==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-FEB-98 1WQN . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.YAMAGATA,M.KUBOTA,Y.SUMIKAWA,J.FUNAHASHI,S.FUJII,K.YUTANI . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7060.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 67.7 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 . 9 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 20.0 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 . 3 2.3 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 . 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 83 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 136.9 1.6 20.5 22.0 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.929 360.0-144.0-108.2 105.6 4.1 19.6 19.3 3 3 A F - 0 0 10 35,-2.6 2,-0.3 -2,-0.7 3,-0.0 -0.353 8.1-125.6 -68.4 148.6 7.0 22.1 19.5 4 4 A E > - 0 0 148 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 -0.714 34.8-108.7 -89.4 148.2 8.8 23.3 16.4 5 5 A R H > S+ 0 0 89 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.906 113.8 37.0 -44.3 -64.4 12.6 22.8 16.8 6 6 A a H > S+ 0 0 26 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.830 112.2 59.5 -64.7 -30.0 13.8 26.4 17.3 7 7 A E H > S+ 0 0 63 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.952 109.6 44.4 -62.3 -44.4 10.7 27.3 19.4 8 8 A L H X S+ 0 0 1 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.912 109.4 56.3 -65.1 -41.6 11.6 24.6 21.9 9 9 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.930 109.7 44.8 -56.9 -47.4 15.3 25.6 21.8 10 10 A R H X S+ 0 0 113 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.908 112.7 52.3 -65.3 -38.4 14.6 29.2 22.8 11 11 A T H X S+ 0 0 21 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.930 108.9 49.1 -62.9 -47.3 12.1 28.0 25.5 12 12 A L H <>S+ 0 0 0 -4,-2.9 5,-2.2 1,-0.2 6,-0.3 0.881 110.0 52.0 -61.9 -38.7 14.6 25.6 27.1 13 13 A K H ><5S+ 0 0 94 -4,-1.9 3,-1.6 -5,-0.2 -1,-0.2 0.910 107.9 51.0 -64.4 -42.6 17.2 28.4 27.2 14 14 A R H 3<5S+ 0 0 185 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.826 107.5 54.5 -64.7 -31.0 14.9 30.8 28.9 15 15 A L T 3<5S- 0 0 58 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.367 122.1-108.9 -83.0 2.1 14.1 28.1 31.5 16 16 A G T < 5S+ 0 0 39 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.766 75.8 133.2 76.8 34.3 17.8 27.7 32.2 17 17 A M > < + 0 0 0 -5,-2.2 3,-1.8 2,-0.1 2,-0.7 0.679 36.0 107.1 -86.6 -21.6 18.7 24.4 30.7 18 18 A D T 3 S- 0 0 79 -6,-0.3 6,-0.2 1,-0.3 4,-0.1 -0.462 102.4 -7.7 -66.1 105.1 21.8 25.5 28.8 19 19 A G T > S+ 0 0 41 4,-2.2 3,-2.2 -2,-0.7 -1,-0.3 0.557 86.4 165.9 87.8 8.9 24.7 23.9 30.7 20 20 A F B X S-B 23 0B 45 -3,-1.8 3,-2.1 3,-0.7 -1,-0.3 -0.437 80.1 -12.3 -62.4 120.7 22.6 22.7 33.6 21 21 A R T 3 S- 0 0 162 1,-0.3 -1,-0.3 -2,-0.3 3,-0.1 0.865 134.3 -54.9 52.2 36.8 24.8 20.2 35.5 22 22 A G T < S+ 0 0 74 -3,-2.2 2,-0.6 1,-0.2 -1,-0.3 0.507 104.8 133.0 78.8 7.6 27.1 20.4 32.6 23 23 A I B < -B 20 0B 10 -3,-2.1 -4,-2.2 -6,-0.1 -3,-0.7 -0.824 50.5-135.3 -97.8 118.8 24.5 19.4 29.9 24 24 A S >> - 0 0 46 -2,-0.6 4,-1.4 -5,-0.2 3,-1.0 -0.220 20.4-115.1 -67.6 155.9 24.5 21.6 26.8 25 25 A L H 3> S+ 0 0 6 1,-0.3 4,-2.3 2,-0.2 3,-0.3 0.907 115.4 61.1 -58.1 -40.6 21.3 22.8 25.3 26 26 A A H 3> S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.783 102.7 52.1 -57.9 -28.9 21.9 20.8 22.1 27 27 A N H <> S+ 0 0 30 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.882 107.9 49.4 -75.4 -40.2 21.9 17.6 24.3 28 28 A W H X S+ 0 0 0 -4,-1.4 4,-2.5 -3,-0.3 -2,-0.2 0.873 112.3 50.3 -63.9 -38.7 18.5 18.4 25.8 29 29 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.923 109.2 49.4 -64.6 -46.5 17.2 19.1 22.3 30 30 A b H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.896 112.0 51.2 -60.4 -39.2 18.6 15.7 21.1 31 31 A L H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.962 110.4 45.5 -63.1 -53.5 16.9 14.0 24.1 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 6,-1.5 0.867 111.3 55.8 -58.2 -38.8 13.4 15.6 23.5 33 33 A K H X5S+ 0 0 67 -4,-2.3 4,-0.7 4,-0.2 -1,-0.2 0.941 115.3 34.3 -60.1 -51.9 13.6 14.8 19.8 34 34 A W H <5S+ 0 0 95 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.724 119.8 50.9 -79.0 -24.2 14.2 11.0 20.3 35 35 A E H <5S- 0 0 41 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.935 137.6 -10.8 -79.8 -43.8 12.1 10.7 23.4 36 36 A S H <5S- 0 0 23 -4,-2.4 3,-0.3 20,-0.4 -3,-0.2 0.510 82.5-111.7-134.4 -8.8 8.9 12.3 22.1 37 37 A G S < -A 2 0A 42 -3,-0.3 3,-1.0 -7,-0.3 -37,-0.2 -0.859 38.7-163.1-104.1 116.2 5.4 16.3 21.8 40 40 A T T 3 S+ 0 0 2 -39,-2.7 16,-0.3 -2,-0.6 -1,-0.1 0.684 87.8 53.9 -71.4 -20.6 4.3 17.2 25.3 41 41 A R T 3 S+ 0 0 185 -40,-0.3 -1,-0.2 14,-0.2 44,-0.1 0.423 76.2 129.8 -96.3 6.9 1.4 14.8 25.4 42 42 A A < + 0 0 20 -3,-1.0 13,-2.2 12,-0.1 2,-0.3 -0.320 32.1 179.4 -62.6 130.9 3.4 11.7 24.6 43 43 A T E -C 54 0C 76 11,-0.2 2,-0.3 15,-0.1 11,-0.2 -0.962 9.4-169.7-131.4 149.9 2.8 8.7 26.9 44 44 A N E -C 53 0C 89 9,-1.8 9,-2.5 -2,-0.3 2,-0.3 -0.852 11.4-149.2-146.9 110.2 4.3 5.3 26.8 45 45 A Y E -C 52 0C 125 -2,-0.3 2,-0.9 7,-0.2 7,-0.2 -0.598 7.6-150.5 -79.1 134.0 3.2 2.3 28.8 46 46 A N E >>> -C 51 0C 46 5,-2.9 4,-1.6 -2,-0.3 3,-1.3 -0.840 10.1-171.9-106.6 90.1 6.0 -0.2 29.7 47 47 A A T 345S+ 0 0 74 -2,-0.9 -1,-0.2 1,-0.3 5,-0.0 0.795 77.7 69.0 -51.8 -31.7 4.1 -3.5 29.9 48 48 A G T 345S+ 0 0 86 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.799 121.5 8.0 -59.8 -37.2 7.3 -5.2 31.2 49 49 A D T <45S- 0 0 68 -3,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.279 98.8-114.3-130.5 7.7 7.3 -3.4 34.6 50 50 A R T <5S+ 0 0 158 -4,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.663 73.7 124.2 66.7 22.7 4.0 -1.5 34.7 51 51 A S E < -C 46 0C 1 -5,-0.8 -5,-2.9 19,-0.1 2,-0.4 -0.682 48.2-144.5-105.4 165.5 5.5 2.0 34.7 52 52 A T E -C 45 0C 9 -2,-0.2 9,-2.3 -7,-0.2 2,-0.4 -0.972 7.4-135.0-133.7 143.3 4.7 4.7 32.1 53 53 A D E -CD 44 60C 29 -9,-2.5 -9,-1.8 -2,-0.4 2,-0.4 -0.858 28.0-154.5 -97.4 133.8 6.9 7.4 30.5 54 54 A Y E > -CD 43 59C 25 5,-2.3 5,-2.2 -2,-0.4 3,-0.4 -0.928 31.6 -29.5-121.1 136.0 5.3 10.9 30.4 55 55 A G T > 5S- 0 0 0 -13,-2.2 3,-1.3 -2,-0.4 -14,-0.2 -0.042 98.3 -23.1 73.9-166.1 5.6 14.0 28.3 56 56 A I T 3 5S+ 0 0 2 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.793 141.0 34.7 -56.5 -35.3 8.3 15.7 26.2 57 57 A F T 3 5S- 0 0 2 -3,-0.4 -1,-0.3 27,-0.1 -2,-0.2 0.382 105.8-126.0-100.6 0.5 11.2 14.1 28.1 58 58 A Q T < 5 - 0 0 11 -3,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.950 35.0-165.2 51.8 57.0 9.4 10.8 28.7 59 59 A I E < -D 54 0C 2 -5,-2.2 -5,-2.3 -6,-0.1 2,-0.3 -0.591 16.2-119.0 -78.2 129.9 9.9 10.9 32.4 60 60 A N E >>> -D 53 0C 29 -2,-0.3 4,-2.1 -7,-0.2 3,-0.8 -0.503 6.0-145.7 -78.2 134.3 9.2 7.6 34.2 61 61 A S T 345S+ 0 0 0 -9,-2.3 6,-0.3 -2,-0.3 7,-0.1 0.601 89.6 74.7 -70.3 -16.2 6.5 7.1 36.9 62 62 A R T 345S+ 0 0 43 -10,-0.2 12,-2.7 11,-0.2 -1,-0.2 0.870 120.4 3.0 -68.4 -32.2 8.5 4.5 38.8 63 63 A Y T <45S+ 0 0 130 -3,-0.8 13,-2.9 10,-0.2 -2,-0.2 0.735 131.5 41.2-122.2 -35.0 10.9 7.1 40.3 64 64 A W T <5S+ 0 0 33 -4,-2.1 13,-2.1 11,-0.3 15,-0.4 0.814 108.6 19.2 -95.6 -35.4 10.0 10.7 39.2 65 65 A c S S- 0 0 13 -9,-0.1 3,-1.0 -18,-0.0 -2,-0.1 -0.820 75.2-122.4 -92.3 121.1 2.9 2.0 39.3 71 71 A P T 3 S- 0 0 68 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.334 85.1 -4.4 -62.3 137.2 4.0 -0.7 41.9 72 72 A G T 3 S+ 0 0 79 1,-0.2 2,-0.2 -2,-0.0 -10,-0.0 0.811 96.3 156.0 47.8 42.4 6.6 0.3 44.5 73 73 A A < - 0 0 36 -3,-1.0 2,-0.3 -5,-0.0 -10,-0.2 -0.598 30.7-153.5 -99.3 155.5 7.1 3.7 42.9 74 74 A V - 0 0 89 -12,-2.7 2,-0.3 -2,-0.2 -9,-0.2 -0.735 13.5-137.1-118.6 170.2 8.4 6.9 44.3 75 75 A N > + 0 0 47 -2,-0.3 3,-1.1 -11,-0.1 -11,-0.3 -0.681 29.4 165.1-128.9 73.9 7.8 10.6 43.3 76 76 A A T 3 S+ 0 0 22 -13,-2.9 -12,-0.2 -2,-0.3 -11,-0.1 0.819 79.7 51.2 -64.0 -29.6 11.1 12.3 43.5 77 77 A d T 3 S- 0 0 20 -13,-2.1 -1,-0.3 -14,-0.2 -12,-0.1 0.597 104.1-132.6 -83.3 -7.7 9.8 15.3 41.5 78 78 A H < + 0 0 157 -3,-1.1 2,-0.3 -14,-0.2 -13,-0.1 0.924 64.1 121.5 55.0 51.1 6.9 15.6 43.9 79 79 A L S S- 0 0 39 -15,-0.4 -13,-2.8 16,-0.0 2,-0.3 -0.937 70.4-112.2-140.2 156.1 4.5 15.9 41.0 80 80 A S B > -e 66 0D 71 -2,-0.3 3,-1.9 -15,-0.2 4,-0.4 -0.716 35.2-123.9 -82.1 139.9 1.4 14.2 39.6 81 81 A c G > S+ 0 0 2 -15,-2.1 3,-1.4 -2,-0.3 -14,-0.1 0.780 110.1 73.5 -59.1 -21.2 2.5 12.6 36.3 82 82 A S G > S+ 0 0 79 -16,-0.4 3,-2.0 1,-0.3 -1,-0.3 0.841 84.1 65.9 -58.4 -34.5 -0.4 14.7 34.8 83 83 A A G X S+ 0 0 17 -3,-1.9 3,-0.9 1,-0.3 9,-0.3 0.769 94.0 59.7 -60.1 -26.3 1.8 17.8 35.3 84 84 A L G < S+ 0 0 4 -3,-1.4 -28,-0.3 -4,-0.4 -1,-0.3 0.252 96.3 62.1 -86.4 8.7 4.2 16.3 32.6 85 85 A L G < S+ 0 0 57 -3,-2.0 -1,-0.2 -30,-0.1 -2,-0.2 0.254 79.3 113.1-116.0 11.2 1.4 16.3 30.0 86 86 A Q S < S- 0 0 87 -3,-0.9 6,-0.1 2,-0.2 -3,-0.0 -0.366 72.5-126.8 -80.9 161.7 0.8 20.1 29.9 87 87 A D S S+ 0 0 100 -2,-0.1 2,-0.7 -46,-0.0 -1,-0.1 0.813 99.4 74.9 -74.1 -34.5 1.5 22.4 27.0 88 88 A N S S- 0 0 110 1,-0.1 3,-0.5 -48,-0.0 4,-0.3 -0.745 72.7-160.9 -80.0 117.1 3.5 24.6 29.4 89 89 A I > + 0 0 8 -2,-0.7 4,-2.6 1,-0.2 5,-0.2 0.375 59.1 107.8 -86.2 9.6 6.7 22.7 29.9 90 90 A A H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.874 83.7 43.2 -52.0 -46.1 7.8 24.5 33.1 91 91 A D H > S+ 0 0 62 -3,-0.5 4,-1.9 -8,-0.2 -1,-0.2 0.876 112.9 52.4 -70.2 -37.7 7.0 21.5 35.4 92 92 A A H > S+ 0 0 7 -9,-0.3 4,-2.3 -4,-0.3 -2,-0.2 0.891 110.6 49.0 -64.5 -38.6 8.6 19.0 33.0 93 93 A V H X S+ 0 0 4 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.903 109.1 50.7 -69.3 -40.8 11.8 21.1 32.9 94 94 A A H X S+ 0 0 54 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.2 0.880 113.0 47.3 -65.9 -32.5 12.0 21.3 36.7 95 95 A d H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.900 108.9 53.2 -74.7 -38.3 11.6 17.5 36.9 96 96 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.877 106.5 53.7 -62.1 -38.8 14.2 16.9 34.2 97 97 A K H X S+ 0 0 43 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.916 108.5 50.4 -62.3 -39.9 16.6 19.1 36.3 98 98 A R H >< S+ 0 0 69 -4,-1.5 3,-1.2 1,-0.2 4,-0.3 0.935 107.1 54.3 -62.6 -47.2 15.9 16.8 39.3 99 99 A V H >< S+ 0 0 3 -4,-2.5 3,-1.5 1,-0.3 6,-0.3 0.921 108.3 47.2 -53.3 -50.8 16.6 13.7 37.2 100 100 A V H 3< S+ 0 0 3 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.538 92.9 78.2 -73.6 -5.4 20.1 14.8 36.1 101 101 A R T << S+ 0 0 128 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.550 80.7 87.3 -76.3 -10.7 21.0 15.8 39.6 102 102 A D S X S- 0 0 64 -3,-1.5 3,-2.0 -4,-0.3 6,-0.1 -0.588 101.9 -98.3 -84.9 155.5 21.5 12.1 40.2 103 103 A P T 3 S+ 0 0 139 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.745 119.6 59.6 -44.0 -35.8 25.0 10.6 39.5 104 104 A Q T > S- 0 0 115 1,-0.2 3,-1.6 -5,-0.1 -4,-0.1 0.767 82.6-179.1 -66.1 -30.7 24.0 9.2 36.0 105 105 A G G X - 0 0 16 -3,-2.0 3,-1.7 -6,-0.3 -1,-0.2 -0.357 67.4 -8.6 66.9-138.3 23.1 12.7 34.8 106 106 A I G > S+ 0 0 13 1,-0.3 3,-1.7 -6,-0.2 -1,-0.3 0.739 125.5 77.5 -63.0 -23.0 21.8 12.8 31.2 107 107 A R G < + 0 0 119 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.600 67.4 89.2 -64.1 -12.1 22.8 9.1 30.9 108 108 A A G < S+ 0 0 36 -3,-1.7 2,-0.7 -6,-0.1 -1,-0.3 0.786 79.6 67.6 -56.7 -27.0 19.6 8.3 32.9 109 109 A W S X> S- 0 0 21 -3,-1.7 4,-1.1 1,-0.1 3,-1.0 -0.867 72.1-157.9 -99.8 116.9 17.8 8.1 29.5 110 110 A V H 3> S+ 0 0 75 -2,-0.7 4,-2.2 1,-0.3 5,-0.2 0.786 91.5 64.2 -63.1 -29.2 19.0 5.2 27.4 111 111 A A H 3> S+ 0 0 23 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.845 97.5 56.2 -63.8 -32.7 17.8 6.9 24.3 112 112 A W H <>>S+ 0 0 16 -3,-1.0 5,-2.8 -6,-0.2 4,-2.3 0.918 108.1 48.1 -64.8 -40.0 20.4 9.7 24.9 113 113 A R H <5S+ 0 0 99 -4,-1.1 -2,-0.2 3,-0.2 -1,-0.2 0.922 114.9 45.2 -65.2 -43.8 23.1 7.0 24.9 114 114 A N H <5S+ 0 0 94 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.889 131.3 15.2 -69.3 -43.6 21.9 5.4 21.7 115 115 A R H <5S+ 0 0 112 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.514 131.5 30.0-116.6 -1.8 21.3 8.5 19.7 116 116 A b T ><5S+ 0 0 2 -4,-2.3 3,-1.6 -5,-0.3 -3,-0.2 0.707 84.2 100.2-121.8 -45.5 23.0 11.5 21.2 117 117 A Q T 3 + 0 0 18 -2,-1.3 3,-1.4 1,-0.2 4,-0.3 0.340 45.4 103.6 -94.0 9.2 24.4 17.3 18.1 122 122 A R G >> + 0 0 167 1,-0.3 3,-2.0 2,-0.2 4,-1.1 0.843 66.5 72.5 -55.6 -37.9 24.9 20.8 16.8 123 123 A Q G 34 S+ 0 0 127 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.735 85.7 64.5 -50.4 -30.7 22.2 20.3 14.2 124 124 A Y G <4 S+ 0 0 20 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.725 114.9 28.4 -70.7 -22.5 19.5 20.4 16.8 125 125 A V T X4 S+ 0 0 25 -3,-2.0 3,-1.6 -4,-0.3 5,-0.4 0.426 85.9 125.2-118.0 -2.5 20.2 24.1 17.7 126 126 A Q T 3< S+ 0 0 116 -4,-1.1 -120,-0.1 1,-0.2 -3,-0.0 -0.399 82.0 9.0 -65.2 130.9 21.6 25.5 14.5 127 127 A G T 3 S+ 0 0 81 -2,-0.1 -1,-0.2 3,-0.1 -121,-0.0 0.421 97.0 108.2 81.8 4.7 19.8 28.6 13.2 128 128 A a S < S- 0 0 2 -3,-1.6 -2,-0.1 2,-0.1 -118,-0.1 0.490 83.5-121.2 -92.2 -6.5 17.7 29.0 16.4 129 129 A G 0 0 79 1,-0.2 -3,-0.1 -4,-0.2 -4,-0.0 0.799 360.0 360.0 72.3 30.6 19.3 32.1 17.8 130 130 A V 0 0 72 -5,-0.4 -1,-0.2 -117,-0.0 -3,-0.1 -0.727 360.0 360.0-118.3 360.0 20.4 30.5 21.1