==== 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 1WQQ . 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) . 7033.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 68.5 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 . 10 7.7 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 82 0, 0.0 39,-3.0 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 136.7 1.6 20.5 22.1 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.944 360.0-144.5-105.7 108.0 4.1 19.5 19.4 3 3 A F - 0 0 11 35,-2.9 2,-0.3 -2,-0.7 3,-0.0 -0.415 8.6-125.5 -71.9 149.7 6.9 22.1 19.6 4 4 A E > - 0 0 149 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.715 34.6-108.1 -89.1 149.3 8.8 23.3 16.5 5 5 A R H > S+ 0 0 90 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.896 113.8 36.1 -43.9 -65.4 12.6 22.8 16.8 6 6 A a H > S+ 0 0 25 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.847 112.7 60.2 -64.1 -31.1 13.8 26.4 17.3 7 7 A E H > S+ 0 0 65 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.953 109.3 43.7 -60.0 -46.8 10.7 27.3 19.3 8 8 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.882 109.6 56.7 -64.8 -40.6 11.7 24.6 21.9 9 9 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.946 109.7 44.4 -57.6 -48.9 15.4 25.6 21.8 10 10 A R H X S+ 0 0 113 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.902 113.1 52.6 -63.9 -38.4 14.6 29.2 22.8 11 11 A T H X S+ 0 0 23 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.914 109.0 47.6 -63.3 -47.0 12.1 28.0 25.5 12 12 A L H <>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 6,-0.3 0.880 109.8 54.0 -64.4 -37.6 14.6 25.6 27.2 13 13 A K H ><5S+ 0 0 96 -4,-1.9 3,-1.5 -5,-0.3 5,-0.2 0.922 107.8 49.7 -62.2 -41.7 17.3 28.3 27.2 14 14 A R H 3<5S+ 0 0 183 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.860 107.2 55.4 -65.2 -32.7 14.9 30.8 29.0 15 15 A L T 3<5S- 0 0 58 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.335 122.7-107.7 -83.7 6.1 14.1 28.1 31.5 16 16 A G T < 5S+ 0 0 37 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.800 76.7 133.3 74.4 36.2 17.8 27.8 32.3 17 17 A M > < + 0 0 0 -5,-2.3 3,-1.8 2,-0.1 2,-0.6 0.694 35.3 106.9 -90.1 -19.7 18.6 24.4 30.7 18 18 A D T 3 S- 0 0 81 -6,-0.3 6,-0.2 1,-0.3 4,-0.1 -0.466 102.6 -7.6 -66.8 108.7 21.8 25.5 28.8 19 19 A G T > S+ 0 0 41 4,-1.8 3,-2.0 -2,-0.6 -1,-0.3 0.565 86.1 165.9 84.5 10.5 24.7 24.0 30.7 20 20 A Y B X S-B 23 0B 56 -3,-1.8 3,-2.0 3,-0.8 -1,-0.3 -0.429 79.5 -10.8 -63.1 121.3 22.5 22.7 33.6 21 21 A R T 3 S- 0 0 154 1,-0.3 -1,-0.3 -2,-0.3 85,-0.2 0.866 134.5 -54.1 53.2 39.2 24.7 20.2 35.5 22 22 A G T < S+ 0 0 77 -3,-2.0 2,-0.7 1,-0.2 -1,-0.3 0.516 107.1 132.0 76.4 7.8 27.2 20.4 32.6 23 23 A I B < -B 20 0B 11 -3,-2.0 -4,-1.8 -6,-0.1 -3,-0.8 -0.829 49.9-138.4 -99.8 117.1 24.6 19.5 30.0 24 24 A S >> - 0 0 47 -2,-0.7 4,-1.4 -5,-0.2 3,-1.0 -0.223 22.6-112.5 -68.0 156.9 24.5 21.7 26.9 25 25 A L H 3> S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.906 115.2 60.3 -56.0 -43.1 21.2 22.9 25.4 26 26 A A H 3> S+ 0 0 11 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.771 102.4 52.6 -58.6 -28.2 21.9 20.7 22.2 27 27 A N H <> S+ 0 0 31 -3,-1.0 4,-2.5 2,-0.2 -1,-0.3 0.878 108.5 49.6 -74.3 -39.7 21.9 17.6 24.3 28 28 A W H X S+ 0 0 0 -4,-1.4 4,-2.5 -3,-0.4 -2,-0.2 0.885 111.8 49.6 -64.8 -39.2 18.6 18.5 25.9 29 29 A M H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.923 110.1 49.9 -66.3 -41.7 17.2 19.0 22.4 30 30 A b H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.924 111.6 49.7 -62.6 -43.3 18.6 15.7 21.2 31 31 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.938 112.0 46.1 -60.3 -50.5 17.0 14.0 24.2 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 6,-1.5 0.859 110.4 55.7 -61.6 -38.5 13.5 15.6 23.6 33 33 A K H X5S+ 0 0 70 -4,-2.4 4,-1.1 4,-0.2 -1,-0.2 0.958 115.4 35.2 -59.1 -53.2 13.7 14.8 19.9 34 34 A W H <5S+ 0 0 94 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.764 118.0 51.5 -76.1 -25.9 14.3 11.0 20.4 35 35 A E H <5S- 0 0 41 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.934 137.5 -11.9 -76.9 -45.2 12.1 10.6 23.5 36 36 A S H <5S- 0 0 19 -4,-1.9 3,-0.3 20,-0.4 -3,-0.2 0.428 83.9-109.9-137.7 -2.0 8.9 12.3 22.2 37 37 A G S < -A 2 0A 41 -7,-0.3 3,-1.1 -3,-0.3 -37,-0.2 -0.894 39.3-162.9-106.8 117.2 5.5 16.3 21.9 40 40 A T T 3 S+ 0 0 2 -39,-3.0 16,-0.3 -2,-0.6 -1,-0.1 0.719 87.4 51.2 -70.8 -22.3 4.3 17.2 25.4 41 41 A R T 3 S+ 0 0 180 -40,-0.3 -1,-0.2 14,-0.2 2,-0.1 0.352 76.1 131.8-100.1 11.4 1.4 14.7 25.6 42 42 A A < - 0 0 19 -3,-1.1 13,-2.1 12,-0.1 2,-0.4 -0.372 31.7-178.3 -66.6 132.3 3.4 11.6 24.6 43 43 A T E -C 54 0C 76 11,-0.2 2,-0.4 -2,-0.1 11,-0.2 -0.977 9.9-172.0-131.9 144.3 2.8 8.6 26.9 44 44 A N E -C 53 0C 93 9,-1.8 9,-2.5 -2,-0.4 2,-0.4 -0.900 12.5-150.0-144.5 110.2 4.3 5.2 26.8 45 45 A Y E -C 52 0C 125 -2,-0.4 2,-0.9 7,-0.2 7,-0.2 -0.664 8.8-148.5 -79.5 128.5 3.2 2.3 28.9 46 46 A N E >>> -C 51 0C 47 5,-3.3 4,-1.4 -2,-0.4 3,-1.3 -0.838 10.9-170.5-100.9 91.2 6.0 -0.2 29.7 47 47 A A T 345S+ 0 0 76 -2,-0.9 -1,-0.2 1,-0.2 5,-0.0 0.791 77.9 67.4 -51.5 -33.5 4.2 -3.5 30.0 48 48 A G T 345S+ 0 0 86 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.776 121.2 11.3 -61.6 -32.9 7.3 -5.2 31.4 49 49 A D T <45S- 0 0 67 -3,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.285 99.8-114.4-131.3 8.1 7.3 -3.4 34.7 50 50 A R T <5S+ 0 0 164 -4,-1.4 2,-0.2 1,-0.2 -3,-0.2 0.640 73.5 125.3 67.1 21.6 3.9 -1.6 34.8 51 51 A S E < -C 46 0C 0 -5,-0.9 -5,-3.3 19,-0.1 2,-0.3 -0.651 47.5-144.6-105.0 166.0 5.4 1.9 34.6 52 52 A T E -C 45 0C 9 -7,-0.2 9,-2.1 -2,-0.2 2,-0.4 -0.973 7.5-136.9-133.7 142.8 4.6 4.7 32.2 53 53 A D E -CD 44 60C 28 -9,-2.5 -9,-1.8 -2,-0.3 2,-0.4 -0.866 27.9-153.7 -97.2 131.8 6.9 7.4 30.6 54 54 A F E > -CD 43 59C 21 5,-2.2 5,-2.1 -2,-0.4 3,-0.4 -0.919 31.7 -30.9-120.3 136.0 5.2 10.8 30.5 55 55 A G T > 5S- 0 0 0 -13,-2.1 3,-0.9 -2,-0.4 -14,-0.2 -0.068 98.3 -21.3 74.7-162.5 5.6 13.9 28.3 56 56 A I T 3 5S+ 0 0 2 28,-0.3 -20,-0.4 -16,-0.3 -18,-0.3 0.814 140.4 33.7 -59.0 -36.1 8.3 15.7 26.3 57 57 A F T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.1 -2,-0.2 0.401 105.5-125.2-101.7 0.6 11.2 14.1 28.2 58 58 A Q T < 5 - 0 0 10 -3,-0.9 2,-0.4 -4,-0.2 -3,-0.2 0.958 35.0-165.5 53.6 59.5 9.4 10.8 28.8 59 59 A I E < -D 54 0C 3 -5,-2.1 -5,-2.2 25,-0.1 2,-0.2 -0.622 17.0-118.2 -82.3 128.4 9.9 10.8 32.5 60 60 A N E >>> -D 53 0C 28 -2,-0.4 4,-2.1 -7,-0.2 3,-0.8 -0.480 5.9-145.2 -74.6 135.1 9.3 7.5 34.3 61 61 A S T 345S+ 0 0 0 -9,-2.1 6,-0.3 -2,-0.2 7,-0.1 0.607 90.3 73.7 -71.6 -15.6 6.5 7.0 36.9 62 62 A R T 345S+ 0 0 43 11,-0.2 12,-2.8 -10,-0.2 -1,-0.2 0.853 120.6 3.5 -69.4 -31.3 8.6 4.5 39.0 63 63 A Y T <45S+ 0 0 124 -3,-0.8 13,-2.7 10,-0.2 -2,-0.2 0.713 131.0 41.4-123.0 -33.4 10.9 7.2 40.4 64 64 A W T <5S+ 0 0 32 -4,-2.1 13,-2.0 11,-0.2 15,-0.4 0.809 109.1 17.4 -97.1 -35.6 9.9 10.7 39.3 65 65 A c S S- 0 0 13 -9,-0.1 3,-1.1 -18,-0.0 -19,-0.1 -0.805 73.7-124.7 -93.6 121.2 2.9 2.1 39.4 71 71 A P T 3 S- 0 0 64 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.373 86.1 -2.2 -62.9 136.8 4.0 -0.7 41.9 72 72 A G T 3 S+ 0 0 80 1,-0.2 2,-0.2 -2,-0.1 -10,-0.0 0.759 95.9 157.8 52.2 36.3 6.8 0.3 44.3 73 73 A A < - 0 0 35 -3,-1.1 2,-0.3 -5,-0.1 -10,-0.2 -0.562 29.9-156.1 -95.7 151.5 7.1 3.8 42.9 74 74 A V - 0 0 89 -12,-2.8 -9,-0.2 -2,-0.2 2,-0.2 -0.718 14.2-137.3-115.4 169.1 8.5 6.9 44.5 75 75 A N > + 0 0 51 -2,-0.3 3,-1.3 1,-0.1 -11,-0.2 -0.612 31.4 162.8-130.4 70.7 7.7 10.6 43.5 76 76 A A T 3 S+ 0 0 22 -13,-2.7 -12,-0.2 1,-0.3 -11,-0.1 0.810 79.0 49.2 -60.7 -35.3 11.1 12.4 43.6 77 77 A d T 3 S- 0 0 21 -13,-2.0 -1,-0.3 -14,-0.1 -12,-0.1 0.545 104.4-133.2 -82.2 -4.9 9.8 15.4 41.6 78 78 A H < + 0 0 155 -3,-1.3 2,-0.3 1,-0.2 -13,-0.1 0.925 63.3 124.6 51.3 53.3 6.9 15.6 43.9 79 79 A L - 0 0 36 -15,-0.4 -13,-2.6 16,-0.0 2,-0.3 -0.960 68.7-115.8-139.1 149.6 4.5 15.9 41.0 80 80 A S B > -e 66 0D 69 -2,-0.3 3,-1.6 -15,-0.2 4,-0.4 -0.674 35.7-121.3 -78.1 144.0 1.4 14.1 39.7 81 81 A c G > S+ 0 0 1 -15,-2.2 3,-1.6 -2,-0.3 -14,-0.1 0.766 109.6 75.0 -60.5 -21.2 2.4 12.6 36.3 82 82 A S G > S+ 0 0 84 -16,-0.4 3,-1.9 1,-0.3 -1,-0.3 0.845 84.1 65.9 -57.8 -34.2 -0.5 14.7 34.9 83 83 A A G X S+ 0 0 17 -3,-1.6 3,-0.8 1,-0.3 9,-0.3 0.756 93.5 59.5 -60.9 -24.9 1.8 17.8 35.3 84 84 A L G < S+ 0 0 3 -3,-1.6 -28,-0.3 -4,-0.4 -1,-0.3 0.236 97.0 61.5 -89.8 12.0 4.1 16.3 32.7 85 85 A L G < S+ 0 0 58 -3,-1.9 -1,-0.2 -30,-0.1 -2,-0.2 0.243 79.7 111.7-117.0 6.2 1.4 16.3 30.0 86 86 A Q S < S- 0 0 87 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.335 73.5-126.3 -76.9 162.8 0.7 20.1 30.0 87 87 A D S S+ 0 0 102 -2,-0.1 2,-0.7 -46,-0.0 -1,-0.1 0.815 98.6 76.6 -76.4 -35.0 1.5 22.4 27.1 88 88 A N S S- 0 0 106 1,-0.1 3,-0.4 -48,-0.0 4,-0.3 -0.723 71.9-161.4 -77.7 118.9 3.5 24.6 29.4 89 89 A I > + 0 0 6 -2,-0.7 4,-2.4 1,-0.2 5,-0.2 0.337 59.0 107.1 -88.2 11.7 6.7 22.7 30.0 90 90 A A H > S+ 0 0 40 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.906 83.8 42.6 -54.8 -48.8 7.8 24.5 33.2 91 91 A D H > S+ 0 0 61 -3,-0.4 4,-2.0 -8,-0.2 -1,-0.2 0.888 113.0 53.2 -67.4 -40.4 7.0 21.5 35.5 92 92 A A H > S+ 0 0 8 -9,-0.3 4,-2.3 -4,-0.3 -1,-0.2 0.870 110.5 47.6 -61.2 -38.1 8.6 19.0 33.1 93 93 A V H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.882 109.5 52.3 -70.8 -41.2 11.8 21.1 33.0 94 94 A A H X S+ 0 0 56 -4,-2.1 4,-1.3 -5,-0.2 -2,-0.2 0.873 113.3 45.6 -62.6 -35.7 11.9 21.4 36.8 95 95 A d H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.887 109.1 53.5 -75.0 -38.3 11.6 17.5 37.0 96 96 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.889 106.7 54.5 -62.1 -36.5 14.2 16.9 34.3 97 97 A K H X S+ 0 0 43 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.914 106.8 50.8 -62.5 -41.2 16.5 19.1 36.3 98 98 A R H >< S+ 0 0 68 -4,-1.3 3,-0.8 1,-0.2 4,-0.3 0.896 106.6 55.0 -62.6 -43.3 15.9 16.8 39.4 99 99 A V H >< S+ 0 0 3 -4,-2.1 3,-1.5 1,-0.2 6,-0.3 0.937 108.7 46.0 -56.4 -51.6 16.7 13.7 37.3 100 100 A V H 3< S+ 0 0 2 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.553 94.6 77.0 -71.9 -7.0 20.1 14.9 36.2 101 101 A R T << S+ 0 0 114 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.583 82.1 85.9 -77.2 -10.7 21.0 16.0 39.7 102 102 A D S X S- 0 0 63 -3,-1.5 3,-2.4 -4,-0.3 6,-0.1 -0.611 102.9 -96.3 -85.8 155.7 21.5 12.2 40.4 103 103 A P T 3 S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.728 119.7 59.5 -42.9 -37.7 25.0 10.7 39.7 104 104 A Q T > S- 0 0 114 1,-0.2 3,-1.8 -5,-0.1 -4,-0.1 0.724 81.8-178.2 -66.9 -25.4 24.0 9.3 36.3 105 105 A G G X - 0 0 16 -3,-2.4 3,-1.6 -6,-0.3 -1,-0.2 -0.293 67.9 -7.9 62.7-139.0 23.2 12.8 34.9 106 106 A I G > S+ 0 0 13 1,-0.3 3,-1.4 -85,-0.2 -1,-0.3 0.699 124.5 78.5 -62.4 -19.8 21.9 12.8 31.3 107 107 A R G < + 0 0 116 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.611 67.3 87.1 -67.2 -12.1 22.8 9.0 31.1 108 108 A A G < S+ 0 0 36 -3,-1.6 2,-0.8 -6,-0.1 -1,-0.3 0.821 79.4 70.4 -57.9 -31.2 19.6 8.1 33.0 109 109 A W S X> S- 0 0 19 -3,-1.4 4,-1.1 1,-0.2 3,-1.1 -0.800 71.3-159.3 -92.4 114.6 17.9 8.1 29.7 110 110 A V H 3> S+ 0 0 79 -2,-0.8 4,-2.0 1,-0.3 3,-0.3 0.869 90.5 63.9 -60.1 -34.2 19.0 5.2 27.6 111 111 A A H 3> S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.837 97.6 56.7 -59.2 -32.8 17.8 6.9 24.4 112 112 A W H <>>S+ 0 0 16 -3,-1.1 5,-2.5 -6,-0.2 4,-2.3 0.910 106.7 48.6 -64.8 -42.5 20.4 9.6 25.0 113 113 A R H <5S+ 0 0 100 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.924 116.3 43.7 -62.6 -43.0 23.2 7.0 25.1 114 114 A N H <5S+ 0 0 95 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.903 130.4 18.5 -69.2 -48.0 21.9 5.4 21.8 115 115 A R H <5S+ 0 0 110 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.552 132.8 26.9-106.9 -8.4 21.2 8.5 19.8 116 116 A b T ><5S+ 0 0 2 -4,-2.3 3,-1.8 -5,-0.3 -3,-0.2 0.711 83.6 101.8-123.4 -39.3 23.1 11.5 21.3 117 117 A Q T 3 + 0 0 18 -2,-1.2 3,-1.5 1,-0.2 4,-0.4 0.368 47.0 102.4 -90.6 5.0 24.4 17.2 18.2 122 122 A R G >> + 0 0 172 1,-0.3 3,-1.8 2,-0.2 4,-1.1 0.848 67.0 71.3 -56.4 -36.9 24.9 20.8 16.9 123 123 A Q G 34 S+ 0 0 129 -3,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.749 86.8 65.7 -51.8 -30.6 22.2 20.3 14.2 124 124 A Y G <4 S+ 0 0 21 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.782 113.8 28.4 -66.0 -28.4 19.5 20.4 16.9 125 125 A V T X4 S+ 0 0 24 -3,-1.8 3,-1.7 -4,-0.4 5,-0.4 0.434 87.0 129.0-113.7 -0.3 20.2 24.0 17.7 126 126 A Q T 3< S+ 0 0 110 -4,-1.1 -120,-0.1 1,-0.2 -3,-0.0 -0.330 80.2 6.0 -64.3 130.3 21.5 25.4 14.4 127 127 A G T 3 S+ 0 0 81 3,-0.1 -1,-0.2 -2,-0.1 -4,-0.0 0.408 97.5 110.6 80.5 2.9 19.8 28.6 13.2 128 128 A a S < S- 0 0 2 -3,-1.7 -2,-0.1 2,-0.1 -118,-0.1 0.508 82.0-123.1 -87.1 -7.6 17.7 29.0 16.4 129 129 A G 0 0 81 1,-0.2 -3,-0.1 -4,-0.2 -1,-0.0 0.803 360.0 360.0 70.4 30.6 19.4 32.1 17.8 130 130 A V 0 0 71 -5,-0.4 -1,-0.2 -117,-0.0 -2,-0.1 -0.847 360.0 360.0-115.7 360.0 20.3 30.4 21.1