==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-AUG-11 3TEN . COMPND 2 MOLECULE: CS2 HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ACIDIANUS SP. A1-3; . AUTHOR M.J.SMEULDERS,T.R.M.B.BARENDS,A.POL,A.SCHERER,M.H.ZANDVOORT, . 1608 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 58830.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1084 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 168 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 107 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 176 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 458 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 43 2.7 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 11 8 0 8 0 0 0 8 8 0 16 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 8 8 8 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 8 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 0 0 0 0 0 0 0 4 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 3 A S > 0 0 28 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -58.5 -11.0 2.5 36.3 2 4 A E H > + 0 0 139 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.819 360.0 50.7 -56.6 -38.2 -10.6 6.3 36.8 3 5 A Y H > S+ 0 0 124 2,-0.2 4,-1.9 3,-0.2 5,-0.2 0.909 109.7 48.5 -66.3 -43.8 -8.0 5.9 34.0 4 6 A I H > S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.935 112.9 47.0 -67.4 -47.5 -10.4 4.0 31.8 5 7 A D H X S+ 0 0 55 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.947 112.3 50.8 -52.9 -55.3 -13.2 6.5 32.3 6 8 A S H X S+ 0 0 52 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.842 115.0 42.7 -50.2 -40.6 -10.8 9.4 31.6 7 9 A E H X S+ 0 0 83 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.809 112.5 53.0 -83.8 -31.3 -9.6 7.7 28.4 8 10 A L H X S+ 0 0 26 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.890 107.3 51.3 -68.6 -41.2 -13.1 6.7 27.3 9 11 A K H X S+ 0 0 108 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.874 107.5 54.7 -61.5 -36.5 -14.4 10.3 27.7 10 12 A R H X S+ 0 0 135 -4,-1.1 4,-1.3 -5,-0.3 -2,-0.2 0.908 110.4 45.5 -63.0 -43.2 -11.4 11.3 25.5 11 13 A L H X S+ 0 0 36 -4,-1.8 4,-3.1 2,-0.2 -2,-0.2 0.896 110.3 53.2 -62.3 -47.2 -12.5 8.9 22.8 12 14 A E H X S+ 0 0 55 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.899 110.2 49.3 -56.4 -41.6 -16.1 10.0 23.1 13 15 A D H < S+ 0 0 51 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.787 113.3 45.7 -69.6 -29.7 -14.9 13.6 22.6 14 16 A Y H >< S+ 0 0 42 -4,-1.3 3,-0.9 2,-0.2 -2,-0.2 0.890 111.8 50.4 -78.8 -44.0 -12.8 12.6 19.5 15 17 A A H 3< S+ 0 0 0 -4,-3.1 -2,-0.2 1,-0.2 363,-0.2 0.727 121.3 34.4 -64.2 -23.1 -15.6 10.6 18.0 16 18 A L T >X S+ 0 0 0 -4,-1.1 4,-2.8 -5,-0.2 3,-1.0 0.045 70.7 126.9-126.5 24.9 -18.1 13.4 18.4 17 19 A R H <>>S+ 0 0 23 -3,-0.9 5,-3.4 1,-0.3 4,-1.5 0.852 79.8 51.9 -47.5 -41.4 -16.1 16.7 17.9 18 20 A R H 345S+ 0 0 4 272,-0.3 -1,-0.3 3,-0.2 786,-0.1 0.740 112.2 45.3 -75.8 -27.3 -18.6 17.8 15.3 19 21 A V H <45S+ 0 0 26 -3,-1.0 785,-1.6 784,-0.2 -2,-0.2 0.903 118.6 42.5 -70.2 -48.2 -21.5 17.1 17.6 20 22 A K H <5S- 0 0 64 -4,-2.8 -2,-0.2 783,-0.2 -3,-0.2 0.581 114.6-109.8 -82.7 -13.0 -19.8 18.8 20.6 21 23 A G T <5 + 0 0 18 -4,-1.5 786,-0.3 -5,-0.3 -3,-0.2 0.922 61.7 155.4 79.4 50.0 -18.4 21.8 18.7 22 24 A I < - 0 0 48 -5,-3.4 -1,-0.3 -6,-0.1 3,-0.1 -0.939 31.2-142.9-110.1 127.2 -14.8 20.8 18.9 23 25 A P - 0 0 26 0, 0.0 54,-0.1 0, 0.0 28,-0.0 -0.258 30.0 -81.7 -83.8 172.8 -12.5 22.2 16.2 24 26 A N > - 0 0 2 52,-0.4 3,-0.8 1,-0.1 26,-0.2 -0.258 54.0 -97.8 -64.7 163.7 -9.6 20.6 14.4 25 27 A N T 3 S+ 0 0 88 24,-2.3 25,-0.2 1,-0.2 26,-0.1 0.751 120.3 27.7 -63.4 -23.7 -6.4 20.7 16.4 26 28 A R T 3 S- 0 0 95 24,-1.9 -1,-0.2 23,-0.2 53,-0.1 0.340 99.0-122.2-121.1 5.8 -5.0 23.7 14.6 27 29 A R < + 0 0 78 -3,-0.8 52,-1.8 1,-0.2 53,-1.5 0.927 67.3 142.2 52.7 49.4 -8.2 25.6 13.5 28 30 A L E -ab 51 80A 6 22,-0.6 24,-2.6 50,-0.2 2,-0.4 -0.938 40.0-168.7-128.9 138.8 -6.9 25.3 9.9 29 31 A W E -ab 52 81A 0 51,-2.3 53,-2.2 -2,-0.4 2,-0.4 -0.999 13.1-161.0-126.9 133.2 -8.5 24.6 6.5 30 32 A V E -ab 53 82A 0 22,-2.8 24,-3.7 -2,-0.4 2,-0.5 -0.950 8.7-159.3-118.6 132.0 -6.3 23.9 3.5 31 33 A L E +ab 54 83A 0 51,-2.3 53,-3.1 -2,-0.4 2,-0.3 -0.964 34.9 142.3-104.5 121.9 -7.3 24.1 -0.2 32 34 A T E -ab 55 84A 0 22,-2.4 24,-1.7 -2,-0.5 27,-0.5 -0.877 49.1 -81.6-147.8 179.0 -5.0 22.0 -2.4 33 35 A C E -a 56 0A 6 51,-0.6 24,-0.2 25,-0.3 222,-0.1 -0.507 28.8-127.0 -87.4 156.3 -5.0 19.8 -5.5 34 36 A M + 0 0 4 22,-2.0 221,-1.8 -2,-0.2 23,-0.1 0.568 65.2 133.2 -75.4 -11.1 -6.0 16.1 -5.5 35 37 A D > - 0 0 5 21,-0.3 3,-1.0 219,-0.2 219,-0.1 -0.062 61.2-131.5 -46.9 139.2 -2.7 15.2 -7.2 36 38 A E T 3 S+ 0 0 3 1,-0.2 216,-0.1 215,-0.2 -1,-0.1 0.754 102.6 60.3 -63.3 -30.8 -0.9 12.2 -5.6 37 39 A R T 3 S+ 0 0 0 214,-0.1 2,-1.4 1,-0.1 -1,-0.2 0.657 80.1 92.1 -79.2 -15.7 2.4 14.0 -5.5 38 40 A V < - 0 0 2 -3,-1.0 2,-1.4 212,-0.1 3,-0.1 -0.670 54.4-176.1 -82.8 94.2 1.1 16.7 -3.2 39 41 A H > + 0 0 40 -2,-1.4 4,-1.5 1,-0.2 -1,-0.1 -0.725 12.5 179.7 -91.3 85.9 2.0 15.3 0.2 40 42 A I H > + 0 0 5 -2,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.841 63.5 51.2 -71.3 -42.1 0.3 18.2 1.9 41 43 A E H >>S+ 0 0 56 1,-0.2 5,-2.3 2,-0.2 4,-1.3 0.923 110.4 49.2 -64.7 -45.3 0.6 17.5 5.7 42 44 A Q H 45S+ 0 0 103 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.908 110.8 51.4 -60.5 -40.3 4.4 16.9 5.6 43 45 A S H <5S+ 0 0 20 -4,-1.5 137,-0.3 1,-0.2 -1,-0.2 0.819 113.8 43.1 -68.0 -32.6 4.9 20.1 3.5 44 46 A L H <5S- 0 0 9 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.609 109.9-124.0 -84.6 -14.4 2.9 22.2 6.0 45 47 A G T <5 + 0 0 59 -4,-1.3 2,-0.2 -3,-0.3 -3,-0.2 0.855 64.6 135.8 72.7 37.2 4.5 20.5 9.0 46 48 A I < - 0 0 13 -5,-2.3 -1,-0.3 -6,-0.1 -2,-0.1 -0.746 51.8-119.8-118.7 164.8 1.2 19.4 10.5 47 49 A Q > - 0 0 131 -2,-0.2 3,-2.5 -3,-0.1 4,-0.4 -0.624 38.2 -96.1-100.6 157.8 -0.2 16.2 12.0 48 50 A P G > S+ 0 0 51 0, 0.0 3,-0.5 0, 0.0 192,-0.1 0.791 122.2 42.6 -41.9 -46.1 -3.2 14.1 10.8 49 51 A D G 3 S+ 0 0 31 1,-0.2 -24,-2.3 190,-0.1 -23,-0.2 0.341 92.8 89.1 -88.0 8.0 -5.7 15.7 13.1 50 52 A D G < S+ 0 0 14 -3,-2.5 -24,-1.9 -25,-0.2 -22,-0.6 0.770 88.3 18.5 -78.8 -28.9 -4.5 19.3 12.7 51 53 A A E < -a 28 0A 2 -3,-0.5 2,-0.5 -4,-0.4 -22,-0.2 -0.912 64.0-116.2-143.4 160.4 -6.5 20.5 9.7 52 54 A H E -a 29 0A 2 -24,-2.6 -22,-2.8 -2,-0.3 2,-0.6 -0.918 38.2-155.4 -92.9 126.3 -9.5 20.2 7.4 53 55 A I E -a 30 0A 4 183,-1.9 2,-0.5 -2,-0.5 -22,-0.2 -0.928 9.3-167.1-115.2 111.6 -8.0 19.5 4.0 54 56 A Y E -a 31 0A 0 -24,-3.7 -22,-2.4 -2,-0.6 2,-0.4 -0.848 12.3-177.5 -93.5 132.6 -10.1 20.3 0.9 55 57 A R E +aC 32 257A 12 202,-2.1 202,-2.2 -2,-0.5 2,-0.2 -0.988 11.8 149.3-138.2 126.6 -8.8 18.8 -2.3 56 58 A N E > -a 33 0A 0 -24,-1.7 -22,-2.0 -2,-0.4 2,-1.2 -0.769 60.5 -60.0-136.0-177.0 -10.0 19.2 -5.9 57 59 A A T 3 S- 0 0 1 209,-0.3 3,-0.2 -2,-0.2 -24,-0.1 -0.606 124.6 -1.7 -70.8 97.5 -8.6 19.2 -9.4 58 60 A G T 3 S- 0 0 0 -2,-1.2 -25,-0.3 1,-0.2 -1,-0.2 0.239 100.3 -98.6 112.3 -10.3 -6.1 22.1 -9.3 59 61 A G S < S+ 0 0 2 -3,-0.7 2,-0.3 -27,-0.5 -26,-0.2 0.934 76.8 155.3 58.1 44.5 -6.6 23.4 -5.8 60 62 A I - 0 0 2 -3,-0.2 2,-0.7 -28,-0.2 -1,-0.2 -0.782 53.9-102.3-107.9 147.6 -8.8 26.0 -7.4 61 63 A V + 0 0 2 -2,-0.3 259,-0.4 -3,-0.1 2,-0.2 -0.600 53.1 164.1 -73.3 109.4 -11.6 28.0 -5.7 62 64 A T > - 0 0 0 -2,-0.7 4,-2.2 257,-0.1 5,-0.2 -0.613 55.8 -96.6-112.3 174.4 -14.8 26.3 -6.8 63 65 A D H > S+ 0 0 1 -2,-0.2 4,-2.9 1,-0.2 5,-0.1 0.887 127.9 53.4 -58.6 -38.0 -18.4 26.7 -5.3 64 66 A D H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 195,-0.3 0.893 107.0 50.7 -65.1 -40.4 -17.6 23.5 -3.4 65 67 A A H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.934 113.8 44.7 -60.6 -46.0 -14.4 25.0 -2.0 66 68 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 251,-0.2 -2,-0.2 0.882 112.6 52.1 -67.9 -40.3 -16.3 28.1 -0.9 67 69 A R H X S+ 0 0 1 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.969 115.0 41.4 -54.4 -55.3 -19.1 25.9 0.5 68 70 A S H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.871 115.1 50.4 -65.5 -39.8 -16.7 23.8 2.5 69 71 A A H X S+ 0 0 0 -4,-2.9 4,-1.9 -5,-0.2 5,-0.3 0.861 108.3 52.8 -66.8 -37.6 -14.6 26.9 3.6 70 72 A S H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.3 0.891 111.4 46.9 -66.3 -38.4 -17.7 28.7 4.7 71 73 A L H X>S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.2 5,-1.4 0.905 112.5 47.6 -68.4 -44.3 -18.8 25.8 6.9 72 74 A T H <5S+ 0 0 0 -4,-2.0 6,-2.5 3,-0.2 4,-0.2 0.882 118.5 40.5 -67.3 -37.6 -15.4 25.2 8.5 73 75 A T H <5S+ 0 0 7 -4,-1.9 4,-0.2 4,-0.2 -2,-0.2 0.897 123.4 35.8 -78.7 -45.0 -14.8 28.9 9.4 74 76 A N H <5S+ 0 0 12 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.840 136.1 16.2 -79.1 -34.8 -18.3 29.8 10.5 75 77 A F T <5S+ 0 0 6 -4,-2.1 731,-2.3 -5,-0.3 -3,-0.2 0.756 125.9 45.3-113.4 -34.9 -19.3 26.6 12.2 76 78 A F S - d 0 173A 0 86,-0.3 3,-0.7 -28,-0.2 88,-0.2 -0.981 13.2 -92.2-152.8 163.6 1.4 22.9 -7.1 87 89 A T T 3 S+ 0 0 0 86,-2.4 1115,-0.2 -2,-0.3 88,-0.1 -0.427 103.8 19.4 -77.8 152.6 3.8 22.4 -10.0 88 90 A D T 3 S+ 0 0 0 1113,-3.0 132,-0.3 1,-0.2 -1,-0.2 0.803 84.5 175.1 54.7 35.2 3.0 20.2 -13.0 89 91 A C X - 0 0 0 -3,-0.7 3,-2.0 1112,-0.4 -1,-0.2 -0.470 37.9-130.3 -70.6 139.4 -0.7 20.5 -12.1 90 92 A G G >> S+ 0 0 5 1,-0.3 3,-2.2 2,-0.2 4,-0.5 0.818 106.7 66.8 -59.2 -32.5 -3.0 18.8 -14.7 91 93 A M G 34 S+ 0 0 2 1,-0.3 46,-2.6 2,-0.2 47,-0.4 0.554 101.8 49.6 -65.8 -8.5 -5.1 22.0 -14.8 92 94 A L G <4 S+ 0 0 0 -3,-2.0 1113,-1.4 44,-0.2 -1,-0.3 0.099 104.4 60.7-111.9 17.5 -2.0 23.6 -16.4 93 95 A R T <4 S+ 0 0 0 -3,-2.2 1114,-2.7 1111,-0.2 2,-0.3 0.450 105.6 31.1-122.1 -8.6 -1.5 20.8 -19.0 94 96 A F < - 0 0 2 -4,-0.5 44,-0.4 1112,-0.2 2,-0.3 -0.864 68.7-123.3-143.0 173.5 -4.8 20.9 -20.9 95 97 A T > - 0 0 25 -2,-0.3 4,-1.8 43,-0.1 5,-0.1 -0.901 21.1-126.0-122.4 153.0 -7.5 23.3 -22.1 96 98 A G H > S+ 0 0 0 -2,-0.3 4,-3.2 2,-0.2 5,-0.2 0.796 112.3 59.7 -66.4 -30.0 -11.3 23.1 -21.6 97 99 A E H > S+ 0 0 86 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.931 106.5 46.8 -60.0 -49.2 -11.8 23.3 -25.3 98 100 A E H > S+ 0 0 59 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.899 115.2 46.2 -55.4 -46.9 -9.8 20.1 -25.7 99 101 A V H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.924 114.0 46.9 -66.4 -47.7 -11.8 18.5 -22.9 100 102 A A H X S+ 0 0 0 -4,-3.2 4,-2.5 2,-0.2 5,-0.2 0.939 113.1 49.5 -58.8 -48.6 -15.1 19.7 -24.3 101 103 A K H X S+ 0 0 142 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.871 108.4 54.7 -58.5 -38.1 -14.1 18.5 -27.8 102 104 A Y H X S+ 0 0 53 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.2 0.902 110.2 46.0 -60.6 -42.3 -13.1 15.2 -26.3 103 105 A F H >X>S+ 0 0 4 -4,-2.0 5,-2.2 2,-0.2 4,-1.4 0.906 109.2 51.5 -73.1 -42.2 -16.6 14.7 -24.7 104 106 A I H 3<5S+ 0 0 79 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.877 104.0 61.8 -61.0 -34.7 -18.6 15.7 -27.8 105 107 A S H 3<5S+ 0 0 98 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.813 104.7 46.5 -58.8 -34.3 -16.6 13.1 -29.7 106 108 A K H <<5S- 0 0 148 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.792 131.0 -95.5 -77.9 -29.7 -17.9 10.4 -27.4 107 109 A G T <5S+ 0 0 55 -4,-1.4 -3,-0.2 1,-0.2 2,-0.2 0.483 70.8 150.2 126.5 14.7 -21.4 11.7 -27.8 108 110 A I < - 0 0 29 -5,-2.2 -1,-0.2 -8,-0.1 3,-0.1 -0.528 37.4-147.2 -79.0 140.6 -21.9 14.0 -24.8 109 111 A K > - 0 0 138 -2,-0.2 3,-2.2 1,-0.2 4,-0.2 -0.855 7.3-159.8-110.4 94.5 -24.3 17.0 -25.1 110 112 A P G > S+ 0 0 13 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.777 87.7 57.2 -42.4 -45.7 -22.8 19.7 -22.8 111 113 A T G 3 S+ 0 0 95 1,-0.2 14,-0.3 -3,-0.1 13,-0.3 0.815 112.2 40.6 -57.5 -35.2 -26.0 21.6 -22.5 112 114 A E G < S+ 0 0 149 -3,-2.2 2,-0.5 2,-0.1 -1,-0.2 0.045 84.4 113.1-113.0 27.6 -28.0 18.6 -21.1 113 115 A V < - 0 0 18 -3,-1.2 2,-1.1 -4,-0.2 3,-0.1 -0.854 69.2-126.1 -95.7 128.2 -25.4 17.0 -18.7 114 116 A Q - 0 0 117 -2,-0.5 9,-0.1 1,-0.2 -2,-0.1 -0.637 28.6-178.0 -72.5 102.1 -26.4 17.2 -15.0 115 117 A L S S+ 0 0 3 -2,-1.1 153,-0.2 7,-0.4 -1,-0.2 0.876 80.8 23.9 -73.9 -39.3 -23.3 18.8 -13.6 116 118 A D > - 0 0 2 6,-0.5 3,-1.9 3,-0.2 -1,-0.3 -0.802 69.4-176.5-125.6 91.7 -24.6 18.7 -10.0 117 119 A P T 3 S+ 0 0 28 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.840 87.2 51.1 -51.6 -39.8 -27.2 15.8 -9.8 118 120 A L T 3 S+ 0 0 30 145,-0.4 219,-0.1 1,-0.3 146,-0.1 0.524 117.2 41.7 -79.3 -6.1 -27.9 16.7 -6.1 119 121 A L X + 0 0 1 -3,-1.9 3,-2.0 3,-0.1 -1,-0.3 -0.658 62.8 175.9-138.5 80.6 -28.5 20.4 -7.1 120 122 A P T 3 S+ 0 0 65 0, 0.0 -5,-0.1 0, 0.0 -1,-0.1 0.705 71.9 79.5 -59.7 -19.7 -30.5 20.6 -10.3 121 123 A A T 3 S+ 0 0 17 210,-0.1 2,-0.9 1,-0.1 204,-0.3 0.722 72.9 90.7 -58.4 -23.5 -30.5 24.4 -10.0 122 124 A F < + 0 0 7 -3,-2.0 -6,-0.5 -6,-0.3 -7,-0.4 -0.693 56.1 146.4 -80.8 108.0 -26.9 24.5 -11.3 123 125 A R - 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