==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 06-AUG-92 1TBY . COMPND 2 MOLECULE: HUMAN LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.HARATA,M.MURAKI,Y.JIGAMI . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 86 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.5 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 . 8 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 17.7 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 . 5 3.8 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 . 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 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 . 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 K 0 0 59 0, 0.0 39,-2.4 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 156.7 1.9 20.3 21.0 2 2 A V B -A 39 0A 80 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.919 360.0-147.0-103.4 117.2 4.7 19.7 18.5 3 3 A F - 0 0 12 35,-2.4 2,-0.4 -2,-0.6 3,-0.1 -0.331 11.8-121.6 -76.3 155.7 7.4 22.3 18.9 4 4 A E > - 0 0 145 1,-0.1 4,-2.8 -2,-0.1 5,-0.2 -0.790 34.0-108.5 -90.3 153.0 9.4 23.6 16.1 5 5 A R H > S+ 0 0 83 -2,-0.4 4,-2.1 1,-0.2 3,-0.1 0.915 114.9 36.1 -49.4 -61.1 13.1 23.0 16.6 6 6 A a H > S+ 0 0 25 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.842 113.1 59.8 -69.8 -28.5 14.3 26.6 17.2 7 7 A E H > S+ 0 0 57 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.938 109.4 43.5 -60.5 -47.2 11.1 27.4 19.1 8 8 A L H X S+ 0 0 2 -4,-2.8 4,-2.8 2,-0.2 5,-0.3 0.910 108.8 58.3 -66.9 -39.5 12.0 24.6 21.6 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.934 109.7 43.3 -57.9 -46.1 15.7 25.6 21.8 10 10 A R H X S+ 0 0 105 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.877 112.0 53.4 -67.9 -36.9 14.8 29.1 22.9 11 11 A T H X S+ 0 0 15 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.931 110.8 46.5 -64.3 -44.1 12.2 27.8 25.4 12 12 A L H <>S+ 0 0 0 -4,-2.8 5,-2.4 2,-0.2 6,-0.3 0.859 110.4 54.5 -65.9 -35.3 14.8 25.5 27.0 13 13 A K H ><5S+ 0 0 108 -4,-1.9 3,-1.6 -5,-0.3 5,-0.3 0.951 108.3 48.3 -60.1 -50.8 17.3 28.4 27.1 14 14 A R H 3<5S+ 0 0 162 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.829 107.8 55.8 -58.3 -38.4 14.7 30.5 29.0 15 15 A L T 3<5S- 0 0 52 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.309 120.3-107.3 -80.9 3.7 14.0 27.6 31.5 16 16 A G T < 5S+ 0 0 39 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.703 76.6 132.0 86.4 26.7 17.7 27.4 32.4 17 17 A M > < + 0 0 0 -5,-2.4 3,-1.5 2,-0.1 2,-0.7 0.631 35.5 104.7 -86.7 -13.4 18.7 24.1 30.6 18 18 A D T 3 S- 0 0 96 -6,-0.3 6,-0.2 -5,-0.3 3,-0.1 -0.585 104.3 -7.4 -77.4 112.0 21.8 25.3 28.9 19 19 A G T > S+ 0 0 44 4,-2.6 3,-2.3 -2,-0.7 -1,-0.3 0.542 87.5 161.2 81.5 10.7 24.8 23.9 30.8 20 20 A Y B X S-B 23 0B 40 -3,-1.5 3,-1.9 3,-0.7 -1,-0.3 -0.512 83.0 -8.9 -66.1 124.5 22.5 22.6 33.6 21 21 A R T 3 S- 0 0 156 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.777 133.7 -59.2 50.7 30.5 24.7 19.9 35.3 22 22 A G T < S+ 0 0 72 -3,-2.3 2,-0.6 1,-0.2 -1,-0.3 0.568 104.4 132.2 82.5 9.6 27.2 20.4 32.4 23 23 A I B < -B 20 0B 14 -3,-1.9 -4,-2.6 -6,-0.1 -3,-0.7 -0.835 49.5-139.2 -99.7 119.3 24.8 19.4 29.7 24 24 A S > - 0 0 29 -2,-0.6 4,-1.3 -6,-0.2 3,-0.4 -0.286 23.8-110.0 -66.2 164.1 24.6 21.8 26.7 25 25 A L H > S+ 0 0 5 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.866 116.8 62.6 -59.5 -38.3 21.3 22.8 25.0 26 26 A A H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.863 103.1 50.3 -59.4 -32.4 22.3 20.7 21.9 27 27 A N H > S+ 0 0 27 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.861 110.4 47.1 -74.9 -38.3 22.3 17.6 24.0 28 28 A W H X S+ 0 0 0 -4,-1.3 4,-2.7 2,-0.2 5,-0.2 0.882 113.0 51.6 -68.0 -33.0 18.9 18.3 25.5 29 29 A M H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.915 108.1 49.6 -69.2 -43.2 17.7 19.0 21.9 30 30 A b H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.933 112.6 50.4 -59.9 -40.9 19.1 15.7 20.6 31 31 A L H X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 5,-0.2 0.953 111.8 43.7 -65.3 -54.8 17.3 14.0 23.5 32 32 A A H X>S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 6,-1.4 0.886 112.7 56.7 -55.4 -40.2 13.8 15.6 23.0 33 33 A K H X5S+ 0 0 78 -4,-2.3 4,-1.4 4,-0.2 -2,-0.2 0.974 115.7 33.2 -54.5 -57.7 14.2 14.9 19.2 34 34 A W H <5S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.790 118.8 53.5 -78.0 -24.5 14.8 11.2 19.5 35 35 A E H <5S- 0 0 40 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.923 137.5 -13.0 -74.6 -42.8 12.5 10.7 22.5 36 36 A S H <5S- 0 0 20 -4,-2.3 -3,-0.2 20,-0.3 -2,-0.2 0.443 83.6-109.5-137.3 -3.9 9.3 12.3 21.1 37 37 A G S < -A 2 0A 42 -7,-0.3 3,-1.2 -37,-0.2 -37,-0.2 -0.896 39.4-164.7-113.4 117.6 5.9 16.3 20.9 40 40 A T T 3 S+ 0 0 1 -39,-2.4 16,-0.1 -2,-0.6 15,-0.1 0.685 87.8 60.1 -70.5 -18.5 4.6 17.0 24.4 41 41 A R T 3 S+ 0 0 144 -40,-0.2 -1,-0.2 14,-0.1 2,-0.1 0.442 76.2 126.5 -89.3 -2.4 1.6 14.6 23.9 42 42 A A < + 0 0 19 -3,-1.2 13,-2.2 12,-0.1 2,-0.3 -0.351 31.0 174.1 -64.1 130.6 3.8 11.5 23.4 43 43 A T E -C 54 0C 81 11,-0.2 2,-0.3 -2,-0.1 11,-0.2 -0.972 12.1-172.0-133.3 148.4 3.3 8.4 25.6 44 44 A N E -C 53 0C 70 9,-1.7 9,-2.2 -2,-0.3 2,-0.3 -0.916 11.7-153.6-137.1 111.3 4.9 5.0 25.3 45 45 A Y E -C 52 0C 133 -2,-0.3 2,-0.8 7,-0.3 7,-0.3 -0.715 8.3-147.7 -87.1 140.6 3.5 2.1 27.5 46 46 A N E >>> -C 51 0C 46 5,-3.3 4,-1.7 -2,-0.3 5,-0.9 -0.905 9.0-167.9-113.9 98.4 6.1 -0.6 28.3 47 47 A A T 345S+ 0 0 77 -2,-0.8 -1,-0.1 1,-0.2 5,-0.0 0.803 79.6 63.3 -62.7 -28.7 4.1 -3.8 28.5 48 48 A G T 345S+ 0 0 85 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.842 123.4 15.1 -68.0 -39.6 7.1 -5.8 30.0 49 49 A D T <45S- 0 0 67 -3,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.373 101.4-122.4-116.8 4.6 7.3 -3.7 33.2 50 50 A R T <5 + 0 0 160 -4,-1.7 2,-0.2 1,-0.2 -3,-0.2 0.744 67.3 125.7 65.8 29.0 3.9 -1.9 33.0 51 51 A S E < -C 46 0C 0 -5,-0.9 -5,-3.3 19,-0.1 2,-0.3 -0.707 47.4-143.2-107.7 170.8 5.3 1.6 33.1 52 52 A T E -C 45 0C 9 -7,-0.3 9,-2.2 -2,-0.2 2,-0.4 -0.960 7.9-136.7-133.1 145.0 4.6 4.5 30.6 53 53 A D E -CD 44 60C 23 -9,-2.2 -9,-1.7 -2,-0.3 2,-0.4 -0.913 27.1-154.0-103.3 132.9 6.9 7.2 29.4 54 54 A Y E > -CD 43 59C 22 5,-2.3 5,-2.1 -2,-0.4 3,-0.4 -0.927 32.6 -23.5-118.5 130.8 5.3 10.7 29.2 55 55 A G T > 5S- 0 0 0 -13,-2.2 3,-1.7 -2,-0.4 -15,-0.2 0.007 98.9 -26.4 82.4-169.5 5.9 13.9 27.2 56 56 A I T 3 5S+ 0 0 2 28,-0.3 -20,-0.3 1,-0.3 -18,-0.3 0.715 139.8 36.5 -57.7 -28.0 8.6 15.5 25.3 57 57 A F T 3 5S- 0 0 3 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.434 103.6-125.3-103.4 -0.7 11.4 13.8 27.3 58 58 A Q T < 5 - 0 0 13 -3,-1.7 2,-0.5 -4,-0.2 -3,-0.2 0.981 35.5-170.0 49.1 62.2 9.7 10.4 27.8 59 59 A I E < -D 54 0C 2 -5,-2.1 -5,-2.3 25,-0.1 2,-0.2 -0.726 19.7-119.5 -87.3 128.6 10.0 10.5 31.5 60 60 A N E >> -D 53 0C 30 -2,-0.5 4,-2.1 -7,-0.2 5,-1.1 -0.478 3.8-139.7 -76.1 140.4 9.1 7.1 33.0 61 61 A S T 45S+ 0 0 0 -9,-2.2 6,-0.3 -2,-0.2 14,-0.2 0.540 94.4 64.7 -77.3 -8.0 6.2 6.5 35.6 62 62 A R T 45S+ 0 0 51 11,-0.2 12,-3.1 -10,-0.1 13,-0.5 0.937 120.4 12.3 -78.7 -49.3 8.2 4.0 37.8 63 63 A L T 45S+ 0 0 78 10,-0.2 13,-2.8 11,-0.2 -2,-0.2 0.849 133.4 27.4 -96.2 -31.9 10.8 6.4 39.0 64 64 A W T <5S+ 0 0 30 -4,-2.1 13,-2.3 11,-0.3 15,-0.5 0.918 110.8 24.1-110.8 -45.2 9.9 9.9 38.2 65 65 A c < - 0 0 0 -5,-1.1 2,-0.5 12,-0.1 10,-0.3 -0.825 68.6-122.0-121.9 161.9 6.2 10.8 37.9 66 66 A N B +e 80 0D 66 13,-2.6 15,-2.5 -2,-0.3 16,-0.4 -0.890 32.4 161.4-110.5 124.6 3.1 9.2 39.3 67 67 A D - 0 0 37 -2,-0.5 2,-0.3 -6,-0.3 -1,-0.1 0.273 51.4-122.8-113.8 5.0 0.2 7.9 37.2 68 68 A G S S+ 0 0 65 -7,-0.2 5,-0.1 2,-0.1 -2,-0.0 0.106 97.8 72.4 80.0 -30.3 -1.4 5.6 39.8 69 69 A K + 0 0 149 -2,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.397 68.2 99.0-101.9 7.0 -1.2 2.5 37.7 70 70 A T S > S- 0 0 11 -9,-0.2 3,-1.1 -18,-0.0 -19,-0.1 -0.827 71.6-124.7-100.3 122.0 2.6 1.6 37.7 71 71 A P T 3 S+ 0 0 65 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.234 91.8 10.1 -60.1 141.7 3.8 -1.1 40.2 72 72 A G T 3 S- 0 0 71 1,-0.2 2,-0.1 2,-0.1 -10,-0.0 0.757 86.5-179.7 60.5 27.7 6.7 -0.0 42.6 73 73 A A < - 0 0 43 -3,-1.1 -10,-0.2 1,-0.1 -11,-0.2 -0.385 17.9-174.9 -67.9 138.8 6.4 3.7 41.6 74 74 A V - 0 0 88 -12,-3.1 -11,-0.2 -9,-0.2 -1,-0.1 0.721 14.9-155.2-101.0 -41.3 8.8 6.0 43.3 75 75 A N > + 0 0 37 -13,-0.5 3,-1.5 -10,-0.3 -11,-0.3 0.907 21.3 172.1 54.6 51.6 7.6 9.5 42.0 76 76 A A T 3 S+ 0 0 15 -13,-2.8 -12,-0.2 1,-0.3 -11,-0.1 0.833 76.3 52.6 -60.8 -27.9 11.0 11.2 42.6 77 77 A d T 3 S- 0 0 21 -13,-2.3 -1,-0.3 -14,-0.2 -12,-0.1 0.630 101.7-134.8 -82.7 -12.5 9.8 14.4 40.8 78 78 A H < + 0 0 157 -3,-1.5 2,-0.3 -14,-0.4 -13,-0.1 0.913 63.6 128.0 58.1 47.9 6.7 14.6 43.1 79 79 A L - 0 0 34 -15,-0.5 -13,-2.6 16,-0.0 2,-0.3 -0.958 66.5-117.2-137.2 140.7 4.7 15.2 40.0 80 80 A S B > -e 66 0D 64 -2,-0.3 3,-1.7 -15,-0.2 4,-0.4 -0.632 30.4-125.2 -72.9 143.6 1.5 13.7 38.4 81 81 A c G > S+ 0 0 2 -15,-2.5 3,-1.6 1,-0.3 -14,-0.1 0.828 108.4 68.7 -62.7 -26.8 2.4 12.2 35.0 82 82 A S G > S+ 0 0 75 -16,-0.4 3,-1.6 1,-0.3 -1,-0.3 0.763 84.9 69.3 -65.7 -20.8 -0.3 14.3 33.5 83 83 A A G X S+ 0 0 14 -3,-1.7 3,-0.8 1,-0.3 9,-0.3 0.790 94.7 58.2 -64.9 -23.1 1.8 17.4 34.2 84 84 A L G < S+ 0 0 4 -3,-1.6 -28,-0.3 -4,-0.4 -1,-0.3 0.330 96.3 60.6 -88.2 3.0 4.2 16.1 31.5 85 85 A L G < S+ 0 0 59 -3,-1.6 -1,-0.2 -30,-0.1 -2,-0.2 0.244 81.4 112.8-109.8 13.3 1.5 16.1 28.8 86 86 A Q S < S- 0 0 81 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.446 74.2-127.4 -82.2 160.0 0.9 19.8 29.0 87 87 A D S S+ 0 0 99 -2,-0.1 2,-0.6 2,-0.0 -1,-0.1 0.803 99.6 74.7 -73.3 -30.9 1.8 22.3 26.1 88 88 A N S S- 0 0 96 1,-0.1 3,-0.4 -5,-0.1 4,-0.3 -0.765 71.2-164.4 -81.0 117.8 3.7 24.3 28.7 89 89 A I > + 0 0 4 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.345 57.5 108.0 -91.6 9.1 6.9 22.3 29.3 90 90 A A H > S+ 0 0 35 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.922 84.8 44.8 -53.5 -41.5 8.0 24.0 32.6 91 91 A D H > S+ 0 0 57 -3,-0.4 4,-2.1 -8,-0.2 -1,-0.2 0.893 111.4 51.1 -71.2 -42.0 7.0 20.9 34.7 92 92 A A H > S+ 0 0 5 -9,-0.3 4,-2.6 -4,-0.3 -1,-0.2 0.905 112.0 50.1 -57.3 -40.3 8.7 18.5 32.3 93 93 A V H X S+ 0 0 3 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.920 107.9 51.1 -67.8 -45.3 11.9 20.7 32.5 94 94 A A H X S+ 0 0 54 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.915 114.4 44.7 -60.5 -34.7 11.8 20.7 36.3 95 95 A d H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.918 110.1 53.8 -78.0 -36.9 11.5 16.9 36.3 96 96 A A H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.894 107.4 51.8 -59.1 -38.3 14.2 16.5 33.6 97 97 A K H < S+ 0 0 42 -4,-2.5 4,-0.5 2,-0.2 -1,-0.2 0.874 108.9 51.6 -66.2 -37.1 16.6 18.6 35.8 98 98 A R H >< S+ 0 0 75 -4,-1.5 3,-1.4 -5,-0.2 4,-0.4 0.951 106.0 54.7 -60.6 -49.3 15.8 16.2 38.8 99 99 A V H >< S+ 0 0 2 -4,-2.5 3,-1.4 1,-0.3 6,-0.3 0.919 108.8 47.9 -49.7 -48.5 16.6 13.1 36.6 100 100 A V T 3< S+ 0 0 5 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.529 91.6 76.3 -81.6 -2.3 20.1 14.4 35.8 101 101 A R T < S+ 0 0 119 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.581 79.7 88.7 -76.2 -12.9 21.0 15.3 39.4 102 102 A D S X S- 0 0 48 -3,-1.4 3,-1.6 -4,-0.4 6,-0.1 -0.597 100.8-106.9 -72.9 156.4 21.5 11.5 39.8 103 103 A P T 3 S+ 0 0 128 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.760 116.9 63.1 -62.8 -29.3 25.2 10.6 38.9 104 104 A Q T > S- 0 0 87 1,-0.2 3,-1.5 -5,-0.1 4,-0.1 0.728 84.3-179.0 -63.6 -28.4 24.3 8.9 35.5 105 105 A G G X - 0 0 15 -3,-1.6 3,-1.7 -6,-0.3 -1,-0.2 -0.280 64.1 -9.8 62.6-138.4 23.0 12.3 34.4 106 106 A I G > S+ 0 0 9 1,-0.3 3,-2.0 -6,-0.2 6,-0.3 0.697 120.5 82.5 -70.1 -15.5 21.6 12.4 30.8 107 107 A R G < + 0 0 116 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.680 69.9 85.0 -60.2 -14.6 22.9 8.8 30.3 108 108 A A G < S+ 0 0 42 -3,-1.7 2,-0.8 1,-0.1 -1,-0.3 0.799 79.4 67.5 -59.7 -27.2 19.7 7.8 32.2 109 109 A W S X> S- 0 0 19 -3,-2.0 3,-1.8 1,-0.2 4,-1.1 -0.843 74.3-159.9 -97.5 110.5 17.9 8.0 28.8 110 110 A V H 3> S+ 0 0 82 -2,-0.8 4,-2.6 1,-0.3 3,-0.2 0.873 89.1 66.1 -60.1 -36.1 19.3 5.1 26.7 111 111 A A H 3> S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.783 97.8 55.5 -54.0 -27.8 18.1 6.8 23.5 112 112 A W H <>>S+ 0 0 17 -3,-1.8 4,-2.4 -6,-0.3 5,-2.4 0.903 108.4 47.4 -69.5 -45.2 20.7 9.6 24.3 113 113 A R H <5S+ 0 0 116 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.921 116.6 43.5 -60.2 -43.5 23.4 7.0 24.4 114 114 A N H <5S+ 0 0 101 -4,-2.6 -2,-0.2 1,-0.1 -1,-0.2 0.866 130.1 20.7 -68.9 -41.5 22.3 5.4 21.2 115 115 A R H <5S+ 0 0 122 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.554 131.1 23.7-110.6 -12.4 21.7 8.6 19.2 116 116 A b T ><5S+ 0 0 1 -4,-2.4 3,-1.4 -5,-0.2 -3,-0.2 0.690 84.4 101.4-130.1 -40.6 23.6 11.6 20.7 117 117 A Q T 3 + 0 0 1 -2,-0.8 3,-1.5 1,-0.1 4,-0.3 0.296 46.6 100.4-111.3 9.6 24.9 17.4 18.0 122 122 A R G >> + 0 0 113 1,-0.3 3,-1.8 2,-0.2 4,-1.1 0.828 66.9 72.4 -72.4 -24.2 25.4 21.1 17.2 123 123 A Q G 34 S+ 0 0 75 1,-0.3 -1,-0.3 2,-0.2 3,-0.1 0.786 87.9 66.7 -56.1 -22.8 23.1 20.9 14.1 124 124 A Y G <4 S+ 0 0 35 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.807 112.2 29.9 -70.7 -23.9 20.2 20.6 16.5 125 125 A V T X4 S+ 0 0 25 -3,-1.8 3,-1.6 -4,-0.3 5,-0.4 0.435 90.0 124.7-109.4 -4.2 20.8 24.2 17.8 126 126 A Q T 3< S+ 0 0 126 -4,-1.1 -120,-0.1 1,-0.3 -3,-0.0 -0.410 78.6 9.0 -65.4 123.7 22.2 25.8 14.7 127 127 A G T 3 S+ 0 0 76 -2,-0.3 -1,-0.3 -121,-0.0 -4,-0.0 0.332 95.9 106.5 93.7 -5.9 20.4 28.9 13.4 128 128 A a S < S- 0 0 4 -3,-1.6 -2,-0.1 -123,-0.0 -118,-0.1 0.513 84.3-125.1 -84.9 -6.5 18.2 29.2 16.4 129 129 A G 0 0 75 -4,-0.2 -3,-0.1 1,-0.1 -1,-0.0 0.916 360.0 360.0 64.6 48.8 20.1 32.2 17.8 130 130 A V 0 0 87 -5,-0.4 -105,-0.1 -117,-0.0 -1,-0.1 0.177 360.0 360.0-127.3 360.0 20.6 30.6 21.1