==== 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 2BQA . 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) . 6977.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 66.9 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 . 9 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 18.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 3.1 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 1 1 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 82 0, 0.0 39,-2.6 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 140.8 1.5 20.3 21.5 2 2 A V B -A 39 0A 99 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.930 360.0-145.2-107.5 109.2 4.3 19.5 19.0 3 3 A F - 0 0 11 35,-2.3 2,-0.3 -2,-0.7 3,-0.0 -0.319 10.3-123.7 -70.7 152.6 7.1 22.1 19.2 4 4 A E > - 0 0 150 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.721 35.2-106.6 -91.7 152.1 9.1 23.3 16.2 5 5 A R H > S+ 0 0 91 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.902 114.1 35.8 -44.8 -63.2 12.8 22.8 16.7 6 6 A a H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.866 112.7 59.7 -66.6 -33.1 14.0 26.4 17.3 7 7 A E H > S+ 0 0 60 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.940 109.5 44.4 -58.8 -45.7 10.9 27.3 19.2 8 8 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.912 109.5 56.2 -64.6 -44.5 11.7 24.6 21.7 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.931 109.7 44.7 -54.8 -48.5 15.4 25.5 21.9 10 10 A R H X S+ 0 0 116 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.883 112.3 52.8 -64.3 -38.2 14.7 29.1 22.9 11 11 A T H X S+ 0 0 21 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.925 109.7 47.9 -64.6 -44.6 12.1 27.9 25.4 12 12 A L H <>S+ 0 0 0 -4,-2.8 5,-2.2 1,-0.2 6,-0.3 0.887 111.0 51.7 -64.6 -37.7 14.6 25.6 27.1 13 13 A K H ><5S+ 0 0 94 -4,-2.1 3,-1.9 -5,-0.2 -2,-0.2 0.947 108.8 49.7 -63.2 -47.5 17.2 28.3 27.2 14 14 A R H 3<5S+ 0 0 180 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.855 107.9 55.7 -58.8 -33.6 14.7 30.7 28.8 15 15 A L T 3<5S- 0 0 56 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.363 120.7-107.2 -82.3 3.5 13.9 27.9 31.4 16 16 A G T < 5S+ 0 0 39 -3,-1.9 -3,-0.2 -4,-0.1 -2,-0.1 0.770 78.9 129.2 78.0 30.5 17.6 27.6 32.4 17 17 A M > < + 0 0 0 -5,-2.2 3,-2.0 2,-0.1 2,-0.6 0.715 35.9 107.1 -87.7 -21.5 18.5 24.3 30.7 18 18 A D T 3 S- 0 0 83 -6,-0.3 6,-0.2 1,-0.3 4,-0.1 -0.434 103.4 -8.4 -66.3 107.9 21.6 25.4 28.9 19 19 A G T > S+ 0 0 42 4,-1.8 3,-2.1 -2,-0.6 -1,-0.3 0.556 86.7 166.4 83.9 9.3 24.5 23.8 30.8 20 20 A Y B X S-B 23 0B 53 -3,-2.0 3,-2.0 3,-0.7 -1,-0.3 -0.444 79.7 -12.2 -62.1 121.2 22.3 22.6 33.7 21 21 A R T 3 S- 0 0 161 1,-0.3 -1,-0.3 -2,-0.3 3,-0.1 0.841 133.9 -53.6 51.7 38.7 24.5 20.1 35.6 22 22 A G T < S+ 0 0 76 -3,-2.1 2,-0.7 1,-0.2 -1,-0.3 0.495 105.7 133.3 78.9 7.3 27.0 20.2 32.7 23 23 A I B < -B 20 0B 11 -3,-2.0 -4,-1.8 -6,-0.1 -3,-0.7 -0.816 49.6-138.7 -99.0 114.0 24.4 19.3 30.0 24 24 A S >> - 0 0 43 -2,-0.7 4,-1.5 -5,-0.2 3,-0.9 -0.223 20.7-115.8 -65.5 154.8 24.4 21.5 26.9 25 25 A L H 3> S+ 0 0 4 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.893 116.0 61.2 -58.8 -39.5 21.2 22.7 25.3 26 26 A A H 3> S+ 0 0 13 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.832 103.3 51.0 -58.0 -32.1 22.1 20.7 22.2 27 27 A N H <> S+ 0 0 31 -3,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.897 108.2 49.2 -74.5 -39.1 22.0 17.5 24.4 28 28 A W H X S+ 0 0 0 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.880 111.6 51.7 -66.2 -34.0 18.6 18.3 25.8 29 29 A M H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.920 108.8 49.3 -66.6 -43.4 17.3 18.9 22.3 30 30 A b H X S+ 0 0 0 -4,-1.9 4,-2.0 -5,-0.2 5,-0.2 0.898 111.5 50.9 -62.4 -40.9 18.7 15.6 21.1 31 31 A L H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.944 111.2 45.6 -62.9 -51.1 17.0 13.9 24.0 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 6,-1.4 0.881 110.4 56.4 -61.0 -38.4 13.6 15.5 23.4 33 33 A K H X5S+ 0 0 71 -4,-2.3 4,-0.7 4,-0.2 -1,-0.2 0.940 116.2 33.5 -58.7 -50.3 13.8 14.7 19.7 34 34 A W H <5S+ 0 0 95 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.776 119.3 51.2 -81.0 -26.6 14.4 10.9 20.2 35 35 A E H <5S- 0 0 41 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.954 138.4 -10.9 -77.0 -46.2 12.2 10.5 23.3 36 36 A S H <5S- 0 0 21 -4,-2.3 -3,-0.2 20,-0.4 3,-0.2 0.474 83.6-111.8-133.5 -5.9 9.1 12.2 22.0 37 37 A G S < -A 2 0A 40 -7,-0.3 3,-1.0 -37,-0.2 -37,-0.2 -0.921 40.3-161.5-110.0 118.5 5.6 16.2 21.5 40 40 A T T 3 S+ 0 0 2 -39,-2.6 16,-0.2 -2,-0.6 -1,-0.1 0.661 89.2 52.0 -69.7 -22.0 4.3 17.1 25.0 41 41 A R T 3 S+ 0 0 178 -40,-0.2 -1,-0.2 14,-0.2 2,-0.1 0.391 76.4 131.0 -98.5 6.1 1.4 14.6 25.0 42 42 A A < - 0 0 20 -3,-1.0 13,-2.4 12,-0.1 2,-0.4 -0.352 32.4-179.3 -61.6 130.1 3.5 11.6 24.1 43 43 A T E -C 54 0C 78 11,-0.2 2,-0.4 -2,-0.1 11,-0.2 -0.989 9.1-169.1-132.5 140.9 2.9 8.6 26.5 44 44 A N E -C 53 0C 92 9,-2.2 9,-2.8 -2,-0.4 2,-0.4 -0.945 9.4-151.6-139.0 117.9 4.5 5.2 26.4 45 45 A Y E -C 52 0C 126 -2,-0.4 2,-0.8 7,-0.2 7,-0.2 -0.691 5.4-152.0 -88.1 133.2 3.4 2.1 28.4 46 46 A N E >>> -C 51 0C 45 5,-2.9 4,-1.5 -2,-0.4 5,-0.9 -0.883 7.8-170.2-108.5 96.9 6.0 -0.4 29.3 47 47 A A T 345S+ 0 0 78 -2,-0.8 -1,-0.2 1,-0.2 5,-0.0 0.791 79.3 66.0 -55.7 -33.3 4.1 -3.7 29.6 48 48 A G T 345S+ 0 0 85 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.847 121.6 11.9 -61.1 -41.0 7.2 -5.4 31.1 49 49 A D T <45S- 0 0 65 -3,-0.8 -1,-0.2 2,-0.2 -2,-0.2 0.290 99.3-118.0-121.8 7.1 7.2 -3.5 34.3 50 50 A R T <5S+ 0 0 161 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.762 70.3 128.0 63.4 28.7 3.8 -1.7 34.2 51 51 A S E < -C 46 0C 0 -5,-0.9 -5,-2.9 19,-0.1 2,-0.4 -0.735 46.6-142.7-109.7 164.3 5.3 1.8 34.2 52 52 A T E -C 45 0C 8 -2,-0.3 9,-2.2 -7,-0.2 2,-0.5 -0.975 5.5-140.2-131.4 141.1 4.5 4.7 31.8 53 53 A D E -CD 44 60C 29 -9,-2.8 -9,-2.2 -2,-0.4 2,-0.4 -0.887 26.9-157.0 -99.1 129.0 6.8 7.4 30.3 54 54 A Y E > -CD 43 59C 25 5,-2.5 5,-2.4 -2,-0.5 3,-0.3 -0.912 32.1 -24.5-117.5 135.0 5.1 10.8 30.1 55 55 A G T > 5S- 0 0 0 -13,-2.4 3,-1.4 -2,-0.4 -14,-0.2 -0.094 98.0 -25.2 81.2-168.0 5.7 13.9 28.0 56 56 A I T 3 5S+ 0 0 1 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.830 140.5 35.0 -58.2 -34.4 8.4 15.6 26.0 57 57 A F T 3 5S- 0 0 1 -3,-0.3 -1,-0.3 27,-0.1 -2,-0.2 0.360 106.5-124.2-103.6 7.2 11.2 14.0 28.0 58 58 A Q T < 5 - 0 0 12 -3,-1.4 2,-0.4 1,-0.2 -3,-0.2 0.968 35.3-164.0 46.7 66.7 9.4 10.7 28.6 59 59 A I E < -D 54 0C 3 -5,-2.4 -5,-2.5 25,-0.1 2,-0.3 -0.699 15.8-119.6 -87.0 130.6 9.6 10.8 32.3 60 60 A N E >>> -D 53 0C 26 -2,-0.4 4,-2.2 -7,-0.2 3,-0.8 -0.534 5.5-145.1 -79.4 132.8 9.0 7.5 34.1 61 61 A S T 345S+ 0 0 0 -9,-2.2 6,-0.3 -2,-0.3 13,-0.2 0.538 90.9 70.0 -70.1 -10.0 6.2 7.0 36.6 62 62 A R T 345S+ 0 0 36 11,-0.2 12,-2.9 -10,-0.1 -1,-0.2 0.854 121.3 4.2 -78.2 -32.6 8.1 4.6 38.8 63 63 A Y T <45S+ 0 0 117 -3,-0.8 13,-3.3 10,-0.2 14,-0.3 0.714 132.6 37.9-123.2 -29.1 10.6 7.2 40.2 64 64 A W T <5S+ 0 0 33 -4,-2.2 15,-0.7 11,-0.2 2,-0.3 0.676 111.7 20.4-104.8 -25.1 9.7 10.7 39.0 65 65 A c E < -e 79 0D 0 -5,-0.7 2,-0.5 9,-0.3 15,-0.2 -0.964 69.9-119.1-142.2 159.3 6.0 11.3 38.8 66 66 A N E +e 80 0D 84 13,-2.7 15,-2.4 -2,-0.3 16,-0.4 -0.898 34.6 157.6-104.3 125.9 2.9 9.7 40.4 67 67 A D - 0 0 38 -2,-0.5 2,-0.6 -6,-0.3 -1,-0.1 0.291 48.4-128.9-123.7 4.8 0.2 8.2 38.3 68 68 A G S S+ 0 0 66 -7,-0.2 5,-0.1 1,-0.1 -2,-0.0 0.054 94.0 72.4 74.7 -29.2 -1.3 5.9 40.9 69 69 A K + 0 0 128 -2,-0.6 -1,-0.1 2,-0.1 -3,-0.0 0.239 67.8 103.5-104.4 13.9 -1.2 2.7 38.8 70 70 A T S > S- 0 0 12 -9,-0.2 3,-1.0 -18,-0.0 -19,-0.1 -0.877 70.3-125.8-101.6 120.6 2.5 2.0 38.8 71 71 A P T 3 S+ 0 0 61 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.196 87.6 4.3 -59.0 149.1 3.7 -0.9 41.2 72 72 A G T 3 S+ 0 0 72 1,-0.1 2,-0.1 0, 0.0 -10,-0.0 0.733 96.3 170.3 41.4 39.4 6.5 -0.1 43.7 73 73 A A < - 0 0 44 -3,-1.0 2,-0.3 -5,-0.1 -10,-0.2 -0.306 22.7-168.8 -83.2 160.4 6.5 3.5 42.7 74 74 A V - 0 0 91 -12,-2.9 -9,-0.3 -13,-0.2 2,-0.2 -0.817 17.2-141.1-135.3 167.7 8.2 6.5 44.1 75 75 A N + 0 0 34 -2,-0.3 -11,-0.2 -11,-0.1 -9,-0.1 -0.630 29.3 161.0-138.8 76.9 7.8 10.3 43.5 76 76 A A S S+ 0 0 23 -13,-3.3 -12,-0.2 1,-0.2 -1,-0.1 0.945 86.5 38.8 -61.4 -51.1 11.2 11.9 43.6 77 77 A A S S- 0 0 28 -13,-0.3 -1,-0.2 -14,-0.3 -12,-0.1 0.752 102.4-139.5 -71.2 -24.3 10.1 15.0 41.7 78 78 A H + 0 0 155 1,-0.2 2,-0.2 -14,-0.1 -13,-0.1 0.634 53.5 135.2 71.1 23.3 6.7 14.9 43.6 79 79 A L E -e 65 0D 38 -15,-0.7 -13,-2.7 12,-0.1 2,-0.3 -0.584 61.8-115.2 -99.6 156.0 4.6 15.7 40.5 80 80 A S E > -e 66 0D 69 -15,-0.2 3,-1.5 -2,-0.2 4,-0.4 -0.711 28.9-127.4 -82.2 142.2 1.4 14.2 39.2 81 81 A c G > S+ 0 0 2 -15,-2.4 3,-1.5 -2,-0.3 -14,-0.1 0.791 106.9 72.6 -63.6 -21.4 2.2 12.6 35.8 82 82 A S G > S+ 0 0 82 -16,-0.4 3,-1.5 1,-0.3 -1,-0.3 0.794 85.8 64.6 -61.0 -30.5 -0.7 14.7 34.4 83 83 A A G X S+ 0 0 16 -3,-1.5 3,-0.8 1,-0.3 9,-0.3 0.727 94.1 60.8 -67.5 -21.0 1.5 17.8 34.8 84 84 A L G < S+ 0 0 4 -3,-1.5 -28,-0.3 -4,-0.4 -1,-0.3 0.251 94.9 62.0 -90.9 8.7 3.9 16.3 32.2 85 85 A L G < S+ 0 0 60 -3,-1.5 -1,-0.2 -30,-0.1 -2,-0.2 0.236 80.9 112.9-113.9 9.8 1.2 16.2 29.5 86 86 A Q S < S- 0 0 89 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.344 73.4-127.6 -79.4 160.4 0.6 20.1 29.5 87 87 A D S S+ 0 0 99 -2,-0.1 2,-0.7 -46,-0.0 -1,-0.1 0.788 98.7 75.5 -74.8 -32.3 1.5 22.4 26.6 88 88 A N S S- 0 0 107 1,-0.1 3,-0.5 -48,-0.0 4,-0.3 -0.762 72.0-161.7 -81.4 117.7 3.4 24.5 29.0 89 89 A I > + 0 0 6 -2,-0.7 4,-2.5 1,-0.2 5,-0.2 0.309 58.8 108.0 -88.3 13.0 6.6 22.6 29.7 90 90 A A H > S+ 0 0 41 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 84.8 43.2 -55.2 -46.3 7.7 24.3 32.9 91 91 A D H > S+ 0 0 62 -3,-0.5 4,-2.1 -8,-0.2 -1,-0.2 0.876 112.0 52.8 -70.0 -36.5 6.8 21.3 35.0 92 92 A A H > S+ 0 0 6 -9,-0.3 4,-2.2 -4,-0.3 -1,-0.2 0.857 110.8 49.2 -65.5 -36.0 8.4 18.8 32.6 93 93 A V H X S+ 0 0 5 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.902 108.3 51.8 -69.4 -42.6 11.6 20.9 32.7 94 94 A A H X S+ 0 0 53 -4,-2.0 4,-1.5 -5,-0.2 -2,-0.2 0.891 112.5 47.4 -61.1 -37.8 11.5 21.0 36.5 95 95 A A H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.914 109.4 51.6 -68.3 -45.6 11.2 17.1 36.5 96 96 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.859 108.3 53.6 -59.1 -36.8 14.0 16.6 33.9 97 97 A K H X S+ 0 0 40 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.918 108.4 49.6 -65.1 -42.1 16.3 18.8 36.1 98 98 A R H >< S+ 0 0 63 -4,-1.5 3,-1.4 1,-0.2 4,-0.3 0.932 106.6 55.4 -62.5 -46.4 15.5 16.6 39.1 99 99 A V H >< S+ 0 0 4 -4,-2.5 3,-1.4 1,-0.3 6,-0.3 0.938 109.0 46.7 -53.5 -49.2 16.3 13.4 37.1 100 100 A V H 3< S+ 0 0 2 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.510 91.7 78.9 -74.7 -3.6 19.8 14.6 36.2 101 101 A R T << S+ 0 0 124 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.510 81.9 87.0 -76.7 -8.0 20.6 15.7 39.8 102 102 A D S X S- 0 0 67 -3,-1.4 3,-1.7 -4,-0.3 6,-0.1 -0.596 101.8 -99.5 -86.9 157.8 21.2 12.0 40.4 103 103 A P T 3 S+ 0 0 135 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.753 118.8 60.7 -48.3 -34.9 24.7 10.5 39.7 104 104 A Q T > S- 0 0 112 1,-0.2 3,-1.7 -5,-0.2 -4,-0.1 0.789 82.3-179.9 -65.8 -29.7 23.7 9.1 36.2 105 105 A G G X - 0 0 16 -3,-1.7 3,-1.7 -6,-0.3 -1,-0.2 -0.353 66.7 -8.3 66.0-140.2 22.9 12.5 34.9 106 106 A I G > S+ 0 0 13 1,-0.3 3,-1.4 -6,-0.1 -1,-0.3 0.703 124.7 78.7 -63.3 -20.5 21.7 12.6 31.3 107 107 A R G < + 0 0 108 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.516 66.2 89.1 -69.3 -3.0 22.6 8.9 31.1 108 108 A A G < S+ 0 0 37 -3,-1.7 2,-0.7 -6,-0.1 -1,-0.3 0.823 79.1 68.1 -63.9 -28.8 19.4 8.0 32.9 109 109 A W S X> S- 0 0 21 -3,-1.4 3,-1.3 1,-0.2 4,-1.1 -0.819 71.3-158.6 -94.0 116.0 17.7 7.9 29.5 110 110 A V H 3> S+ 0 0 79 -2,-0.7 4,-2.0 1,-0.3 3,-0.3 0.880 91.4 65.9 -62.7 -33.1 19.0 5.0 27.4 111 111 A A H 3> S+ 0 0 23 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.797 96.9 56.5 -56.7 -30.4 17.8 6.8 24.3 112 112 A W H <>>S+ 0 0 16 -3,-1.3 5,-2.5 -6,-0.2 4,-2.4 0.915 106.8 47.9 -68.5 -43.3 20.5 9.4 25.0 113 113 A R H <5S+ 0 0 98 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.910 114.5 46.6 -63.0 -42.2 23.3 6.9 25.0 114 114 A N H <5S+ 0 0 91 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.901 130.9 14.2 -67.6 -47.9 22.1 5.2 21.8 115 115 A R H <5S+ 0 0 113 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.514 131.6 30.5-115.0 1.4 21.6 8.3 19.7 116 116 A b T ><5S+ 0 0 1 -4,-2.4 3,-1.6 -5,-0.2 -3,-0.2 0.734 84.6 95.4-122.6 -47.5 23.2 11.4 21.3 117 117 A Q T 3 + 0 0 18 -2,-0.8 3,-1.6 1,-0.1 4,-0.3 0.274 44.7 106.2-108.0 12.0 24.7 17.3 18.2 122 122 A R G >> + 0 0 156 1,-0.3 3,-1.7 2,-0.2 4,-1.2 0.826 66.9 72.7 -57.4 -36.9 25.1 20.9 16.9 123 123 A Q G 34 S+ 0 0 122 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.749 86.0 65.3 -50.4 -29.1 22.5 20.3 14.3 124 124 A Y G <4 S+ 0 0 22 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.766 116.1 24.0 -69.7 -25.3 19.8 20.4 17.0 125 125 A V T X4 S+ 0 0 27 -3,-1.7 3,-1.6 -4,-0.3 5,-0.5 0.364 87.2 129.4-120.1 1.3 20.3 24.1 17.8 126 126 A Q T 3< S+ 0 0 111 -4,-1.2 -120,-0.1 1,-0.2 -3,-0.0 -0.395 81.0 7.1 -65.7 127.0 21.9 25.4 14.6 127 127 A G T 3 S+ 0 0 80 -2,-0.2 -1,-0.2 3,-0.1 -4,-0.0 0.310 97.2 109.2 86.0 -5.0 20.2 28.6 13.3 128 128 A a S < S- 0 0 2 -3,-1.6 -2,-0.1 2,-0.1 -118,-0.1 0.558 84.6-119.5 -80.8 -11.4 17.9 29.0 16.4 129 129 A G 0 0 77 -4,-0.3 -3,-0.1 1,-0.3 -1,-0.0 0.756 360.0 360.0 79.9 24.6 19.6 32.0 17.8 130 130 A V 0 0 70 -5,-0.5 -1,-0.3 -117,-0.0 -3,-0.1 -0.577 360.0 360.0-113.2 360.0 20.6 30.4 21.2