==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-MAY-12 4EYZ . COMPND 2 MOLECULE: CELLULOSOME-RELATED PROTEIN MODULE FROM RUMINOCOC . SOURCE 2 ORGANISM_SCIENTIFIC: RUMINOCOCCUS FLAVEFACIENS; . AUTHOR F.FROLOW,M.VORONOV-GOLDMAN,E.BAYER,R.LAMED . 492 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19358.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 293 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 22 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 21.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 4 3 3 1 3 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 . 6 4 2 2 0 4 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 2 0 0 2 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 23 A M 0 0 205 0, 0.0 2,-0.3 0, 0.0 162,-0.1 0.000 360.0 360.0 360.0 161.6 -0.9 -26.3 31.7 2 24 A A - 0 0 31 160,-0.4 2,-0.5 156,-0.1 422,-0.1 -0.504 360.0-135.4 -69.4 124.9 0.3 -25.7 35.2 3 25 A S - 0 0 39 -2,-0.3 2,-0.4 420,-0.2 149,-0.4 -0.689 12.2-137.1 -85.0 128.0 4.1 -25.8 35.4 4 26 A X - 0 0 42 -2,-0.5 3,-0.5 147,-0.1 2,-0.2 -0.705 14.0-144.3 -82.6 129.5 5.6 -27.7 38.2 5 27 A Y B S+A 150 0A 36 145,-3.1 145,-1.7 -2,-0.4 4,-0.1 -0.624 85.0 21.6 -90.0 154.9 8.5 -26.0 40.0 6 28 A N S > S+ 0 0 49 -2,-0.2 3,-1.9 143,-0.2 -1,-0.2 0.914 79.5 170.7 52.3 45.8 11.4 -28.2 41.3 7 29 A S T 3 + 0 0 72 -3,-0.5 -1,-0.1 1,-0.3 142,-0.1 0.764 69.1 50.7 -65.2 -22.5 10.2 -30.8 38.8 8 30 A D T 3 S+ 0 0 158 140,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.429 102.0 76.6 -92.3 6.2 13.2 -33.0 39.3 9 31 A G S < S- 0 0 12 -3,-1.9 2,-0.3 138,-0.2 139,-0.2 0.519 85.3 -67.1 -90.0-133.3 12.9 -33.1 43.1 10 32 A W B -b 148 0B 110 137,-1.5 139,-2.4 136,-0.6 -1,-0.1 -0.914 29.9-119.6-133.1 151.9 10.6 -34.9 45.5 11 33 A Y > - 0 0 16 -2,-0.3 4,-2.6 137,-0.2 5,-0.2 -0.447 40.7-103.7 -81.2 162.3 7.0 -35.0 46.6 12 34 A X H > S+ 0 0 1 229,-2.2 4,-2.6 1,-0.2 5,-0.2 0.892 121.5 51.2 -55.3 -45.0 6.1 -34.3 50.2 13 35 A G H > S+ 0 0 5 229,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.903 111.0 48.5 -61.2 -42.3 5.5 -38.0 51.0 14 36 A E H > S+ 0 0 79 228,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.903 111.0 50.7 -63.9 -42.8 8.9 -38.8 49.6 15 37 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.905 110.3 48.8 -62.7 -43.6 10.6 -36.0 51.5 16 38 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.923 109.2 53.5 -62.1 -42.3 9.0 -37.1 54.8 17 39 A N H <>S+ 0 0 39 -4,-2.3 5,-2.7 -5,-0.2 6,-0.4 0.925 112.1 44.9 -56.8 -44.0 10.1 -40.7 54.1 18 40 A X H ><5S+ 0 0 71 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.926 111.7 51.2 -65.5 -45.7 13.7 -39.4 53.6 19 41 A A H 3<5S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.843 107.8 54.7 -59.6 -33.9 13.5 -37.2 56.7 20 42 A S T 3<5S- 0 0 0 -4,-2.3 3,-0.5 -5,-0.2 -1,-0.3 0.405 114.6-117.8 -79.2 0.5 12.3 -40.2 58.7 21 43 A L T < 5S- 0 0 148 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.887 72.6 -57.2 56.9 42.8 15.4 -42.2 57.6 22 44 A N S - 0 0 79 1,-0.1 4,-2.2 -14,-0.1 -1,-0.2 -0.374 22.6-136.9 -65.1 134.1 1.8 -43.6 51.6 28 50 A L H > S+ 0 0 31 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.917 100.9 51.4 -58.3 -48.4 -0.8 -41.5 49.9 29 51 A G H > S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.906 111.3 47.2 -60.3 -41.8 -3.7 -43.9 50.3 30 52 A K H > S+ 0 0 114 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.899 111.7 51.2 -66.3 -38.9 -3.1 -44.3 54.0 31 53 A W H X S+ 0 0 9 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.919 110.5 49.1 -61.9 -44.9 -2.9 -40.5 54.4 32 54 A Q H X S+ 0 0 47 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.902 111.3 49.2 -61.4 -41.4 -6.2 -40.1 52.5 33 55 A N H X S+ 0 0 98 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.897 110.5 51.0 -63.6 -42.0 -7.8 -42.7 54.7 34 56 A F H X S+ 0 0 9 -4,-2.5 4,-3.3 2,-0.2 5,-0.3 0.919 109.4 50.7 -60.4 -45.7 -6.5 -40.9 57.8 35 57 A I H X S+ 0 0 1 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.939 110.3 49.1 -58.6 -46.5 -7.9 -37.6 56.5 36 58 A D H < S+ 0 0 67 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.924 117.7 41.1 -58.6 -43.4 -11.3 -39.2 56.0 37 59 A D H >X S+ 0 0 99 -4,-2.3 4,-1.7 1,-0.2 3,-0.7 0.926 116.9 44.9 -72.3 -45.5 -11.3 -40.8 59.4 38 60 A Y H 3< S+ 0 0 45 -4,-3.3 6,-0.5 1,-0.3 7,-0.4 0.548 108.7 55.8 -89.3 -4.4 -9.8 -37.9 61.4 39 61 A T T 3< S+ 0 0 25 -4,-1.6 -1,-0.3 -5,-0.3 186,-0.2 0.605 114.6 42.3 -85.2 -15.7 -12.0 -35.2 59.8 40 62 A S T <4 S+ 0 0 84 -3,-0.7 -2,-0.2 -4,-0.5 -3,-0.1 0.735 104.8 67.3-102.4 -29.5 -15.1 -37.2 60.9 41 63 A N S < S- 0 0 55 -4,-1.7 4,-0.4 -5,-0.1 3,-0.3 -0.023 93.7-101.7 -84.1-169.8 -14.2 -38.3 64.4 42 64 A D S S+ 0 0 119 1,-0.2 -4,-0.1 2,-0.1 -1,-0.1 0.061 92.4 98.6-106.3 26.9 -13.9 -36.0 67.4 43 65 A Y S S+ 0 0 34 16,-0.1 17,-2.5 -5,-0.1 18,-0.3 0.889 104.3 2.3 -79.3 -40.8 -10.1 -35.8 67.6 44 66 A Y S > S+ 0 0 0 -6,-0.5 3,-2.4 -3,-0.3 15,-0.3 0.759 103.6 96.8-112.1 -47.3 -9.6 -32.5 65.8 45 67 A K T 3 S+ 0 0 81 -4,-0.4 179,-0.2 -7,-0.4 -6,-0.0 -0.251 92.3 22.7 -55.7 126.3 -13.0 -31.0 64.9 46 68 A G T 3 S+ 0 0 43 177,-1.1 -1,-0.3 1,-0.4 178,-0.1 0.219 82.9 137.3 99.6 -13.4 -14.1 -28.5 67.6 47 69 A T < - 0 0 1 -3,-2.4 176,-0.4 176,-0.2 -1,-0.4 -0.487 62.5-108.6 -64.1 130.0 -10.6 -27.7 68.8 48 70 A P - 0 0 31 0, 0.0 37,-2.5 0, 0.0 2,-0.5 -0.352 20.8-129.0 -61.3 139.0 -10.4 -23.9 69.3 49 71 A Y B -c 85 0C 31 35,-0.2 2,-0.3 172,-0.2 37,-0.2 -0.795 36.3-175.3 -81.4 124.9 -8.4 -21.9 66.8 50 72 A I - 0 0 4 35,-2.8 2,-1.8 -2,-0.5 5,-0.2 -0.949 33.1-117.0-131.3 148.5 -6.1 -19.7 68.9 51 73 A D S S+ 0 0 127 25,-0.5 2,-0.4 -2,-0.3 35,-0.1 -0.412 76.4 105.2 -88.1 62.4 -3.6 -17.0 68.1 52 74 A W > - 0 0 32 -2,-1.8 3,-2.2 1,-0.1 -2,-0.2 -0.956 63.9-144.0-135.3 121.9 -0.3 -18.6 69.3 53 75 A V T 3 S+ 0 0 56 -2,-0.4 36,-0.3 1,-0.3 33,-0.2 0.755 97.9 52.9 -60.9 -25.4 1.9 -19.8 66.5 54 76 A F T 3 S+ 0 0 27 31,-0.1 2,-0.4 34,-0.1 -1,-0.3 0.434 74.3 127.9 -92.8 3.1 3.1 -22.8 68.5 55 77 A A < + 0 0 0 -3,-2.2 31,-2.0 -5,-0.2 34,-0.2 -0.453 16.6 147.4 -66.0 120.6 -0.4 -24.1 69.4 56 78 A S E +D 85 0C 0 -2,-0.4 29,-0.2 29,-0.2 7,-0.2 -0.152 26.5 115.8-150.4 39.4 -0.5 -27.8 68.4 57 79 A S E -D 84 0C 0 27,-2.3 27,-2.6 5,-0.1 5,-0.2 -0.811 42.6-168.8-123.8 85.9 -2.8 -29.5 70.9 58 80 A P > - 0 0 0 0, 0.0 3,-2.5 0, 0.0 -14,-0.2 -0.260 41.6 -98.8 -69.3 164.0 -6.0 -30.9 69.4 59 81 A K T 3 S+ 0 0 47 -15,-0.3 3,-0.5 1,-0.3 -15,-0.2 0.868 126.3 53.7 -45.4 -43.4 -8.9 -32.2 71.5 60 82 A G T 3 S+ 0 0 40 -17,-2.5 -1,-0.3 1,-0.3 -16,-0.1 0.538 123.0 24.9 -74.0 -6.6 -7.5 -35.7 71.0 61 83 A D < + 0 0 29 -3,-2.5 2,-1.6 -18,-0.3 3,-0.3 -0.536 65.3 175.2-159.3 75.9 -4.0 -34.8 72.3 62 84 A R > + 0 0 109 -3,-0.5 3,-1.6 1,-0.2 4,-0.2 -0.182 26.3 145.6 -84.8 48.5 -4.1 -31.8 74.6 63 85 A W G > + 0 0 9 -2,-1.6 3,-1.7 1,-0.3 -1,-0.2 0.792 59.0 58.3 -68.8 -32.3 -0.5 -32.1 75.4 64 86 A Q G > S+ 0 0 0 -3,-0.3 3,-0.8 1,-0.3 -1,-0.3 0.662 95.3 66.8 -74.7 -11.4 0.5 -28.4 75.8 65 87 A X G < S+ 0 0 7 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.581 99.0 54.5 -78.0 -7.5 -2.1 -28.0 78.5 66 88 A N G < S+ 0 0 136 -3,-1.7 2,-0.2 -4,-0.2 -1,-0.2 0.245 106.7 51.8-110.5 8.3 0.1 -30.4 80.6 67 89 A E S X S- 0 0 55 -3,-0.8 3,-2.4 -4,-0.1 4,-0.2 -0.781 106.3 -78.6-134.8-180.0 3.5 -28.5 80.4 68 90 A W T > S+ 0 0 137 1,-0.3 3,-1.3 -2,-0.2 4,-0.3 0.702 117.1 78.0 -59.5 -21.5 4.6 -24.9 81.0 69 91 A S T 3> + 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.596 68.3 90.8 -56.7 -17.2 3.1 -23.9 77.6 70 92 A V H <> S+ 0 0 22 -3,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.839 78.6 59.4 -54.9 -34.2 -0.3 -23.9 79.3 71 93 A S H <> S+ 0 0 69 -3,-1.3 4,-1.7 1,-0.2 -1,-0.2 0.942 108.5 42.0 -62.5 -48.0 0.1 -20.2 80.2 72 94 A E H > S+ 0 0 64 -3,-0.4 4,-1.1 -4,-0.3 -1,-0.2 0.887 113.9 54.0 -65.3 -37.6 0.5 -19.1 76.6 73 95 A X H <>S+ 0 0 0 -4,-2.2 5,-2.9 1,-0.2 3,-0.5 0.934 108.4 48.5 -60.0 -47.2 -2.3 -21.4 75.5 74 96 A L H ><5S+ 0 0 78 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.853 102.3 62.7 -64.8 -36.5 -4.8 -20.0 78.0 75 97 A K H 3<5S+ 0 0 149 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.866 109.7 39.2 -57.1 -38.5 -4.1 -16.4 77.2 76 98 A V T 3<5S- 0 0 53 -4,-1.1 -25,-0.5 -3,-0.5 -1,-0.3 0.311 131.9 -81.5-103.2 7.8 -5.3 -16.8 73.6 77 99 A G T < 5S+ 0 0 38 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.507 74.2 148.0 111.4 7.0 -8.3 -19.1 74.3 78 100 A G < - 0 0 4 -5,-2.9 2,-0.3 -6,-0.2 -1,-0.3 -0.406 31.9-153.5 -64.2 149.0 -6.9 -22.6 74.7 79 101 A T B > -E 83 0D 42 4,-2.1 4,-2.2 1,-0.1 -14,-0.1 -0.912 26.8-128.7-127.7 156.0 -8.9 -24.7 77.1 80 102 A Y T 4 S+ 0 0 121 -2,-0.3 -1,-0.1 1,-0.2 -18,-0.1 0.850 111.8 51.1 -66.3 -30.2 -8.1 -27.7 79.4 81 103 A E T 4 S+ 0 0 139 1,-0.1 -1,-0.2 2,-0.1 -19,-0.1 0.829 129.6 10.8 -77.2 -34.0 -11.2 -29.4 77.9 82 104 A E T 4 S- 0 0 69 1,-0.3 -23,-0.2 -21,-0.0 -2,-0.2 0.374 87.3-144.3-132.6 2.4 -10.4 -28.9 74.2 83 105 A G B < -E 79 0D 0 -4,-2.2 -4,-2.1 -36,-0.1 -1,-0.3 -0.393 25.6-101.1 72.2-141.6 -6.8 -27.7 73.8 84 106 A G E - D 0 57C 0 -27,-2.6 -27,-2.3 -6,-0.2 2,-0.3 -0.818 26.2-160.2 176.2 144.0 -6.0 -25.3 71.0 85 107 A L E -cD 49 56C 0 -37,-2.5 -35,-2.8 -2,-0.2 2,-0.3 -0.954 5.8-161.0-134.0 150.4 -4.5 -25.1 67.5 86 108 A N > - 0 0 6 -31,-2.0 4,-2.4 -2,-0.3 5,-0.2 -0.755 45.6 -93.4-119.0 173.0 -3.0 -22.6 65.2 87 109 A X H > S+ 0 0 17 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.901 120.8 35.1 -63.2 -50.6 -2.7 -23.2 61.5 88 110 A X H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.856 116.3 57.0 -69.7 -35.0 0.8 -24.7 61.1 89 111 A G H > S+ 0 0 0 -36,-0.3 4,-2.4 -34,-0.2 -2,-0.2 0.884 107.2 48.9 -62.9 -38.7 0.5 -26.4 64.4 90 112 A F H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.943 112.4 45.7 -63.4 -50.6 -2.6 -28.2 63.2 91 113 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 5,-0.3 0.925 113.6 51.3 -63.7 -38.3 -1.0 -29.3 59.9 92 114 A W H X S+ 0 0 6 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.952 113.6 43.7 -58.2 -50.9 2.1 -30.4 61.8 93 115 A H H X S+ 0 0 1 -4,-2.4 4,-3.4 1,-0.2 5,-0.3 0.935 113.0 51.1 -63.7 -46.5 0.0 -32.5 64.2 94 116 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.920 114.0 43.6 -59.2 -46.8 -2.2 -34.0 61.6 95 117 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.953 116.3 47.5 -63.8 -46.5 0.7 -35.1 59.4 96 118 A A H X S+ 0 0 1 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.908 112.9 48.9 -60.6 -42.3 2.6 -36.4 62.5 97 119 A K H X S+ 0 0 42 -4,-3.4 4,-2.8 -5,-0.2 -1,-0.2 0.924 109.9 51.6 -65.8 -43.2 -0.4 -38.2 63.8 98 120 A G H X S+ 0 0 8 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.922 110.3 49.0 -58.3 -42.2 -1.1 -39.8 60.4 99 121 A L H X S+ 0 0 5 -4,-2.5 4,-2.4 1,-0.2 6,-0.4 0.870 110.9 50.7 -66.5 -35.8 2.5 -41.0 60.2 100 122 A S H X S+ 0 0 18 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.911 110.6 48.2 -65.5 -44.5 2.1 -42.4 63.8 101 123 A V H < S+ 0 0 78 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.930 116.2 44.6 -60.9 -43.3 -1.1 -44.2 62.8 102 124 A E H < S+ 0 0 39 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.892 125.0 30.0 -68.9 -41.6 0.6 -45.6 59.6 103 125 A S H < S- 0 0 43 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.683 94.8-125.8 -95.1 -24.1 3.9 -46.7 61.2 104 126 A G < + 0 0 69 -4,-2.4 -4,-0.1 1,-0.3 2,-0.1 0.425 67.2 132.5 83.1 -0.6 3.0 -47.5 64.8 105 127 A L - 0 0 44 -6,-0.4 -1,-0.3 -5,-0.2 -2,-0.1 -0.479 67.0 -94.9 -78.7 156.0 5.7 -45.1 66.0 106 128 A D >> - 0 0 102 -2,-0.1 4,-2.0 1,-0.1 3,-1.3 -0.428 27.7-122.9 -67.7 145.6 4.9 -42.6 68.7 107 129 A I H 3> S+ 0 0 20 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.785 111.1 67.6 -59.5 -27.1 3.8 -39.1 67.5 108 130 A S H 34 S+ 0 0 50 1,-0.2 20,-0.5 2,-0.2 -1,-0.3 0.864 108.2 39.0 -63.4 -30.1 6.7 -37.7 69.6 109 131 A Q H X4 S+ 0 0 66 -3,-1.3 3,-1.5 2,-0.1 -2,-0.2 0.917 115.2 49.5 -80.8 -47.8 9.0 -39.4 67.1 110 132 A T H >< S+ 0 0 0 -4,-2.0 3,-2.1 1,-0.3 -2,-0.2 0.809 98.6 67.6 -68.4 -27.5 7.1 -38.8 63.9 111 133 A G G >< S+ 0 0 0 -4,-2.3 3,-1.3 1,-0.3 19,-0.7 0.757 89.0 67.5 -59.9 -23.7 6.7 -35.1 64.6 112 134 A Q G < S+ 0 0 91 -3,-1.5 19,-0.4 1,-0.2 -1,-0.3 0.577 96.9 54.4 -72.1 -8.4 10.4 -34.8 64.1 113 135 A Y G < S+ 0 0 29 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.2 0.293 98.5 74.4-106.1 8.2 9.9 -35.7 60.4 114 136 A V S < S- 0 0 0 -3,-1.3 16,-2.4 -4,-0.1 24,-0.1 -0.972 80.0-120.5-128.3 132.8 7.4 -32.9 59.7 115 137 A P + 0 0 0 0, 0.0 16,-0.1 0, 0.0 24,-0.1 -0.347 43.8 143.7 -73.0 155.3 8.1 -29.2 59.3 116 138 A F - 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