==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-OCT-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-MAR-13 4JHO . COMPND 2 MOLECULE: BETA-MANNOSIDASE/BETA-GLUCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYZA SATIVA INDICA GROUP; . AUTHOR A.TANKRATHOK,S.LUANG,R.C.ROBINSON,A.KIMURA,M.HRMOVA,J.R.KETU . 483 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18013.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 27 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 31.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.5 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 5 0 0 4 0 2 1 0 0 1 2 0 2 0 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 4 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 PARALLEL BRIDGES PER LADDER . 2 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 0 0 0 0 1 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 -4 A A 0 0 70 0, 0.0 5,-0.1 0, 0.0 403,-0.0 0.000 360.0 360.0 360.0 136.3 29.5 7.8 -6.6 2 -3 A A > - 0 0 48 1,-0.1 3,-2.0 3,-0.1 4,-0.3 -0.168 360.0-103.2 -57.6 154.0 31.1 10.7 -8.5 3 -2 A P G > S+ 0 0 118 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.724 115.8 69.9 -59.0 -25.8 34.4 12.1 -7.1 4 -1 A F G > S+ 0 0 92 1,-0.3 3,-1.6 2,-0.2 -2,-0.0 0.752 80.3 78.0 -64.2 -23.2 32.7 15.3 -5.6 5 0 A T G < S+ 0 0 9 -3,-2.0 -1,-0.3 1,-0.2 -3,-0.1 0.851 95.0 49.8 -46.1 -36.3 31.1 12.9 -3.1 6 1 A Y G < S+ 0 0 154 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.365 75.3 125.0-100.6 3.9 34.5 12.9 -1.3 7 2 A W < - 0 0 113 -3,-1.6 2,-0.7 -4,-0.2 -3,-0.0 -0.408 67.4-118.6 -52.1 133.9 35.2 16.7 -1.2 8 3 A L - 0 0 104 -2,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.758 22.6-143.7 -83.6 109.9 35.8 17.6 2.5 9 4 A N > - 0 0 3 -2,-0.7 3,-1.8 1,-0.1 4,-0.3 -0.636 0.7-151.3 -76.7 117.1 33.2 20.1 3.7 10 5 A P G > S+ 0 0 89 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.748 90.5 74.2 -63.3 -23.0 34.8 22.6 6.1 11 6 A E G > S+ 0 0 57 1,-0.3 3,-1.2 2,-0.2 -2,-0.0 0.741 80.6 73.6 -56.5 -27.4 31.4 23.1 7.8 12 7 A I G < S+ 0 0 4 -3,-1.8 -1,-0.3 1,-0.2 468,-0.2 0.849 98.2 46.2 -53.7 -36.8 32.0 19.6 9.4 13 8 A Y G < S+ 0 0 137 -3,-1.5 2,-1.0 -4,-0.3 -1,-0.2 0.413 88.1 92.3 -95.2 1.8 34.6 21.2 11.7 14 9 A D < + 0 0 76 -3,-1.2 -1,-0.1 -4,-0.2 467,-0.1 -0.791 42.4 165.7 -94.6 94.5 32.6 24.3 12.7 15 10 A A > - 0 0 16 -2,-1.0 3,-2.0 465,-0.1 -1,-0.2 0.472 42.9-133.3 -86.6 -3.2 30.9 23.0 15.9 16 11 A G T 3 - 0 0 39 1,-0.3 3,-0.1 -3,-0.1 -2,-0.1 0.808 69.9 -50.6 54.1 35.7 29.9 26.6 16.8 17 12 A G T 3 S+ 0 0 69 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.323 104.8 135.5 88.4 -7.5 31.2 26.1 20.4 18 13 A L < + 0 0 9 -3,-2.0 -1,-0.3 3,-0.0 2,-0.3 -0.518 15.6 134.3 -79.2 141.5 29.3 22.9 21.0 19 14 A S > - 0 0 34 -2,-0.2 3,-1.3 -3,-0.1 463,-0.2 -0.919 69.3 -90.5-166.3 174.1 30.9 19.9 22.7 20 15 A R G > S+ 0 0 62 461,-0.4 3,-1.8 -2,-0.3 7,-0.2 0.846 123.1 64.1 -64.1 -30.3 29.9 17.4 25.4 21 16 A R G 3 S+ 0 0 181 1,-0.3 -1,-0.3 -3,-0.0 4,-0.1 0.570 92.8 62.5 -71.9 -10.3 31.5 19.8 27.9 22 17 A A G < S+ 0 0 18 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.382 103.3 61.6 -90.9 1.6 28.8 22.4 27.0 23 18 A F S < S- 0 0 17 -3,-1.8 3,-0.1 1,-0.1 413,-0.1 -0.808 99.0 -75.4-125.6 160.9 26.2 20.0 28.3 24 19 A P > - 0 0 57 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.104 59.8 -85.6 -52.0 152.8 25.3 18.3 31.7 25 20 A E T 3 S+ 0 0 205 1,-0.3 -4,-0.0 -4,-0.1 -5,-0.0 -0.426 117.7 15.1 -57.5 130.1 27.4 15.4 33.0 26 21 A G T 3 S+ 0 0 68 1,-0.2 -1,-0.3 -2,-0.1 2,-0.1 0.478 84.4 163.6 79.5 4.3 26.0 12.2 31.5 27 22 A F < - 0 0 11 -3,-1.9 2,-0.4 -7,-0.2 -1,-0.2 -0.334 32.1-134.3 -57.0 129.1 24.0 13.9 28.8 28 23 A V E -a 437 0A 13 408,-2.1 410,-2.7 -2,-0.1 2,-0.5 -0.752 17.8-166.7 -95.9 128.3 23.0 11.4 26.1 29 24 A F E +a 438 0A 1 -2,-0.4 62,-3.2 408,-0.2 63,-1.2 -0.976 27.5 143.0-108.6 128.7 23.3 12.0 22.4 30 25 A G E -ab 439 92A 0 408,-2.6 410,-2.4 -2,-0.5 2,-0.3 -0.823 43.6-113.6-144.6-177.8 21.6 9.5 20.1 31 26 A T E -ab 440 93A 0 61,-1.3 63,-2.6 408,-0.3 2,-0.4 -0.899 26.5-144.1-118.6 157.0 19.7 9.0 16.9 32 27 A A E + b 0 94A 0 408,-2.3 410,-0.5 -2,-0.3 411,-0.3 -0.953 25.4 154.3-123.5 140.6 16.0 7.9 16.7 33 28 A A - 0 0 3 61,-2.9 2,-0.3 -2,-0.4 3,-0.1 -0.744 29.3-122.0-139.8-169.0 14.2 5.7 14.2 34 29 A S > - 0 0 1 -2,-0.2 4,-1.6 61,-0.1 5,-0.4 -0.996 20.6-117.3-144.3 154.0 11.1 3.4 14.0 35 30 A A H >> S+ 0 0 1 -2,-0.3 4,-2.7 1,-0.2 3,-0.6 0.920 112.6 41.8 -51.2 -56.2 10.4 -0.3 13.3 36 31 A Y H 34 S+ 0 0 7 102,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.809 114.0 52.3 -65.8 -31.5 8.2 0.3 10.2 37 32 A Q H 34 S+ 0 0 1 -3,-0.2 410,-1.7 1,-0.1 35,-0.4 0.744 127.7 14.2 -80.6 -22.8 10.4 3.0 8.7 38 33 A V H << S+ 0 0 3 -4,-1.6 36,-3.2 -3,-0.6 37,-0.3 0.663 107.1 73.8-121.8 -24.4 13.7 1.1 8.9 39 34 A E < - 0 0 6 -4,-2.7 36,-2.7 -5,-0.4 37,-0.4 0.928 63.1-167.4 -67.0 -50.8 13.3 -2.7 9.5 40 35 A G + 0 0 4 28,-0.4 30,-0.3 -5,-0.4 -1,-0.2 -0.558 55.9 96.6 79.8-162.1 12.0 -4.2 6.3 41 36 A M > + 0 0 19 28,-1.0 3,-0.6 -2,-0.2 6,-0.3 0.867 44.2 155.9 48.5 43.3 10.7 -7.7 6.4 42 37 A A T 3 S+ 0 0 4 27,-1.2 -1,-0.1 1,-0.2 27,-0.1 0.826 78.1 29.0 -66.8 -32.9 7.1 -6.3 6.8 43 38 A K T 3 S+ 0 0 114 26,-0.3 -1,-0.2 6,-0.1 2,-0.2 0.156 120.6 63.4-113.2 12.1 5.5 -9.5 5.4 44 39 A Q S X S+ 0 0 124 -3,-0.6 3,-1.7 25,-0.1 -4,-0.0 -0.699 71.4 51.7-130.6 179.4 8.2 -11.8 6.6 45 40 A G T 3 S- 0 0 8 1,-0.3 72,-0.1 -2,-0.2 -1,-0.1 0.681 125.7 -63.6 64.6 20.6 9.9 -13.2 9.7 46 41 A G T 3 S+ 0 0 41 1,-0.2 -1,-0.3 -3,-0.1 2,-0.1 0.373 89.8 157.6 86.4 -2.4 6.5 -14.1 11.2 47 42 A R < - 0 0 17 -3,-1.7 54,-0.3 -6,-0.3 -1,-0.2 -0.334 34.9-138.4 -64.1 126.7 5.3 -10.5 11.3 48 43 A G - 0 0 6 52,-2.7 52,-0.1 -2,-0.1 57,-0.1 -0.419 33.9 -89.6 -76.3 157.8 1.5 -10.0 11.3 49 44 A P - 0 0 70 0, 0.0 94,-2.1 0, 0.0 95,-0.5 -0.358 40.2-154.8 -69.4 151.6 0.0 -7.2 9.2 50 45 A S B > -I 142 0B 0 92,-0.3 4,-1.3 93,-0.1 3,-0.3 -0.658 35.6 -95.5-112.9 176.0 -0.4 -3.7 10.7 51 46 A I H > S+ 0 0 6 90,-2.1 4,-2.2 1,-0.2 89,-0.1 0.792 124.4 56.1 -63.9 -28.6 -2.8 -0.9 9.8 52 47 A W H > S+ 0 0 2 2,-0.2 4,-2.4 89,-0.2 -1,-0.2 0.836 99.6 59.2 -73.0 -33.7 -0.2 0.7 7.5 53 48 A D H > S+ 0 0 7 -3,-0.3 4,-0.8 1,-0.2 -2,-0.2 0.930 113.3 38.7 -57.0 -46.2 0.3 -2.6 5.6 54 49 A A H X S+ 0 0 31 -4,-1.3 4,-0.6 2,-0.2 3,-0.4 0.881 114.9 54.3 -68.2 -40.7 -3.5 -2.3 4.7 55 50 A F H < S+ 0 0 34 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.834 105.2 52.6 -63.9 -37.8 -3.3 1.5 4.2 56 51 A I H < S+ 0 0 15 -4,-2.4 6,-0.3 1,-0.2 -1,-0.2 0.762 92.7 76.9 -71.4 -27.9 -0.5 1.3 1.7 57 52 A E H < S+ 0 0 155 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.850 73.9 87.0 -49.9 -46.0 -2.4 -1.3 -0.4 58 53 A K S >< S- 0 0 128 -4,-0.6 3,-1.5 -3,-0.5 4,-0.3 -0.439 91.0-113.9 -63.1 125.6 -4.7 1.4 -1.9 59 54 A P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.270 97.8 30.0 -63.8 146.1 -3.0 2.9 -5.0 60 55 A G T 3 S+ 0 0 63 2,-0.4 -3,-0.1 -4,-0.1 -2,-0.1 0.076 88.2 105.3 94.0 -22.8 -2.0 6.5 -4.8 61 56 A T S < S+ 0 0 7 -3,-1.5 -5,-0.1 -5,-0.2 -4,-0.1 0.907 84.5 32.6 -57.6 -48.5 -1.4 6.4 -1.0 62 57 A I S > S- 0 0 3 -6,-0.3 3,-1.9 -4,-0.3 -2,-0.4 -0.932 100.7 -98.3-113.7 133.5 2.4 6.4 -1.3 63 58 A P G > S+ 0 0 44 0, 0.0 3,-1.6 0, 0.0 390,-0.3 -0.200 108.8 4.0 -49.6 135.1 4.3 8.2 -4.0 64 59 A N G 3 S- 0 0 157 1,-0.3 -3,-0.0 388,-0.1 388,-0.0 0.676 119.7 -85.1 58.8 24.4 5.4 5.9 -6.9 65 60 A N G < S+ 0 0 102 -3,-1.9 -1,-0.3 1,-0.2 2,-0.1 0.790 78.9 167.2 42.1 39.3 3.4 3.1 -5.0 66 61 A A < - 0 0 26 -3,-1.6 2,-0.2 -4,-0.1 -1,-0.2 -0.368 16.9-158.8 -73.7 154.6 6.5 2.4 -2.9 67 62 A T - 0 0 51 -2,-0.1 4,-0.4 4,-0.0 3,-0.2 -0.761 29.0-127.0-126.5 174.2 6.3 0.3 0.2 68 63 A A S S+ 0 0 1 -2,-0.2 -28,-0.4 1,-0.1 -26,-0.2 0.032 74.6 115.2-105.1 21.6 8.3 -0.3 3.5 69 64 A D S S+ 0 0 53 -28,-0.1 -27,-1.2 1,-0.1 -28,-1.0 0.852 103.4 0.2 -59.7 -33.9 8.4 -4.1 2.8 70 65 A V S > S+ 0 0 78 -30,-0.3 3,-2.1 -3,-0.2 5,-0.2 0.675 86.8 157.3-116.3 -44.6 12.2 -3.7 2.5 71 66 A T T 3 S- 0 0 7 -4,-0.4 -33,-0.1 1,-0.3 -32,-0.1 -0.237 83.3 -24.3 44.2-131.4 12.9 -0.0 3.1 72 67 A V T 3 S- 0 0 0 -35,-0.4 -1,-0.3 -4,-0.1 -33,-0.1 0.410 87.1-129.6 -90.8 3.3 16.6 0.3 4.3 73 68 A D X> + 0 0 17 -3,-2.1 4,-2.2 1,-0.1 3,-1.2 0.833 45.9 163.0 59.9 43.2 16.5 -3.2 5.5 74 69 A E H 3> + 0 0 5 -36,-3.2 4,-1.3 1,-0.2 -35,-0.2 0.769 65.7 78.3 -62.8 -23.6 17.8 -2.7 9.1 75 70 A Y H 34 S+ 0 0 10 -36,-2.7 -1,-0.2 -37,-0.3 -35,-0.1 0.880 114.0 18.6 -49.9 -41.3 16.4 -6.1 9.9 76 71 A H H <4 S+ 0 0 115 -3,-1.2 3,-0.3 -37,-0.4 -2,-0.2 0.697 129.3 51.4-100.2 -26.9 19.5 -7.6 8.1 77 72 A R H X S+ 0 0 81 -4,-2.2 4,-2.1 -38,-0.2 3,-0.3 0.251 70.1 114.9 -98.5 13.5 21.8 -4.5 8.2 78 73 A Y H X S+ 0 0 29 -4,-1.3 4,-2.7 1,-0.2 5,-0.2 0.786 73.0 56.3 -57.2 -33.9 21.5 -3.7 11.9 79 74 A K H > S+ 0 0 104 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.951 109.3 45.4 -65.0 -48.8 25.2 -4.4 12.6 80 75 A E H > S+ 0 0 71 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.927 114.5 50.2 -54.5 -47.9 26.4 -1.9 9.9 81 76 A D H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.914 112.5 44.5 -62.3 -45.4 23.9 0.6 11.3 82 77 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.893 110.4 56.9 -65.5 -40.4 24.9 0.3 14.9 83 78 A N H X S+ 0 0 55 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.866 107.6 48.0 -55.8 -41.3 28.6 0.4 13.7 84 79 A I H X S+ 0 0 19 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.939 109.4 52.0 -64.7 -50.2 27.9 3.8 12.1 85 80 A M H <>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 -2,-0.2 0.905 113.9 44.9 -49.4 -47.6 26.2 5.1 15.2 86 81 A K H ><5S+ 0 0 92 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.910 112.4 50.1 -66.4 -43.9 29.2 4.1 17.3 87 82 A N H 3<5S+ 0 0 108 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.829 108.0 53.8 -64.2 -32.9 31.8 5.5 14.8 88 83 A M T 3<5S- 0 0 10 -4,-2.6 -1,-0.3 -5,-0.1 394,-0.2 0.447 120.7-110.2 -82.6 -1.6 29.9 8.8 14.7 89 84 A G T < 5 + 0 0 26 -3,-1.2 -3,-0.2 1,-0.2 -60,-0.1 0.577 60.3 157.5 88.5 12.2 30.2 9.0 18.5 90 85 A F < - 0 0 1 -5,-2.3 -1,-0.2 -6,-0.2 -60,-0.2 -0.394 32.5-157.1 -72.2 147.8 26.6 8.5 19.5 91 86 A D + 0 0 39 -62,-3.2 40,-2.8 1,-0.1 2,-0.3 0.646 69.7 16.9 -90.4 -22.3 25.7 7.2 23.0 92 87 A A E -bc 30 131A 0 -63,-1.2 -61,-1.3 38,-0.3 2,-0.4 -0.954 53.2-145.5-155.8 160.3 22.3 5.8 22.3 93 88 A Y E -bc 31 132A 2 38,-2.7 40,-2.6 -2,-0.3 2,-0.7 -0.978 9.6-156.7-139.4 121.2 19.7 4.6 19.8 94 89 A R E +bc 32 133A 2 -63,-2.6 -61,-2.9 -2,-0.4 2,-0.2 -0.898 29.9 159.6 -97.0 112.3 16.0 5.0 20.1 95 90 A F E - c 0 134A 4 38,-1.8 40,-2.6 -2,-0.7 2,-0.3 -0.692 31.2-122.5-118.2 172.3 14.3 2.4 18.0 96 91 A S E - c 0 135A 2 -2,-0.2 2,-0.5 38,-0.2 40,-0.2 -0.900 10.8-129.2-121.4 156.9 10.8 0.9 18.2 97 92 A I - 0 0 0 38,-2.5 2,-0.7 -2,-0.3 41,-0.2 -0.881 25.4-126.1-100.6 127.6 9.4 -2.5 18.7 98 93 A S >> - 0 0 0 -2,-0.5 4,-1.4 1,-0.2 3,-0.7 -0.700 12.8-155.1 -76.6 113.1 6.8 -3.7 16.2 99 94 A W H >> S+ 0 0 0 -2,-0.7 4,-3.5 37,-0.3 3,-0.7 0.930 95.7 47.8 -50.8 -51.7 3.8 -4.8 18.1 100 95 A S H 34 S+ 0 0 0 40,-0.6 -52,-2.7 1,-0.2 -1,-0.2 0.649 104.9 59.4 -72.9 -14.5 2.7 -7.1 15.2 101 96 A R H <4 S+ 0 0 1 -3,-0.7 13,-0.4 -54,-0.3 -1,-0.2 0.790 116.9 33.7 -76.9 -29.5 6.2 -8.6 14.9 102 97 A I H << S+ 0 0 0 -4,-1.4 9,-3.1 -3,-0.7 -2,-0.2 0.892 137.0 22.9 -87.2 -51.0 6.0 -9.8 18.5 103 98 A F >< - 0 0 16 -4,-3.5 3,-1.3 7,-0.2 -1,-0.3 -0.875 68.3-169.4-118.1 95.3 2.2 -10.5 18.5 104 99 A P T 3 S+ 0 0 28 0, 0.0 40,-0.4 0, 0.0 39,-0.1 0.805 95.0 34.7 -52.9 -35.2 1.0 -11.1 14.9 105 100 A N T 3 S- 0 0 100 2,-0.4 -5,-0.1 4,-0.3 3,-0.1 0.450 116.6-112.5 -93.0 -9.2 -2.7 -11.0 16.0 106 101 A G S < S+ 0 0 2 -3,-1.3 2,-0.3 -7,-0.2 58,-0.1 -0.041 93.5 44.9 96.8 -30.1 -2.0 -8.3 18.7 107 102 A T S S+ 0 0 63 2,-0.0 2,-0.6 56,-0.0 -2,-0.4 -0.876 101.4 9.1-136.0 166.5 -2.7 -10.8 21.5 108 103 A G S S+ 0 0 63 -2,-0.3 2,-0.2 -3,-0.1 -2,-0.0 -0.497 95.4 66.0 76.8-112.0 -1.9 -14.4 22.5 109 104 A M S S- 0 0 148 -2,-0.6 2,-0.4 1,-0.1 -4,-0.3 -0.296 70.0-141.4 -62.1 117.4 0.7 -16.2 20.4 110 105 A V - 0 0 33 -2,-0.2 2,-1.0 -7,-0.1 -7,-0.2 -0.673 9.7-136.7 -75.5 124.8 4.2 -14.8 20.6 111 106 A N >> - 0 0 22 -9,-3.1 4,-1.8 -2,-0.4 3,-0.7 -0.773 18.2-166.4 -79.4 99.9 6.1 -14.8 17.3 112 107 A Q H 3> S+ 0 0 107 -2,-1.0 4,-2.6 1,-0.3 -1,-0.2 0.775 83.4 60.6 -62.7 -30.7 9.5 -16.1 18.6 113 108 A E H 3> S+ 0 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