==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-JUL-99 1QVB . COMPND 2 MOLECULE: BETA-GLYCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOSPHAERA AGGREGANS; . AUTHOR Y.-I.CHI,L.A.MARTINEZ-CRUZ,R.V.SWANSON,D.E.ROBERTSON,S.- . 962 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36189.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 686 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 92 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 2 0.2 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 . 71 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 288 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.2 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 6 0 2 4 0 4 2 0 2 0 4 2 0 4 0 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 8 4 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 PARALLEL BRIDGES PER LADDER . 10 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 ANTIPARALLEL BRIDGES PER LADDER . 6 2 0 0 0 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 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 M 0 0 51 0, 0.0 469,-1.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 38.1 -5.1 18.1 6.8 2 2 A K B -A 469 0A 135 467,-0.2 467,-0.3 407,-0.1 466,-0.1 -0.931 360.0-124.5-128.1 152.1 -3.0 15.2 8.1 3 3 A F - 0 0 14 465,-3.0 406,-0.0 -2,-0.3 4,-0.0 -0.447 44.3 -75.8 -90.4 167.2 0.6 14.3 7.7 4 4 A P > - 0 0 83 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 -0.098 52.3 -95.9 -57.9 162.8 2.1 11.1 6.3 5 5 A K T 3 S+ 0 0 186 1,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.910 121.7 35.6 -44.7 -61.0 2.0 7.9 8.4 6 6 A D T 3 S+ 0 0 121 2,-0.1 -1,-0.3 414,-0.0 2,-0.2 0.088 81.5 145.2 -88.7 24.4 5.6 8.1 9.8 7 7 A F < - 0 0 11 -3,-1.7 2,-0.4 1,-0.1 413,-0.2 -0.432 49.6-124.8 -65.2 128.3 5.7 11.9 10.1 8 8 A M E +b 420 0B 7 411,-2.2 413,-2.7 -2,-0.2 2,-0.4 -0.617 32.1 176.9 -80.5 128.5 7.7 12.9 13.2 9 9 A I E +b 421 0B 2 -2,-0.4 66,-2.6 411,-0.2 67,-1.5 -0.999 32.2 81.6-131.6 130.4 6.0 15.2 15.7 10 10 A G E -bc 422 76B 0 411,-2.1 413,-3.0 -2,-0.4 2,-0.3 -0.827 63.6 -79.6 177.5-136.4 7.7 16.3 19.0 11 11 A Y E -bc 423 77B 9 65,-1.0 67,-1.7 411,-0.4 2,-0.3 -0.957 24.2-125.0-155.4 169.8 10.1 18.8 20.4 12 12 A S E +bc 424 78B 0 411,-1.9 413,-1.4 -2,-0.3 2,-0.3 -0.817 21.7 175.1-120.6 161.3 13.8 19.7 20.8 13 13 A S - 0 0 7 65,-1.7 3,-0.1 -2,-0.3 416,-0.0 -0.929 18.3-136.7-153.4 171.1 16.0 20.5 23.7 14 14 A S > - 0 0 2 -2,-0.3 4,-0.8 1,-0.1 5,-0.3 -0.909 22.1-120.2-133.1 157.9 19.7 21.2 24.4 15 15 A P H >> S+ 0 0 3 0, 0.0 4,-2.7 0, 0.0 3,-1.2 0.988 107.4 47.4 -61.1 -60.3 21.9 20.0 27.2 16 16 A F H 34 S+ 0 0 16 1,-0.2 4,-0.3 135,-0.2 11,-0.1 0.836 112.0 48.6 -52.4 -41.9 22.9 23.3 28.7 17 17 A Q H 34 S+ 0 0 4 1,-0.1 413,-2.1 2,-0.1 -1,-0.2 0.638 127.2 18.2 -79.7 -13.3 19.4 24.8 28.9 18 18 A F H << S+ 0 0 7 -3,-1.2 40,-2.5 -4,-0.8 39,-0.6 0.686 103.5 74.4-126.8 -32.0 17.7 21.9 30.6 19 19 A E S < S+ 0 0 3 -4,-2.7 40,-1.7 -5,-0.3 41,-0.4 0.932 84.6 63.2 -56.0 -58.8 20.0 19.4 32.3 20 20 A A + 0 0 8 -5,-0.3 37,-2.2 -4,-0.3 38,-0.4 -0.156 55.6 100.1 -66.6 164.7 21.1 21.2 35.5 21 21 A G + 0 0 6 1,-0.3 -1,-0.2 32,-0.2 32,-0.1 -0.046 68.0 73.7 148.3 -35.7 18.6 22.2 38.2 22 22 A I S > S- 0 0 52 -3,-0.4 3,-1.4 1,-0.1 -1,-0.3 -0.939 97.5 -93.9-107.7 129.0 19.1 19.5 40.8 23 23 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 31,-0.0 -0.007 108.9 29.4 -42.8 131.9 22.3 19.7 42.9 24 24 A G T 3 S+ 0 0 71 -3,-0.0 -4,-0.0 29,-0.0 29,-0.0 0.355 96.6 87.7 98.6 -4.5 25.1 17.6 41.6 25 25 A S < + 0 0 2 -3,-1.4 34,-0.0 28,-0.1 -5,-0.0 0.378 57.2 123.6-107.2 4.5 24.2 17.7 37.9 26 26 A E - 0 0 66 -4,-0.1 3,-0.0 1,-0.1 27,-0.0 -0.213 52.8-147.6 -64.1 155.3 26.0 20.9 37.0 27 27 A D > + 0 0 13 1,-0.1 3,-0.6 -11,-0.1 6,-0.2 -0.804 23.5 170.1-124.6 84.4 28.6 21.0 34.2 28 28 A P T 3 + 0 0 57 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.385 60.5 82.5 -75.4 3.6 31.1 23.6 35.4 29 29 A N T 3 S+ 0 0 65 4,-0.1 127,-2.3 55,-0.0 128,-0.3 0.118 71.7 87.4-100.6 23.1 33.6 22.7 32.7 30 30 A S B <> S-J 155 0C 0 -3,-0.6 4,-1.7 125,-0.3 5,-0.2 -0.813 79.2-120.1-117.9 162.2 32.2 24.7 29.7 31 31 A D H > S+ 0 0 5 123,-2.6 4,-2.9 -2,-0.3 5,-0.1 0.901 114.0 54.0 -64.3 -40.8 32.8 28.2 28.5 32 32 A W H > S+ 0 0 5 122,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.855 104.5 54.8 -62.7 -36.4 29.1 29.0 28.9 33 33 A W H > S+ 0 0 41 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.963 114.3 39.1 -61.5 -52.4 29.1 27.9 32.5 34 34 A V H >X S+ 0 0 44 -4,-1.7 4,-1.0 1,-0.2 3,-0.6 0.930 113.8 58.0 -62.6 -43.9 31.9 30.2 33.5 35 35 A W H 3< S+ 0 0 1 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.880 108.2 42.7 -54.8 -46.4 30.5 32.9 31.2 36 36 A V H 3< S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.648 114.2 51.6 -79.2 -14.1 27.1 33.2 32.9 37 37 A H H << S+ 0 0 46 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.537 82.8 121.2 -94.1 -8.0 28.6 33.0 36.4 38 38 A D X - 0 0 17 -4,-1.0 4,-2.1 -3,-0.5 5,-0.1 -0.367 57.3-148.7 -62.9 124.7 31.0 35.8 35.6 39 39 A P H > S+ 0 0 89 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.900 97.4 47.9 -57.8 -47.2 30.6 38.9 37.9 40 40 A E H > S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 6,-0.3 0.931 110.5 49.8 -64.4 -46.4 31.7 41.4 35.3 41 41 A N H >>S+ 0 0 0 1,-0.2 5,-2.0 2,-0.2 6,-1.1 0.898 114.7 47.4 -58.4 -38.7 29.4 40.0 32.6 42 42 A T H ><5S+ 0 0 53 -4,-2.1 3,-1.2 2,-0.2 -2,-0.2 0.950 111.7 47.0 -67.4 -51.7 26.6 40.1 35.1 43 43 A A H 3<5S+ 0 0 52 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.890 112.6 52.0 -57.6 -40.0 27.3 43.7 36.3 44 44 A A H 3<5S- 0 0 8 -4,-2.7 659,-0.4 -5,-0.2 -1,-0.3 0.633 112.0-122.2 -72.1 -15.5 27.5 44.7 32.7 45 45 A G T <<5S+ 0 0 33 -3,-1.2 -3,-0.2 -4,-0.6 -2,-0.1 0.615 76.4 126.5 82.9 9.7 24.2 43.2 31.9 46 46 A L S - 0 0 62 -2,-0.1 3,-1.7 1,-0.1 -18,-0.0 -0.879 10.8-139.2-113.4 139.9 21.9 30.4 36.7 52 52 A P G > S+ 0 0 4 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 0.775 101.3 71.0 -62.1 -29.7 21.6 27.1 34.8 53 53 A E G 3 S+ 0 0 35 1,-0.3 -32,-0.2 -33,-0.1 -28,-0.1 0.614 94.7 56.4 -64.2 -12.1 21.9 25.1 38.0 54 54 A N G < S+ 0 0 86 -3,-1.7 -1,-0.3 -34,-0.1 -33,-0.1 0.179 90.2 116.8-103.8 17.5 18.4 26.5 38.7 55 55 A G S < S- 0 0 1 -3,-2.3 -37,-0.1 1,-0.1 374,-0.1 0.203 87.8 -73.7 -72.5-167.6 17.0 25.0 35.5 56 56 A P - 0 0 0 0, 0.0 -35,-0.2 0, 0.0 -37,-0.1 0.678 58.2-132.3 -64.4 -19.7 14.4 22.4 34.9 57 57 A G >> + 0 0 0 -37,-2.2 4,-2.4 -39,-0.6 3,-1.8 0.847 44.1 161.8 70.3 36.6 16.7 19.6 36.0 58 58 A Y H 3> + 0 0 9 -40,-2.5 4,-1.8 -38,-0.4 -39,-0.2 0.764 66.6 72.7 -57.2 -29.8 16.1 17.2 33.1 59 59 A W H 34 S+ 0 0 24 -40,-1.7 -1,-0.3 -41,-0.3 -39,-0.1 0.823 115.9 21.8 -57.6 -29.7 19.3 15.4 34.0 60 60 A N H <4 S+ 0 0 75 -3,-1.8 3,-0.3 -41,-0.4 -2,-0.2 0.683 129.4 46.4-108.5 -27.6 17.4 14.0 37.0 61 61 A L H >X S+ 0 0 41 -4,-2.4 4,-2.0 -42,-0.2 3,-0.9 0.318 72.2 116.7-101.2 7.7 13.8 14.3 35.8 62 62 A N H 3X S+ 0 0 19 -4,-1.8 4,-2.5 1,-0.3 5,-0.2 0.835 74.6 53.6 -42.9 -46.6 14.2 12.9 32.3 63 63 A Q H 3> S+ 0 0 109 -3,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.905 109.5 47.9 -61.9 -40.7 11.9 10.0 32.9 64 64 A N H <> S+ 0 0 94 -3,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.884 113.0 47.5 -69.2 -36.3 9.1 12.3 34.1 65 65 A D H X S+ 0 0 6 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.852 108.8 54.5 -72.6 -32.3 9.4 14.6 31.2 66 66 A H H X S+ 0 0 1 -4,-2.5 4,-2.7 -5,-0.3 -1,-0.2 0.897 109.4 48.1 -66.4 -38.1 9.5 11.7 28.8 67 67 A D H X S+ 0 0 70 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.916 111.8 49.2 -66.4 -42.4 6.2 10.5 30.3 68 68 A L H X S+ 0 0 18 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.952 112.0 49.5 -59.9 -49.3 4.8 14.0 30.0 69 69 A A H ><>S+ 0 0 0 -4,-3.1 5,-2.6 1,-0.2 3,-0.5 0.922 112.2 47.1 -54.2 -49.2 6.0 14.1 26.4 70 70 A E H ><5S+ 0 0 55 -4,-2.7 3,-1.4 1,-0.2 -1,-0.2 0.889 107.5 56.7 -63.1 -38.1 4.4 10.7 25.6 71 71 A K H 3<5S+ 0 0 123 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.805 107.9 49.4 -64.1 -27.2 1.2 11.8 27.3 72 72 A L T <<5S- 0 0 0 -4,-1.5 393,-0.3 -3,-0.5 -1,-0.3 0.440 125.0-101.4 -91.5 -1.0 1.0 14.8 24.9 73 73 A G T < 5 + 0 0 18 -3,-1.4 2,-0.4 -4,-0.3 -3,-0.2 0.614 62.2 161.2 93.7 12.6 1.6 12.6 21.9 74 74 A V < + 0 0 0 -5,-2.6 -1,-0.3 -6,-0.2 -64,-0.2 -0.541 8.6 170.1 -68.8 124.8 5.3 13.3 21.3 75 75 A N + 0 0 40 -66,-2.6 69,-2.4 -2,-0.4 2,-0.4 0.541 63.0 36.7-111.4 -12.9 6.7 10.5 19.1 76 76 A T E -cd 10 144B 0 -67,-1.5 -65,-1.0 67,-0.2 2,-0.4 -0.996 59.8-173.8-145.5 137.7 10.0 12.0 18.3 77 77 A I E -cd 11 145B 1 67,-2.2 69,-2.7 -2,-0.4 2,-0.5 -0.973 13.3-150.7-131.1 145.3 12.6 14.1 20.2 78 78 A R E +cd 12 146B 0 -67,-1.7 -65,-1.7 -2,-0.4 2,-0.2 -0.972 29.0 164.2-115.7 122.8 15.9 15.8 19.2 79 79 A V E - d 0 147B 1 67,-2.5 69,-3.4 -2,-0.5 2,-0.2 -0.769 20.8-139.4-130.2 174.3 18.5 16.1 21.9 80 80 A G E - d 0 148B 1 -2,-0.2 2,-0.4 67,-0.2 69,-0.2 -0.698 8.4-130.2-129.1-178.2 22.1 16.8 22.3 81 81 A V - 0 0 1 67,-0.9 2,-0.6 -2,-0.2 70,-0.2 -0.998 26.9-122.3-136.2 128.7 25.3 15.7 24.2 82 82 A E >> - 0 0 3 -2,-0.4 4,-1.8 1,-0.2 3,-1.0 -0.629 9.9-152.1 -75.9 119.5 27.6 18.2 26.0 83 83 A W H 3> S+ 0 0 1 -2,-0.6 4,-2.9 70,-0.4 3,-0.2 0.923 97.6 54.0 -52.5 -46.2 31.1 17.9 24.6 84 84 A S H 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.2 72,-0.1 0.698 105.1 50.6 -66.6 -22.2 32.3 19.2 28.1 85 85 A R H <4 S+ 0 0 22 -3,-1.0 42,-0.3 2,-0.1 -1,-0.2 0.828 115.3 44.4 -82.3 -32.4 30.5 16.5 30.1 86 86 A I H < S+ 0 0 0 -4,-1.8 38,-2.4 1,-0.2 -2,-0.2 0.898 129.7 22.8 -75.8 -44.4 31.9 13.8 27.9 87 87 A F < + 0 0 2 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.1 -0.665 63.5 162.6-126.8 77.4 35.5 15.1 27.8 88 88 A P S S+ 0 0 37 0, 0.0 69,-0.3 0, 0.0 -1,-0.1 0.809 71.6 55.5 -62.0 -29.7 36.1 17.4 30.9 89 89 A K S S- 0 0 148 33,-0.3 35,-0.1 -3,-0.1 33,-0.0 -0.703 106.0 -81.3-104.4 158.5 39.8 17.0 30.3 90 90 A P - 0 0 52 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.265 26.8-167.8 -60.2 135.6 41.8 17.8 27.0 91 91 A T > + 0 0 2 1,-0.1 3,-1.7 -4,-0.1 31,-0.0 0.274 58.6 111.9-105.5 6.7 41.8 15.2 24.2 92 92 A F T 3 + 0 0 76 1,-0.3 -1,-0.1 0, 0.0 91,-0.0 0.815 68.8 58.9 -48.2 -40.1 44.6 17.0 22.5 93 93 A N T 3 S+ 0 0 149 -3,-0.2 2,-2.2 1,-0.1 -1,-0.3 0.630 73.1 96.1 -72.7 -15.0 47.1 14.3 23.1 94 94 A V S < S- 0 0 14 -3,-1.7 -1,-0.1 1,-0.2 -3,-0.0 -0.577 72.8-155.4 -76.1 86.0 45.3 11.5 21.3 95 95 A K + 0 0 191 -2,-2.2 -1,-0.2 3,-0.0 -4,-0.0 0.793 21.1 171.6 -28.7 -82.8 47.3 12.1 18.2 96 96 A V - 0 0 26 -3,-0.1 15,-0.1 13,-0.1 2,-0.1 0.672 43.6 -84.0 67.3 128.0 45.3 10.9 15.2 97 97 A P - 0 0 77 0, 0.0 13,-2.3 0, 0.0 2,-0.4 -0.380 42.6-165.3 -64.9 137.7 46.4 11.6 11.5 98 98 A V E -K 109 0D 48 11,-0.2 2,-0.4 -2,-0.1 11,-0.2 -0.952 6.8-152.1-133.3 114.0 45.4 14.9 10.1 99 99 A E E -K 108 0D 105 9,-2.4 9,-1.3 -2,-0.4 8,-0.8 -0.694 14.2-171.0 -87.5 128.8 45.5 15.6 6.3 100 100 A R E -K 106 0D 98 -2,-0.4 6,-0.2 6,-0.2 -2,-0.0 -0.982 11.6-143.9-125.8 129.8 46.0 19.2 5.3 101 101 A D > - 0 0 49 4,-1.7 3,-0.8 -2,-0.4 -1,-0.0 0.101 45.4 -80.7 -71.0-167.5 45.8 20.7 1.8 102 102 A E T 3 S+ 0 0 184 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.797 127.7 51.7 -70.4 -30.1 48.0 23.4 0.4 103 103 A N T 3 S- 0 0 129 2,-0.0 -1,-0.2 1,-0.0 -2,-0.0 0.387 120.5-100.4 -90.3 4.2 46.1 26.2 2.1 104 104 A G S < S+ 0 0 29 -3,-0.8 -2,-0.1 1,-0.3 2,-0.1 0.459 71.4 150.4 92.8 0.3 46.1 24.8 5.6 105 105 A S - 0 0 6 1,-0.1 -4,-1.7 2,-0.0 2,-1.4 -0.423 51.3-126.9 -67.7 140.8 42.5 23.4 5.3 106 106 A I E +K 100 0D 0 -6,-0.2 -6,-0.2 1,-0.2 -1,-0.1 -0.700 38.1 168.9 -91.6 86.3 41.9 20.3 7.4 107 107 A V E + 0 0 25 -2,-1.4 2,-0.3 -8,-0.8 -1,-0.2 0.576 61.8 18.4 -76.7 -11.5 40.5 18.1 4.6 108 108 A H E -K 99 0D 84 -9,-1.3 -9,-2.4 -3,-0.1 2,-0.4 -0.934 50.7-171.5-165.2 138.9 40.6 14.9 6.6 109 109 A V E -K 98 0D 2 -2,-0.3 2,-0.8 -11,-0.2 -11,-0.2 -0.976 16.8-153.6-133.0 116.4 40.9 13.6 10.2 110 110 A D + 0 0 45 -13,-2.3 2,-0.7 -2,-0.4 77,-0.0 -0.816 17.1 173.4 -98.7 107.3 41.4 9.8 10.7 111 111 A V - 0 0 0 -2,-0.8 2,-0.1 -15,-0.1 -2,-0.0 -0.914 16.1-175.8-112.9 101.5 40.1 8.5 14.0 112 112 A D > - 0 0 54 -2,-0.7 4,-2.4 1,-0.0 5,-0.2 -0.221 43.2 -84.6 -89.9-177.4 40.4 4.7 14.0 113 113 A D H > S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.834 126.8 52.2 -57.2 -37.4 39.3 2.0 16.5 114 114 A K H > S+ 0 0 163 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.936 109.3 49.6 -65.9 -44.1 42.5 2.4 18.6 115 115 A A H > S+ 0 0 11 1,-0.2 4,-3.3 2,-0.2 -2,-0.2 0.914 112.0 49.0 -59.0 -43.8 42.0 6.2 18.9 116 116 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.912 109.7 50.3 -62.2 -44.4 38.4 5.6 19.9 117 117 A E H < S+ 0 0 113 -4,-2.4 4,-0.4 2,-0.2 -1,-0.2 0.870 113.8 47.5 -61.7 -35.8 39.4 3.0 22.6 118 118 A R H >X S+ 0 0 115 -4,-2.3 3,-1.6 2,-0.2 4,-1.0 0.941 110.6 49.2 -70.4 -48.0 41.9 5.6 23.8 119 119 A L H >X S+ 0 0 0 -4,-3.3 4,-2.6 1,-0.3 3,-0.7 0.874 104.6 61.1 -57.7 -36.8 39.3 8.4 23.8 120 120 A D H 3< S+ 0 0 25 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.716 100.6 54.8 -64.1 -19.1 37.0 6.0 25.7 121 121 A E H <4 S+ 0 0 128 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.780 112.2 41.7 -83.3 -28.8 39.7 5.9 28.4 122 122 A L H << S+ 0 0 56 -4,-1.0 -33,-0.3 -3,-0.7 -2,-0.2 0.787 95.3 102.4 -86.5 -30.1 39.6 9.7 28.7 123 123 A A S < S- 0 0 10 -4,-2.6 2,-1.2 -5,-0.2 -36,-0.2 -0.041 83.2-111.1 -54.0 153.0 35.9 10.0 28.5 124 124 A N >> - 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