==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-OCT-11 3VIN . COMPND 2 MOLECULE: BETA-GLUCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NEOTERMES KOSHUNENSIS; . AUTHOR W.Y.JENG,C.I.LIU,A.H.J.WANG . 472 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17551.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.4 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 . 1 0.2 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 . 27 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.8 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 5 1 0 1 2 0 0 0 1 1 1 2 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 3 3 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 . 4 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 27 A T > 0 0 149 0, 0.0 3,-1.8 0, 0.0 405,-0.0 0.000 360.0 360.0 360.0 -45.7 -6.3 96.7 33.0 2 28 A V T 3 + 0 0 29 1,-0.3 404,-0.2 404,-0.1 403,-0.1 0.590 360.0 51.5 -65.7 -11.5 -6.7 95.3 29.5 3 29 A Y T 3 S+ 0 0 51 2,-0.1 463,-2.2 399,-0.1 2,-0.4 0.321 94.5 88.2-104.9 3.1 -8.0 92.1 31.2 4 30 A T B < S-A 465 0A 35 -3,-1.8 461,-0.2 461,-0.2 460,-0.1 -0.868 74.2-125.9-110.2 135.3 -10.6 93.7 33.4 5 31 A F - 0 0 3 459,-2.5 -2,-0.1 -2,-0.4 -3,-0.0 -0.547 35.7-102.4 -73.9 141.3 -14.2 94.4 32.5 6 32 A P > - 0 0 45 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.307 36.0-112.4 -57.7 149.2 -15.4 98.0 33.0 7 33 A D T 3 S+ 0 0 151 1,-0.3 -2,-0.1 -3,-0.1 457,-0.0 0.809 114.6 42.6 -55.9 -37.8 -17.5 98.3 36.1 8 34 A E T 3 S+ 0 0 183 2,-0.1 -1,-0.3 406,-0.0 2,-0.1 0.486 85.3 120.8 -91.4 -3.0 -20.8 99.0 34.3 9 35 A F < - 0 0 5 -3,-1.3 2,-0.5 1,-0.1 405,-0.2 -0.378 58.4-135.5 -65.6 134.4 -20.3 96.4 31.6 10 36 A K E -b 414 0B 58 403,-1.8 405,-2.6 -2,-0.1 2,-0.4 -0.833 19.7-170.3-102.3 125.7 -23.1 93.7 31.5 11 37 A L E +b 415 0B 3 -2,-0.5 63,-3.3 403,-0.2 64,-1.0 -0.906 27.3 108.5-112.5 139.0 -22.3 90.0 31.2 12 38 A G E -bc 416 75B 0 403,-2.2 405,-2.4 -2,-0.4 2,-0.3 -0.829 51.7 -84.5-170.0-148.9 -24.7 87.2 30.5 13 39 A A E -bc 417 76B 0 62,-1.3 64,-2.3 403,-0.3 2,-0.3 -0.927 28.0-141.2-144.8 165.2 -26.1 84.6 28.1 14 40 A A E +bc 418 77B 0 403,-2.4 406,-1.9 -2,-0.3 405,-0.7 -0.927 16.6 168.8-137.3 152.5 -28.7 84.4 25.4 15 41 A T - 0 0 0 62,-2.2 2,-0.3 -2,-0.3 408,-0.0 -0.855 23.2-131.1-144.1 177.9 -31.4 82.1 23.8 16 42 A A > - 0 0 0 -2,-0.3 4,-1.1 62,-0.2 5,-0.2 -0.990 23.7-118.5-138.0 148.2 -34.2 82.4 21.2 17 43 A S H >> S+ 0 0 0 -2,-0.3 4,-2.9 1,-0.2 3,-0.8 0.871 109.1 41.8 -55.8 -55.0 -37.8 81.2 21.6 18 44 A Y H 34 S+ 0 0 12 104,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.854 112.9 57.2 -66.5 -30.1 -38.2 78.6 18.9 19 45 A Q H 34 S+ 0 0 1 -3,-0.2 405,-2.5 1,-0.1 -1,-0.2 0.771 126.2 11.9 -69.9 -24.6 -34.8 77.2 19.8 20 46 A I H << S+ 0 0 6 -4,-1.1 37,-2.5 -3,-0.8 35,-0.4 0.664 108.2 71.9-124.2 -29.0 -35.6 76.5 23.4 21 47 A E < + 0 0 7 -4,-2.9 37,-2.4 -5,-0.2 38,-0.4 0.853 54.1 179.3 -75.0 -39.9 -39.3 76.7 24.3 22 48 A G + 0 0 5 29,-0.4 31,-0.3 -5,-0.3 -1,-0.2 -0.404 45.6 108.1 63.4-147.7 -41.2 73.8 22.9 23 49 A A > + 0 0 8 29,-0.6 3,-1.2 1,-0.1 6,-0.1 0.895 46.4 172.2 47.3 45.2 -44.9 73.8 23.7 24 50 A W T 3 S+ 0 0 66 28,-1.1 -1,-0.1 1,-0.3 8,-0.1 0.707 74.8 17.8 -65.7 -24.5 -45.4 74.7 20.1 25 51 A D T 3 S+ 0 0 100 27,-0.2 3,-0.5 6,-0.1 -1,-0.3 0.098 96.2 129.7-130.4 23.1 -49.2 74.4 20.1 26 52 A E S X S- 0 0 64 -3,-1.2 3,-1.7 1,-0.2 4,-0.0 -0.571 72.4 -6.2 -86.7 143.3 -49.9 74.5 23.9 27 53 A N T 3 S- 0 0 89 1,-0.3 -1,-0.2 -2,-0.3 70,-0.2 0.847 132.5 -41.3 46.7 51.1 -52.4 76.8 25.6 28 54 A G T 3 S+ 0 0 47 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.331 88.3 151.7 88.9 -5.5 -53.5 78.8 22.5 29 55 A K < - 0 0 15 -3,-1.7 -1,-0.3 -6,-0.1 55,-0.2 -0.372 37.1-138.3 -60.5 133.8 -50.1 79.4 20.8 30 56 A G - 0 0 7 53,-2.5 2,-0.2 1,-0.1 58,-0.1 -0.425 26.7 -86.5 -87.1 168.1 -50.6 79.8 17.0 31 57 A P - 0 0 66 0, 0.0 96,-2.7 0, 0.0 97,-0.5 -0.452 40.4-163.7 -78.7 144.5 -48.4 78.2 14.3 32 58 A N B > -J 126 0C 0 94,-0.3 4,-2.2 -2,-0.2 3,-0.2 -0.660 38.6 -93.8-117.8 176.4 -45.2 79.9 13.1 33 59 A I H > S+ 0 0 4 92,-2.2 4,-2.2 1,-0.2 91,-0.1 0.697 124.0 53.7 -67.6 -21.2 -43.1 79.4 10.0 34 60 A W H > S+ 0 0 2 2,-0.2 4,-2.6 91,-0.2 5,-0.3 0.836 105.6 52.4 -83.0 -35.0 -40.7 77.1 11.9 35 61 A D H > S+ 0 0 2 -3,-0.2 4,-2.1 2,-0.2 5,-0.3 0.955 113.8 46.4 -53.3 -48.7 -43.6 74.9 13.0 36 62 A T H X S+ 0 0 29 -4,-2.2 4,-2.9 2,-0.2 5,-0.5 0.941 113.4 47.1 -62.6 -48.2 -44.5 74.8 9.3 37 63 A L H X S+ 0 0 3 -4,-2.2 4,-2.7 1,-0.2 7,-0.2 0.953 116.1 42.4 -60.9 -49.8 -40.9 74.1 8.1 38 64 A T H < S+ 0 0 3 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.805 120.1 43.2 -74.8 -24.6 -40.2 71.3 10.5 39 65 A H H < S+ 0 0 72 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.886 125.9 29.5 -81.9 -40.8 -43.6 69.7 10.2 40 66 A E H < S+ 0 0 130 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.755 129.5 34.6 -92.8 -26.7 -43.9 69.9 6.4 41 67 A H >< + 0 0 61 -4,-2.7 3,-2.4 -5,-0.5 4,-0.2 -0.439 56.6 150.9-129.4 60.5 -40.3 69.7 5.3 42 68 A P G > S+ 0 0 59 0, 0.0 3,-1.6 0, 0.0 6,-0.5 0.765 71.4 73.2 -64.1 -19.9 -38.3 67.5 7.7 43 69 A D G 3 S+ 0 0 130 1,-0.3 4,-0.1 -3,-0.1 -5,-0.1 0.623 90.3 59.2 -63.8 -16.5 -36.1 66.8 4.7 44 70 A Y G < S+ 0 0 39 -3,-2.4 2,-0.4 -7,-0.2 -1,-0.3 0.550 100.1 67.0 -83.3 -11.5 -34.7 70.3 5.2 45 71 A V S X S- 0 0 9 -3,-1.6 3,-2.5 -4,-0.2 383,-0.2 -0.923 91.7-104.2-119.8 136.7 -33.5 69.6 8.7 46 72 A V G > S+ 0 0 39 381,-2.7 3,-1.7 -2,-0.4 384,-0.3 -0.316 108.6 0.5 -54.6 132.9 -30.8 67.3 10.0 47 73 A D G 3 S- 0 0 140 1,-0.3 -1,-0.3 382,-0.1 3,-0.1 0.538 115.7 -86.9 66.1 7.7 -32.4 64.2 11.6 48 74 A G G < S+ 0 0 32 -3,-2.5 -1,-0.3 -6,-0.5 -2,-0.2 0.844 76.7 177.3 57.9 32.1 -35.8 65.6 10.6 49 75 A A < - 0 0 12 -3,-1.7 2,-0.3 -7,-0.2 -1,-0.1 -0.242 14.0-164.9 -68.3 156.0 -35.7 67.4 14.0 50 76 A T - 0 0 37 -3,-0.1 4,-0.5 -11,-0.0 3,-0.4 -0.931 30.4-128.2-132.6 163.0 -38.3 69.8 15.2 51 77 A G S S+ 0 0 2 -2,-0.3 -29,-0.4 1,-0.2 -27,-0.1 0.083 71.4 119.9 -90.7 23.4 -38.7 72.4 17.9 52 78 A D S S- 0 0 49 1,-0.1 -28,-1.1 -30,-0.1 -29,-0.6 0.867 99.6 -1.8 -58.0 -38.5 -41.9 70.8 19.2 53 79 A I S > S+ 0 0 84 -3,-0.4 3,-2.6 -31,-0.3 4,-0.2 0.674 85.5 156.1-116.7 -46.6 -40.2 70.2 22.6 54 80 A A T 3 S- 0 0 0 -4,-0.5 -34,-0.2 1,-0.3 -33,-0.1 -0.307 84.7 -19.4 51.7-131.6 -36.6 71.6 22.3 55 81 A D T 3 S- 0 0 0 -35,-0.4 -1,-0.3 -36,-0.2 -34,-0.2 0.431 85.8-126.9 -82.2 -1.6 -35.4 72.5 25.8 56 82 A D X> + 0 0 29 -3,-2.6 4,-2.5 -36,-0.1 3,-1.1 0.800 53.7 156.1 59.7 32.2 -39.0 72.6 27.0 57 83 A S H 3> + 0 0 0 -37,-2.5 4,-0.8 1,-0.3 -36,-0.2 0.703 61.5 71.6 -67.5 -15.3 -38.3 76.1 28.4 58 84 A Y H 34 S+ 0 0 21 -37,-2.4 -1,-0.3 -38,-0.2 3,-0.2 0.932 116.8 23.0 -59.3 -42.7 -42.0 76.9 28.2 59 85 A H H <4 S+ 0 0 85 -3,-1.1 3,-0.3 -38,-0.4 -2,-0.2 0.804 129.1 47.4 -88.1 -30.8 -42.4 74.5 31.2 60 86 A L H >X + 0 0 37 -4,-2.5 4,-1.4 1,-0.2 3,-1.3 0.100 66.1 123.1-105.4 20.7 -38.8 74.7 32.6 61 87 A Y H 3X S+ 0 0 31 -4,-0.8 4,-2.1 1,-0.3 -1,-0.2 0.806 73.1 58.8 -55.2 -33.1 -38.2 78.4 32.6 62 88 A K H 3> S+ 0 0 117 -3,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.856 103.1 52.7 -67.3 -30.7 -37.4 78.3 36.4 63 89 A E H <> S+ 0 0 90 -3,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.856 106.5 53.4 -68.2 -35.5 -34.6 75.8 35.6 64 90 A D H X S+ 0 0 2 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.926 109.3 48.3 -63.2 -42.9 -33.2 78.3 33.1 65 91 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.910 108.2 56.0 -62.9 -40.7 -33.2 81.0 35.8 66 92 A K H X S+ 0 0 141 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.923 110.0 43.6 -56.4 -46.8 -31.5 78.6 38.2 67 93 A I H X S+ 0 0 12 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.879 111.4 54.2 -72.3 -33.6 -28.6 78.0 35.8 68 94 A L H X>S+ 0 0 0 -4,-2.3 5,-2.1 2,-0.2 4,-1.3 0.909 110.1 48.1 -61.3 -39.7 -28.4 81.8 34.9 69 95 A K H <5S+ 0 0 118 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.907 111.3 49.9 -66.5 -43.3 -28.1 82.4 38.7 70 96 A E H <5S+ 0 0 119 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.905 111.3 49.5 -57.9 -45.5 -25.4 79.7 39.0 71 97 A L H <5S- 0 0 2 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.795 110.2-126.2 -62.2 -30.1 -23.5 81.2 36.1 72 98 A G T <5 + 0 0 41 -4,-1.3 -3,-0.2 1,-0.2 -61,-0.1 0.700 42.0 177.8 82.7 24.3 -23.7 84.7 37.7 73 99 A A < - 0 0 6 -5,-2.1 -61,-0.2 -6,-0.2 -1,-0.2 -0.357 23.9-164.4 -58.0 135.8 -25.3 86.3 34.6 74 100 A Q S S+ 0 0 77 -63,-3.3 41,-2.6 1,-0.2 2,-0.3 0.708 78.3 26.5 -87.2 -25.5 -26.2 90.0 35.0 75 101 A V E -cd 12 115B 0 -64,-1.0 -62,-1.3 39,-0.2 2,-0.5 -0.989 63.0-157.4-139.9 143.2 -28.4 89.9 32.0 76 102 A Y E -cd 13 116B 0 39,-2.5 41,-2.5 -2,-0.3 2,-0.6 -0.986 10.8-158.0-122.0 117.9 -30.4 87.2 30.1 77 103 A R E +cd 14 117B 0 -64,-2.3 -62,-2.2 -2,-0.5 2,-0.3 -0.859 27.2 153.8 -94.8 122.1 -31.3 87.9 26.5 78 104 A F E - d 0 118B 4 39,-2.2 41,-2.7 -2,-0.6 2,-0.3 -0.908 33.6-123.1-138.2 165.8 -34.3 85.8 25.3 79 105 A S E - d 0 119B 2 -2,-0.3 2,-0.4 39,-0.2 41,-0.2 -0.792 14.8-126.7-113.3 159.4 -36.9 86.3 22.6 80 106 A I - 0 0 0 39,-2.1 2,-0.8 -2,-0.3 42,-0.3 -0.865 23.0-125.1-101.5 132.8 -40.6 86.4 22.6 81 107 A S >> - 0 0 2 -2,-0.4 4,-1.3 1,-0.2 3,-1.2 -0.720 15.3-154.6 -77.6 111.2 -42.6 84.1 20.3 82 108 A W H >> S+ 0 0 1 -2,-0.8 4,-3.3 1,-0.3 3,-0.7 0.902 94.0 48.7 -52.8 -47.2 -44.9 86.3 18.3 83 109 A A H 34 S+ 0 0 0 41,-0.6 -53,-2.5 1,-0.3 -1,-0.3 0.646 104.7 59.3 -74.7 -14.3 -47.5 83.5 17.7 84 110 A R H <4 S+ 0 0 1 -3,-1.2 14,-0.5 -55,-0.2 -1,-0.3 0.788 117.7 32.1 -74.7 -30.7 -47.5 82.6 21.4 85 111 A V H << S+ 0 0 0 -4,-1.3 10,-3.0 -3,-0.7 -2,-0.2 0.858 136.6 22.7 -90.6 -46.3 -48.7 86.2 22.2 86 112 A L S >< S- 0 0 1 -4,-3.3 3,-2.4 8,-0.2 -1,-0.3 -0.841 71.3-172.4-123.6 90.3 -50.7 87.0 19.1 87 113 A P T 3 S+ 0 0 18 0, 0.0 41,-0.3 0, 0.0 -1,-0.1 0.769 86.3 44.0 -62.2 -25.5 -51.7 83.6 17.7 88 114 A E T 3 S- 0 0 97 2,-0.4 2,-1.6 5,-0.4 3,-0.1 0.297 107.6-123.9 -96.5 4.2 -53.3 85.1 14.6 89 115 A G S < S+ 0 0 1 -3,-2.4 -1,-0.1 1,-0.2 2,-0.1 -0.282 87.5 88.9 85.0 -55.8 -50.3 87.5 14.0 90 116 A H S > S- 0 0 67 -2,-1.6 3,-0.7 1,-0.1 -2,-0.4 -0.322 91.4-112.5 -66.5 162.3 -52.6 90.5 14.0 91 117 A D T 3 S+ 0 0 68 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.273 90.3 99.6 -89.6 15.9 -53.4 92.1 17.3 92 118 A N T 3 S+ 0 0 111 1,-0.2 2,-0.5 -6,-0.1 -1,-0.2 0.839 86.5 40.6 -69.5 -32.5 -57.1 91.2 17.5 93 119 A I < - 0 0 87 -3,-0.7 2,-0.5 2,-0.0 -5,-0.4 -0.973 66.8-167.5-123.1 121.4 -56.5 88.3 19.8 94 120 A V - 0 0 65 -2,-0.5 2,-0.9 -8,-0.2 -8,-0.2 -0.937 21.2-136.0-105.7 124.2 -54.0 88.4 22.7 95 121 A N >> - 0 0 25 -10,-3.0 4,-1.8 -2,-0.5 3,-0.7 -0.714 10.6-161.1 -82.9 106.3 -53.2 85.0 24.2 96 122 A Q H 3> S+ 0 0 114 -2,-0.9 4,-3.0 1,-0.3 5,-0.2 0.809 89.5 61.8 -58.2 -33.1 -53.2 85.5 28.0 97 123 A D H 3> S+ 0 0 40 -70,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.915 105.7 46.5 -61.0 -41.0 -51.3 82.3 28.5 98 124 A G H <> S+ 0 0 0 -3,-0.7 4,-2.3 -14,-0.5 5,-0.3 0.908 111.5 50.4 -65.7 -43.2 -48.4 83.8 26.5 99 125 A I H X S+ 0 0 3 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.946 112.8 47.9 -56.8 -48.5 -48.6 87.1 28.5 100 126 A D H X S+ 0 0 73 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.894 109.1 53.6 -58.7 -44.6 -48.5 85.1 31.7 101 127 A Y H X S+ 0 0 10 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.958 112.3 41.9 -58.0 -53.2 -45.6 82.9 30.5 102 128 A Y H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.880 114.0 52.7 -68.8 -34.3 -43.3 85.9 29.7 103 129 A N H X S+ 0 0 30 -4,-2.5 4,-3.0 -5,-0.3 5,-0.2 0.920 108.7 51.5 -59.8 -43.6 -44.4 87.7 32.8 104 130 A N H X S+ 0 0 74 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.918 112.6 44.6 -59.9 -43.0 -43.5 84.6 34.8 105 131 A L H X S+ 0 0 5 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.949 114.7 48.5 -67.1 -49.0 -40.0 84.4 33.2 106 132 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.932 113.8 46.5 -56.2 -46.8 -39.4 88.2 33.7 107 133 A N H X S+ 0 0 73 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.892 111.3 51.6 -66.5 -37.6 -40.5 88.1 37.3 108 134 A E H X S+ 0 0 55 -4,-2.2 4,-0.9 -5,-0.2 -1,-0.2 0.913 110.7 49.0 -62.6 -44.7 -38.4 85.0 38.0 109 135 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 3,-1.2 0.963 112.7 46.5 -57.5 -53.6 -35.3 86.7 36.5 110 136 A L H ><5S+ 0 0 75 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.868 107.9 55.8 -62.2 -36.7 -35.8 89.9 38.5 111 137 A A H 3<5S+ 0 0 81 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.723 110.9 47.0 -65.5 -22.6 -36.4 88.0 41.8 112 138 A N T <<5S- 0 0 38 -3,-1.2 -1,-0.3 -4,-0.9 -2,-0.2 0.179 122.4-105.9-105.6 15.2 -33.0 86.3 41.1 113 139 A G T < 5S+ 0 0 66 -3,-1.5 2,-0.4 1,-0.2 -3,-0.2 0.702 76.6 132.7 70.2 24.7 -31.2 89.6 40.3 114 140 A I < - 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