 165 1,-0.3 3,-1.8 2,-0.2 4,-0.9 0.852 67.6 75.0 -58.3 -33.1 25.0 20.8 16.8 123 123 A Q G 34 S+ 0 0 120 1,-0.3 -1,-0.3 -3,-0.2 3,-0.2 0.737 86.0 63.3 -50.1 -28.4 22.4 20.0 14.2 124 124 A Y G <4 S+ 0 0 23 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.781 115.6 25.9 -73.7 -24.9 19.7 20.2 16.9 125 125 A V T X4 S+ 0 0 30 -3,-1.8 3,-1.4 -4,-0.4 5,-0.4 0.272 85.8 132.7-120.1 7.7 20.3 23.9 17.7 126 126 A Q T 3< S+ 0 0 102 -4,-0.9 -120,-0.1 1,-0.2 -3,-0.0 -0.454 80.9 2.2 -68.4 129.6 21.7 25.3 14.4 127 127 A G T 3 S+ 0 0 80 -2,-0.2 -1,-0.2 3,-0.1 -4,-0.0 0.429 97.8 112.7 77.1 3.6 20.1 28.5 13.3 128 128 A a S < S- 0 0 1 -3,-1.4 -118,-0.1 -123,-0.0 -2,-0.1 0.620 77.2-129.9 -82.9 -13.9 17.8 28.8 16.3 129 129 A G 0 0 80 -4,-0.3 -3,-0.1 1,-0.2 -1,-0.0 0.857 360.0 360.0 67.6 33.8 19.4 31.8 17.9 130 130 A A 0 0 47 -5,-0.4 -1,-0.2 -117,-0.0 -120,-0.1 -0.326 360.0 360.0-130.9 360.0 19.7 30.1 21.2