==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-SEP-97 2HEA . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.TAKANO,J.FUNAHASHI,Y.YAMAGATA,S.FUJII,K.YUTANI . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7025.0 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 . 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 . 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 1 2 0 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 84 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 138.3 1.6 20.4 21.9 2 2 A V B -A 39 0A 99 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.957 360.0-142.9-110.8 105.0 4.2 19.4 19.3 3 3 A F - 0 0 11 35,-2.7 2,-0.3 -2,-0.7 3,-0.1 -0.316 9.2-124.3 -65.9 149.8 7.0 22.0 19.5 4 4 A E > - 0 0 152 1,-0.1 4,-2.5 -2,-0.0 5,-0.2 -0.750 34.3-109.0 -89.9 149.0 8.8 23.3 16.5 5 5 A R H > S+ 0 0 93 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.904 113.4 37.1 -42.9 -62.8 12.6 22.7 16.9 6 6 A a H > S+ 0 0 27 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.816 112.6 58.7 -67.1 -28.9 13.8 26.3 17.3 7 7 A E H > S+ 0 0 64 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.950 110.5 44.0 -63.7 -44.9 10.7 27.3 19.3 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.910 109.5 55.6 -65.2 -45.5 11.7 24.6 21.8 9 9 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.940 110.3 45.8 -54.2 -48.4 15.4 25.5 21.8 10 10 A R H X S+ 0 0 113 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.900 112.9 50.7 -63.1 -38.8 14.6 29.1 22.8 11 11 A T H X S+ 0 0 23 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.936 109.2 49.8 -65.5 -46.9 12.1 27.9 25.5 12 12 A L H <>S+ 0 0 0 -4,-3.0 5,-2.1 1,-0.2 6,-0.3 0.876 109.6 52.3 -60.0 -37.4 14.6 25.5 27.1 13 13 A K H ><5S+ 0 0 98 -4,-2.0 3,-1.6 -5,-0.2 -1,-0.2 0.920 107.8 50.3 -65.5 -43.5 17.3 28.3 27.2 14 14 A R H 3<5S+ 0 0 189 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.862 106.6 56.3 -63.8 -32.0 14.9 30.7 28.9 15 15 A L T 3<5S- 0 0 54 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.348 121.1-110.4 -81.6 5.5 14.2 27.9 31.5 16 16 A G T < 5S+ 0 0 38 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.811 75.3 134.0 71.8 36.7 17.9 27.7 32.2 17 17 A M > < + 0 0 0 -5,-2.1 3,-2.0 2,-0.1 2,-0.4 0.712 33.6 108.7 -88.3 -21.4 18.7 24.3 30.7 18 18 A D T 3 S- 0 0 79 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.418 102.1 -8.3 -64.6 110.6 21.8 25.3 28.9 19 19 A G T > S+ 0 0 41 4,-1.7 3,-2.6 -2,-0.4 -1,-0.3 0.503 86.4 166.9 82.8 5.3 24.7 23.7 30.7 20 20 A Y B X S-B 23 0B 55 -3,-2.0 3,-1.6 3,-0.7 -1,-0.3 -0.370 80.7 -11.4 -57.7 118.6 22.5 22.5 33.6 21 21 A R T 3 S- 0 0 155 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.864 134.5 -54.8 54.2 36.9 24.7 20.1 35.5 22 22 A G T < S+ 0 0 74 -3,-2.6 2,-0.7 1,-0.2 -1,-0.3 0.543 105.3 132.3 77.9 8.8 27.1 20.2 32.6 23 23 A I B < -B 20 0B 18 -3,-1.6 -4,-1.7 -6,-0.1 -3,-0.7 -0.845 50.3-136.4 -99.5 115.0 24.5 19.2 29.9 24 24 A S >> - 0 0 44 -2,-0.7 4,-1.5 -5,-0.2 3,-1.1 -0.232 20.1-113.6 -65.6 156.9 24.5 21.4 26.9 25 25 A L H 3> S+ 0 0 5 1,-0.3 4,-2.4 2,-0.2 3,-0.3 0.892 115.8 58.5 -56.9 -45.6 21.3 22.7 25.3 26 26 A A H 3> S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.796 104.2 52.9 -58.1 -27.8 21.9 20.6 22.1 27 27 A N H <> S+ 0 0 30 -3,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.881 107.8 48.5 -75.1 -40.7 21.9 17.5 24.2 28 28 A W H X S+ 0 0 1 -4,-1.5 4,-2.5 -3,-0.3 -2,-0.2 0.890 112.8 50.6 -63.5 -38.6 18.5 18.3 25.9 29 29 A M H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.923 110.1 48.6 -63.9 -44.1 17.2 19.0 22.3 30 30 A b H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.906 111.8 50.8 -62.8 -40.5 18.6 15.6 21.1 31 31 A L H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.933 111.8 45.3 -62.7 -49.4 17.0 13.9 24.1 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-1.4 0.883 110.6 55.6 -62.7 -39.9 13.5 15.5 23.5 33 33 A K H <5S+ 0 0 69 -4,-2.5 4,-0.4 4,-0.2 -1,-0.2 0.923 115.9 35.4 -59.8 -45.8 13.7 14.7 19.8 34 34 A W H <5S+ 0 0 100 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.750 118.5 50.5 -83.1 -24.5 14.3 11.0 20.4 35 35 A E H <5S- 0 0 41 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.930 137.6 -10.5 -78.9 -43.6 12.1 10.6 23.5 36 36 A S T <5S- 0 0 23 -4,-2.2 -3,-0.2 20,-0.4 -2,-0.1 0.493 83.7-110.8-135.0 -9.9 8.9 12.2 22.2 37 37 A G S -A 2 0A 41 -7,-0.3 3,-0.8 -37,-0.2 -37,-0.2 -0.895 38.9-163.6-106.7 117.6 5.4 16.2 21.9 40 40 A T T 3 S+ 0 0 2 -39,-2.7 16,-0.2 -2,-0.6 -1,-0.1 0.623 88.8 51.7 -72.6 -16.1 4.2 17.2 25.4 41 41 A R T 3 S+ 0 0 185 -40,-0.3 -1,-0.2 14,-0.2 44,-0.1 0.440 77.7 128.0-101.8 1.4 1.3 14.7 25.4 42 42 A A < + 0 0 18 -3,-0.8 13,-2.3 12,-0.1 2,-0.3 -0.303 33.3 179.2 -59.3 136.3 3.3 11.6 24.5 43 43 A T E -C 54 0C 75 11,-0.2 2,-0.4 15,-0.1 11,-0.2 -0.981 11.7-168.8-138.7 146.8 2.8 8.6 26.8 44 44 A N E -C 53 0C 88 9,-1.7 9,-2.5 -2,-0.3 2,-0.4 -0.927 11.7-148.6-144.8 116.4 4.3 5.1 26.7 45 45 A Y E -C 52 0C 124 -2,-0.4 2,-1.0 7,-0.2 7,-0.2 -0.716 7.6-149.6 -83.7 129.9 3.2 2.2 28.8 46 46 A N E >>> -C 51 0C 50 5,-3.4 4,-1.6 -2,-0.4 3,-1.1 -0.832 12.3-174.0-101.7 93.5 5.9 -0.3 29.8 47 47 A A T 345S+ 0 0 73 -2,-1.0 -1,-0.2 1,-0.2 5,-0.0 0.833 77.8 66.9 -56.8 -33.7 4.0 -3.5 30.0 48 48 A G T 345S+ 0 0 87 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.784 121.7 12.1 -59.6 -34.6 7.1 -5.3 31.3 49 49 A D T <45S- 0 0 73 -3,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.326 99.4-115.7-128.8 7.4 7.2 -3.4 34.6 50 50 A R T <5S+ 0 0 162 -4,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.743 73.1 122.8 66.3 27.0 3.8 -1.6 34.8 51 51 A S E < -C 46 0C 0 -5,-1.0 -5,-3.4 19,-0.1 2,-0.4 -0.762 49.1-142.2-114.4 164.7 5.3 1.9 34.6 52 52 A T E -C 45 0C 9 -2,-0.3 9,-2.1 -7,-0.2 2,-0.5 -0.961 6.8-138.1-130.6 143.2 4.5 4.8 32.2 53 53 A D E -CD 44 60C 30 -9,-2.5 -9,-1.7 -2,-0.4 2,-0.4 -0.895 27.9-157.3 -98.8 128.4 6.8 7.4 30.6 54 54 A Y E > -CD 43 59C 26 5,-2.8 5,-2.2 -2,-0.5 3,-0.3 -0.909 31.4 -23.4-119.2 134.3 5.2 10.9 30.4 55 55 A G T > 5S- 0 0 0 -13,-2.3 3,-0.8 -2,-0.4 -16,-0.2 -0.178 97.1 -27.4 85.6-169.1 5.7 13.9 28.4 56 56 A I T 3 5S+ 0 0 1 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.843 141.1 35.6 -60.8 -32.8 8.3 15.7 26.2 57 57 A F T 3 5S- 0 0 1 -3,-0.3 -1,-0.3 27,-0.1 -2,-0.2 0.421 105.7-127.0-102.0 2.8 11.2 14.0 28.2 58 58 A Q T < 5 - 0 0 8 -3,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.950 34.8-166.9 49.5 56.8 9.3 10.8 28.8 59 59 A I E < -D 54 0C 2 -5,-2.2 -5,-2.8 25,-0.1 2,-0.3 -0.588 17.0-119.3 -77.8 133.4 9.8 10.8 32.5 60 60 A N E >>> -D 53 0C 23 -2,-0.3 4,-2.0 -7,-0.2 5,-0.7 -0.540 5.1-143.8 -82.5 138.6 9.1 7.5 34.3 61 61 A S T 345S+ 0 0 0 -9,-2.1 6,-0.3 -2,-0.3 9,-0.1 0.506 90.1 72.9 -74.0 -10.7 6.4 7.1 37.0 62 62 A R T 345S+ 0 0 43 11,-0.2 12,-3.0 -10,-0.2 -1,-0.2 0.852 121.6 3.3 -74.9 -32.7 8.4 4.5 39.1 63 63 A Y T <45S+ 0 0 129 -3,-0.6 13,-3.0 10,-0.2 -2,-0.2 0.735 132.4 41.2-120.2 -38.0 10.8 7.1 40.4 64 64 A W T <5S+ 0 0 34 -4,-2.0 13,-2.2 11,-0.3 15,-0.3 0.837 108.9 15.9 -90.8 -40.2 9.9 10.6 39.2 65 65 A c S S- 0 0 13 -9,-0.1 3,-1.0 -18,-0.0 -2,-0.1 -0.850 76.3-120.7 -96.9 119.2 2.7 2.1 39.3 71 71 A P T 3 S- 0 0 67 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.295 85.1 -6.7 -58.1 138.2 3.8 -0.6 41.9 72 72 A G T 3 S+ 0 0 79 1,-0.2 2,-0.2 -9,-0.0 -10,-0.0 0.799 95.2 158.7 42.3 44.7 6.4 0.5 44.5 73 73 A A < - 0 0 34 -3,-1.0 2,-0.3 -5,-0.0 -10,-0.2 -0.572 30.0-152.9 -97.5 155.6 6.9 3.8 42.9 74 74 A V - 0 0 88 -12,-3.0 2,-0.3 -2,-0.2 -9,-0.2 -0.739 12.4-138.9-116.7 169.9 8.3 7.0 44.4 75 75 A N > + 0 0 46 -2,-0.3 3,-0.9 -11,-0.1 -11,-0.3 -0.706 28.3 166.9-131.9 75.7 7.6 10.6 43.3 76 76 A A T 3 S+ 0 0 23 -13,-3.0 -12,-0.2 -2,-0.3 -11,-0.1 0.850 80.0 50.9 -63.7 -33.2 11.0 12.3 43.5 77 77 A d T 3 S- 0 0 22 -13,-2.2 -1,-0.3 -14,-0.2 -12,-0.1 0.631 103.3-133.7 -79.8 -10.0 9.7 15.3 41.5 78 78 A H < + 0 0 155 -3,-0.9 2,-0.3 -14,-0.3 -13,-0.1 0.960 64.0 123.4 53.4 53.7 6.8 15.6 43.9 79 79 A L - 0 0 37 -15,-0.3 -13,-2.7 16,-0.0 2,-0.3 -0.971 69.6-113.2-138.9 154.0 4.5 16.0 40.9 80 80 A S B > -e 66 0D 68 -2,-0.3 3,-1.6 -15,-0.2 4,-0.4 -0.672 32.9-124.1 -80.5 145.6 1.4 14.3 39.5 81 81 A c G > S+ 0 0 2 -15,-2.2 3,-1.2 -2,-0.3 -1,-0.1 0.759 110.4 73.0 -63.0 -20.2 2.4 12.6 36.2 82 82 A S G > S+ 0 0 81 -16,-0.4 3,-1.9 1,-0.2 -1,-0.3 0.838 84.0 65.2 -59.2 -35.4 -0.5 14.7 34.8 83 83 A A G X S+ 0 0 17 -3,-1.6 3,-0.8 1,-0.3 9,-0.3 0.739 93.5 62.1 -61.6 -22.1 1.7 17.8 35.2 84 84 A L G < S+ 0 0 3 -3,-1.2 -28,-0.3 -4,-0.4 -1,-0.3 0.203 95.0 61.2 -89.7 13.5 4.0 16.4 32.6 85 85 A L G < S+ 0 0 59 -3,-1.9 -1,-0.2 -30,-0.1 -2,-0.2 0.268 78.6 111.6-120.3 6.6 1.3 16.4 29.9 86 86 A Q S < S- 0 0 89 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.353 74.3-125.5 -77.0 161.2 0.7 20.1 29.9 87 87 A D S S+ 0 0 99 -2,-0.1 2,-0.7 -46,-0.0 -1,-0.1 0.757 99.8 76.3 -76.3 -26.8 1.6 22.3 26.9 88 88 A N S S- 0 0 109 1,-0.1 3,-0.5 -48,-0.0 4,-0.3 -0.807 70.5-164.0 -86.0 116.8 3.6 24.5 29.3 89 89 A I > + 0 0 4 -2,-0.7 4,-3.0 1,-0.2 5,-0.3 0.310 57.5 108.2 -89.9 10.7 6.8 22.5 30.0 90 90 A A H > S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 85.0 44.5 -52.6 -45.3 7.9 24.4 33.1 91 91 A D H > S+ 0 0 61 -3,-0.5 4,-1.9 -8,-0.2 -1,-0.2 0.903 112.9 50.1 -67.6 -43.3 7.0 21.4 35.3 92 92 A A H > S+ 0 0 6 -9,-0.3 4,-2.2 -4,-0.3 -2,-0.2 0.875 112.1 49.1 -62.2 -38.7 8.6 18.9 33.0 93 93 A V H X S+ 0 0 3 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.929 109.3 51.1 -68.6 -42.7 11.8 21.0 32.9 94 94 A A H X S+ 0 0 54 -4,-2.3 4,-1.2 -5,-0.3 -1,-0.2 0.862 113.9 45.2 -62.1 -36.5 11.9 21.3 36.6 95 95 A d H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.855 108.8 54.7 -76.0 -35.9 11.6 17.5 37.0 96 96 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.892 106.3 53.9 -62.3 -38.1 14.1 16.8 34.2 97 97 A K H X S+ 0 0 45 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.893 107.9 50.2 -62.5 -39.3 16.6 18.9 36.2 98 98 A R H >< S+ 0 0 65 -4,-1.2 3,-1.0 2,-0.2 -2,-0.2 0.944 106.9 55.0 -63.8 -46.2 15.9 16.8 39.3 99 99 A V H >< S+ 0 0 3 -4,-2.5 3,-1.4 1,-0.3 6,-0.3 0.935 109.4 45.3 -52.3 -53.1 16.5 13.6 37.2 100 100 A V H 3< S+ 0 0 3 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.595 93.6 78.4 -70.7 -11.0 20.0 14.7 36.1 101 101 A R T << S+ 0 0 115 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.474 80.6 87.3 -75.3 -2.6 20.9 15.8 39.6 102 102 A D S X S- 0 0 59 -3,-1.4 3,-2.0 -4,-0.2 6,-0.1 -0.725 101.7-101.9 -92.2 152.9 21.5 12.1 40.3 103 103 A P T 3 S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.737 116.9 65.1 -46.4 -31.4 25.0 10.7 39.5 104 104 A Q T > S- 0 0 105 1,-0.2 3,-1.7 -5,-0.2 -4,-0.1 0.819 79.4-178.6 -62.9 -34.6 23.7 9.1 36.2 105 105 A G G X - 0 0 17 -3,-2.0 3,-1.5 -6,-0.3 -1,-0.2 -0.411 68.6 -10.5 69.0-139.1 23.1 12.5 34.6 106 106 A A G > S+ 0 0 8 1,-0.3 3,-1.7 2,-0.1 6,-0.3 0.631 121.4 83.5 -67.9 -13.2 21.6 12.2 31.1 107 107 A R G < + 0 0 115 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.583 67.9 84.9 -67.6 -7.7 22.5 8.4 31.1 108 108 A A G < S+ 0 0 37 -3,-1.5 2,-0.7 1,-0.1 -1,-0.3 0.789 84.5 60.9 -63.2 -27.8 19.2 8.0 33.0 109 109 A W S X> S- 0 0 19 -3,-1.7 3,-1.5 1,-0.2 4,-0.9 -0.904 75.6-156.4-102.1 112.9 17.5 7.9 29.5 110 110 A V H 3> S+ 0 0 78 -2,-0.7 4,-1.8 1,-0.3 3,-0.3 0.860 91.5 67.3 -59.1 -30.5 18.9 5.0 27.5 111 111 A A H 3> S+ 0 0 22 1,-0.2 4,-2.7 2,-0.2 5,-0.4 0.829 93.1 60.5 -59.5 -29.5 17.9 6.8 24.4 112 112 A W H <>>S+ 0 0 28 -3,-1.5 4,-2.7 -6,-0.3 5,-2.7 0.955 105.5 45.0 -63.1 -48.7 20.5 9.4 25.2 113 113 A R H <5S+ 0 0 105 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.875 117.5 46.0 -61.3 -39.2 23.4 6.9 25.1 114 114 A N H <5S+ 0 0 90 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.894 130.6 14.5 -73.8 -44.0 22.1 5.3 21.9 115 115 A R H <5S+ 0 0 111 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.575 132.9 28.2-113.3 -10.8 21.4 8.4 19.8 116 116 A b T ><5S+ 0 0 1 -4,-2.7 3,-1.6 -5,-0.4 -3,-0.2 0.742 84.5 98.9-117.4 -44.3 23.0 11.5 21.4 117 117 A Q T 3 + 0 0 19 -2,-1.1 3,-1.6 1,-0.2 4,-0.4 0.302 42.1 109.3 -98.3 8.4 24.5 17.2 18.1 122 122 A R G >> + 0 0 165 1,-0.3 3,-1.9 2,-0.2 4,-0.8 0.840 65.6 70.6 -51.7 -41.3 25.0 20.8 16.7 123 123 A Q G 34 S+ 0 0 125 -3,-0.3 3,-0.5 1,-0.3 -1,-0.3 0.782 85.1 67.6 -49.9 -32.5 22.1 20.2 14.2 124 124 A Y G <4 S+ 0 0 20 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.749 115.0 25.5 -63.7 -25.6 19.5 20.3 17.0 125 125 A V T X4 S+ 0 0 28 -3,-1.9 3,-1.6 -4,-0.4 5,-0.4 0.316 86.4 134.8-119.4 4.6 20.2 24.1 17.7 126 126 A Q T 3< S- 0 0 108 -4,-0.8 -120,-0.1 -3,-0.5 -3,-0.0 -0.387 81.4 -0.1 -61.1 124.0 21.5 25.2 14.4 127 127 A G T 3 S+ 0 0 83 -2,-0.2 -1,-0.3 3,-0.1 -4,-0.0 0.386 96.2 113.7 80.6 1.4 19.9 28.5 13.4 128 128 A a S < S- 0 0 1 -3,-1.6 -2,-0.1 1,-0.0 -118,-0.1 0.539 82.0-119.1 -82.9 -9.2 17.7 28.9 16.4 129 129 A G 0 0 75 -4,-0.3 -3,-0.1 1,-0.2 -1,-0.0 0.841 360.0 360.0 75.2 34.3 19.4 32.0 17.8 130 130 A V 0 0 71 -5,-0.4 -1,-0.2 -117,-0.0 -3,-0.1 -0.521 360.0 360.0-120.7 360.0 20.4 30.4 21.1