==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-MAR-09 3GUY . COMPND 2 MOLECULE: SHORT-CHAIN DEHYDROGENASE/REDUCTASE SDR; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO PARAHAEMOLYTICUS; . AUTHOR Y.PATSKOVSKY,J.B.BONANNO,J.FREEMAN,K.T.BAIN,S.MILLER,P.SAMPA . 1685 16 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 62463.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1244 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 243 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 3.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.3 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 . 114 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 149 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 596 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 1.8 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 0 0 0 0 5 11 0 7 9 0 0 0 0 0 0 0 8 0 0 0 0 0 8 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 15 23 10 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 . 0 5 0 0 0 0 1 2 1 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 0 0 0 0 0 3 1 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 L 0 0 43 0, 0.0 71,-2.3 0, 0.0 72,-1.5 0.000 360.0 360.0 360.0 133.5 -5.0 -26.5 10.0 2 2 A I E -ab 26 73A 9 23,-2.0 25,-2.0 70,-0.2 2,-0.5 -0.944 360.0-161.1-108.2 113.6 -5.4 -23.5 12.4 3 3 A V E -ab 27 74A 0 70,-2.2 72,-3.2 -2,-0.6 2,-0.5 -0.842 9.3-168.9 -93.8 128.6 -2.4 -21.2 12.4 4 4 A I E -ab 28 75A 0 23,-2.3 25,-2.8 -2,-0.5 3,-0.4 -0.972 5.2-163.9-122.9 121.0 -2.2 -18.9 15.5 5 5 A T E S+ b 0 76A 0 70,-2.9 72,-1.0 -2,-0.5 25,-0.2 -0.649 76.1 34.0 -96.6 160.5 0.1 -15.9 15.9 6 6 A G S > S+ 0 0 19 23,-0.3 6,-0.7 -2,-0.2 3,-0.5 0.833 78.7 137.2 67.2 33.0 0.9 -14.4 19.3 7 7 A A T 3 + 0 0 0 22,-2.8 23,-0.2 -3,-0.4 3,-0.1 0.338 34.4 94.3-101.4 4.8 0.7 -17.8 20.8 8 8 A S T 3 S- 0 0 15 21,-0.3 2,-0.3 1,-0.1 -1,-0.2 0.736 106.4 -31.7 -56.4 -32.1 3.7 -17.7 23.1 9 9 A S S X> S+ 0 0 69 -3,-0.5 4,-0.9 30,-0.0 3,-0.7 -0.960 105.6 39.9-170.7-178.7 1.3 -16.6 25.9 10 10 A G H 3> S- 0 0 39 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 -0.208 113.5 -9.8 65.0-144.2 -1.9 -14.7 26.7 11 11 A L H 3> S+ 0 0 14 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.874 133.2 54.1 -61.0 -42.7 -4.9 -14.9 24.4 12 12 A G H <> S+ 0 0 0 -3,-0.7 4,-2.2 -6,-0.7 -5,-0.3 0.906 109.8 48.2 -63.1 -42.0 -3.3 -16.7 21.5 13 13 A A H X S+ 0 0 2 -4,-0.9 4,-2.3 -7,-0.4 -1,-0.2 0.924 111.0 51.1 -61.5 -43.3 -2.1 -19.6 23.8 14 14 A E H X S+ 0 0 42 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.881 110.4 48.0 -67.2 -38.5 -5.5 -19.9 25.4 15 15 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.901 107.7 55.2 -65.2 -45.3 -7.2 -20.2 22.0 16 16 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.946 107.4 52.2 -53.9 -44.7 -4.6 -22.8 20.8 17 17 A K H X S+ 0 0 71 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.897 109.8 48.3 -56.2 -42.7 -5.6 -24.8 24.0 18 18 A L H X S+ 0 0 51 -4,-1.8 4,-0.8 2,-0.2 -1,-0.2 0.912 113.6 44.9 -68.6 -42.9 -9.3 -24.6 23.1 19 19 A Y H ><>S+ 0 0 16 -4,-2.5 5,-1.8 1,-0.2 3,-0.9 0.914 111.9 52.6 -64.8 -44.5 -8.9 -25.7 19.5 20 20 A D H ><5S+ 0 0 13 -4,-2.9 3,-2.6 -5,-0.3 -1,-0.2 0.929 103.8 58.3 -54.3 -46.9 -6.5 -28.4 20.4 21 21 A A H 3<5S+ 0 0 84 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.699 101.7 54.4 -62.5 -22.1 -9.2 -29.7 22.9 22 22 A E T <<5S- 0 0 87 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.308 124.5-104.0 -88.4 8.5 -11.7 -30.1 20.1 23 23 A G T < 5S+ 0 0 46 -3,-2.6 2,-0.4 1,-0.2 -3,-0.2 0.606 74.0 142.1 84.5 12.0 -9.2 -32.3 18.2 24 24 A K < - 0 0 86 -5,-1.8 -1,-0.2 1,-0.0 21,-0.2 -0.719 51.9-119.3 -95.4 136.1 -8.1 -29.7 15.6 25 25 A A - 0 0 36 -2,-0.4 -23,-2.0 21,-0.1 2,-0.3 -0.483 33.5-170.8 -68.6 137.3 -4.5 -29.4 14.5 26 26 A T E -a 2 0A 0 19,-0.4 21,-2.9 -25,-0.2 2,-0.4 -0.892 19.2-158.5-126.3 162.4 -2.7 -26.1 15.2 27 27 A Y E -a 3 0A 21 -25,-2.0 -23,-2.3 -2,-0.3 2,-0.4 -0.983 24.4-153.0-139.3 120.5 0.6 -24.5 14.2 28 28 A L E -ac 4 49A 0 20,-2.1 22,-1.9 -2,-0.4 2,-0.3 -0.783 14.3-173.8-105.4 145.0 1.8 -21.8 16.5 29 29 A T E + c 0 50A 0 -25,-2.8 -22,-2.8 -2,-0.4 -23,-0.3 -0.968 18.7 135.0-130.9 156.2 4.0 -18.7 16.2 30 30 A G E - c 0 51A 6 20,-0.8 22,-2.7 -2,-0.3 3,-0.0 -0.947 59.9 -93.9-173.3 178.3 5.3 -16.2 18.6 31 31 A R S S+ 0 0 148 -2,-0.3 2,-0.8 20,-0.2 -1,-0.1 0.885 102.6 69.6 -76.6 -40.2 8.5 -14.3 19.6 32 32 A S > - 0 0 25 1,-0.2 4,-2.5 19,-0.1 5,-0.2 -0.712 56.3-170.1 -94.1 111.1 9.7 -16.8 22.3 33 33 A E H > S+ 0 0 139 -2,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.903 92.0 48.0 -55.2 -42.5 10.9 -20.2 21.1 34 34 A S H > S+ 0 0 85 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.920 110.7 48.3 -73.4 -45.0 10.9 -21.4 24.7 35 35 A K H > S+ 0 0 113 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.894 111.8 51.8 -58.2 -40.7 7.5 -20.2 25.6 36 36 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.915 107.2 52.2 -63.2 -43.7 6.2 -21.8 22.4 37 37 A S H X S+ 0 0 35 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.932 110.9 49.4 -52.7 -42.8 7.8 -25.1 23.3 38 38 A T H X S+ 0 0 91 -4,-2.0 4,-0.8 1,-0.2 -2,-0.2 0.911 111.0 47.2 -68.4 -44.8 6.0 -24.8 26.7 39 39 A V H >< S+ 0 0 13 -4,-2.4 3,-0.8 1,-0.2 4,-0.2 0.926 112.1 49.0 -62.2 -44.6 2.6 -24.1 25.3 40 40 A T H >< S+ 0 0 12 -4,-2.3 3,-1.6 1,-0.2 6,-0.2 0.778 96.7 69.9 -72.9 -25.7 2.7 -26.9 22.7 41 41 A N H 3< S+ 0 0 129 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.839 98.7 53.4 -56.8 -32.8 3.9 -29.5 25.3 42 42 A C T << S+ 0 0 83 -3,-0.8 -1,-0.3 -4,-0.8 2,-0.3 0.596 97.2 87.1 -69.0 -18.3 0.3 -29.2 26.6 43 43 A L < - 0 0 19 -3,-1.6 -26,-0.1 -4,-0.2 -27,-0.0 -0.634 52.0-171.5 -96.6 150.0 -1.2 -29.9 23.3 44 44 A S S S+ 0 0 108 -2,-0.3 -1,-0.1 1,-0.1 -19,-0.1 0.625 88.0 38.3-109.7 -18.7 -2.1 -33.3 21.7 45 45 A N S S+ 0 0 65 -21,-0.2 -19,-0.4 2,-0.0 2,-0.1 0.299 83.4 126.7-114.8 8.4 -3.0 -32.4 18.2 46 46 A N - 0 0 36 -6,-0.2 -19,-0.2 -21,-0.2 3,-0.1 -0.395 40.5-165.3 -69.1 144.2 -0.3 -29.6 17.6 47 47 A V - 0 0 90 -21,-2.9 2,-0.2 1,-0.4 -20,-0.1 0.114 56.5 -57.8-119.7 21.1 1.8 -30.1 14.5 48 48 A G - 0 0 21 -22,-0.3 -20,-2.1 -8,-0.0 -1,-0.4 -0.740 40.3-130.0 133.4 176.5 4.6 -27.5 15.3 49 49 A Y E -c 28 0A 88 -22,-0.2 2,-0.3 -2,-0.2 -20,-0.2 -0.958 9.3-161.4-157.5 165.9 5.6 -24.0 16.1 50 50 A R E -c 29 0A 49 -22,-1.9 -20,-0.8 -2,-0.3 2,-0.3 -0.889 21.3-127.7-160.1 124.0 8.1 -21.5 14.9 51 51 A A E +c 30 0A 18 -2,-0.3 2,-0.3 -22,-0.2 -20,-0.2 -0.542 40.8 172.0 -70.9 132.8 9.5 -18.4 16.6 52 52 A R - 0 0 36 -22,-2.7 2,-0.8 -2,-0.3 -2,-0.0 -1.000 41.2-131.9-147.3 144.9 9.1 -15.4 14.3 53 53 A D > - 0 0 79 -2,-0.3 3,-1.7 1,-0.1 7,-0.2 -0.871 22.8-165.9 -89.5 106.2 9.6 -11.6 14.2 54 54 A L T 3 S+ 0 0 15 -2,-0.8 53,-0.2 1,-0.3 54,-0.1 0.636 82.3 69.9 -77.9 -9.4 6.3 -10.6 12.5 55 55 A A T 3 S+ 0 0 29 52,-0.1 2,-0.7 1,-0.1 -1,-0.3 0.590 86.3 81.5 -74.7 -15.9 7.6 -7.1 11.9 56 56 A S <> - 0 0 22 -3,-1.7 4,-2.1 1,-0.2 5,-0.2 -0.836 67.1-160.4 -94.7 110.8 9.9 -8.7 9.4 57 57 A H H > S+ 0 0 41 -2,-0.7 4,-2.4 1,-0.2 5,-0.2 0.860 93.4 55.3 -56.8 -34.2 8.2 -9.3 6.0 58 58 A Q H > S+ 0 0 86 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.950 107.4 48.0 -62.8 -47.9 11.0 -11.9 5.2 59 59 A E H > S+ 0 0 58 1,-0.2 4,-1.7 -6,-0.2 -2,-0.2 0.856 112.9 48.7 -64.9 -31.2 10.3 -13.9 8.3 60 60 A V H X S+ 0 0 0 -4,-2.1 4,-1.7 -7,-0.2 -1,-0.2 0.880 107.8 53.4 -74.1 -40.4 6.5 -13.9 7.7 61 61 A E H X S+ 0 0 76 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.921 111.8 47.4 -57.9 -41.7 7.0 -15.0 4.0 62 62 A Q H X S+ 0 0 78 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.852 104.6 60.3 -65.8 -40.0 9.1 -18.0 5.4 63 63 A L H < S+ 0 0 0 -4,-1.7 4,-0.4 -5,-0.2 -1,-0.2 0.922 114.2 34.4 -53.8 -48.6 6.5 -18.8 8.0 64 64 A F H < S+ 0 0 2 -4,-1.7 3,-0.5 2,-0.2 -2,-0.2 0.826 113.2 58.2 -82.6 -30.6 3.9 -19.5 5.4 65 65 A E H < S+ 0 0 130 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.904 103.2 54.7 -60.9 -42.2 6.2 -20.9 2.7 66 66 A Q S < S+ 0 0 129 -4,-2.3 -1,-0.2 -5,-0.1 2,-0.2 0.710 87.3 104.4 -67.1 -20.3 7.3 -23.7 5.1 67 67 A L - 0 0 22 -3,-0.5 -3,-0.0 -4,-0.4 -4,-0.0 -0.425 60.5-154.8 -70.2 135.1 3.7 -24.7 5.7 68 68 A D S S+ 0 0 146 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.739 71.1 39.7 -79.2 -28.1 2.5 -27.9 3.9 69 69 A S S S- 0 0 49 0, 0.0 -2,-0.0 0, 0.0 3,-0.0 -0.779 85.8-101.7-125.0 164.1 -1.2 -27.1 3.7 70 70 A I - 0 0 84 -2,-0.3 -2,-0.0 1,-0.0 46,-0.0 -0.782 49.8-122.3 -78.7 116.6 -3.6 -24.3 3.0 71 71 A P - 0 0 1 0, 0.0 -69,-0.2 0, 0.0 3,-0.1 -0.283 12.5-152.7 -63.8 149.7 -4.8 -23.2 6.5 72 72 A S S S+ 0 0 58 -71,-2.3 50,-2.3 1,-0.3 2,-0.3 0.764 82.8 14.0 -88.7 -28.2 -8.5 -23.3 7.2 73 73 A T E -bd 2 122A 19 -72,-1.5 -70,-2.2 48,-0.2 2,-0.4 -0.996 61.5-163.2-145.7 139.1 -8.3 -20.5 9.9 74 74 A V E -bd 3 123A 0 48,-2.4 50,-3.0 -2,-0.3 2,-0.6 -0.988 8.4-161.5-126.1 124.7 -5.6 -18.0 10.8 75 75 A V E -bd 4 124A 0 -72,-3.2 -70,-2.9 -2,-0.4 2,-0.9 -0.939 2.6-161.3-108.4 114.1 -5.9 -16.3 14.2 76 76 A H E +bd 5 125A 4 48,-2.8 50,-2.4 -2,-0.6 -70,-0.1 -0.857 30.8 147.3 -99.3 102.1 -3.8 -13.2 14.5 77 77 A S + 0 0 22 -72,-1.0 -65,-0.2 -2,-0.9 -71,-0.2 0.302 25.1 128.1-115.3 11.5 -3.3 -12.4 18.2 78 78 A A + 0 0 8 -66,-0.1 2,-0.3 26,-0.1 27,-0.1 -0.380 33.3 107.2 -69.6 140.6 0.1 -10.9 18.1 79 79 A G - 0 0 24 -2,-0.1 2,-0.3 25,-0.1 22,-0.1 -0.955 43.5-147.4 170.3 177.4 0.3 -7.5 19.9 80 80 A S - 0 0 31 -2,-0.3 2,-0.3 17,-0.2 21,-0.0 -0.962 15.1-124.1-162.9 159.0 1.5 -5.7 23.0 81 81 A G + 0 0 42 -2,-0.3 2,-0.3 20,-0.0 57,-0.0 -0.710 21.7 172.3-109.1 159.9 0.5 -2.8 25.2 82 82 A Y - 0 0 44 -2,-0.3 59,-0.3 2,-0.0 2,-0.3 -0.826 15.1-176.7-166.2 131.9 2.2 0.3 26.3 83 83 A F + 0 0 104 -2,-0.3 55,-0.2 57,-0.1 2,-0.2 -0.827 21.3 100.7-139.5 164.8 0.5 3.1 28.2 84 84 A G S S- 0 0 15 53,-2.6 55,-0.4 -2,-0.3 56,-0.2 -0.601 73.7 -56.4 136.7 157.9 1.0 6.5 29.7 85 85 A L >> - 0 0 58 -2,-0.2 3,-1.5 1,-0.1 4,-0.9 -0.428 61.1-112.1 -62.4 142.8 0.3 10.1 29.0 86 86 A L G >4 S+ 0 0 0 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.882 115.7 54.7 -56.5 -40.1 1.8 10.9 25.6 87 87 A Q G 34 S+ 0 0 12 1,-0.3 -1,-0.3 228,-0.1 -2,-0.0 0.774 108.8 49.7 -64.2 -25.5 4.5 13.2 27.0 88 88 A E G <4 S+ 0 0 110 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.548 88.5 105.1 -90.2 -7.7 5.7 10.5 29.4 89 89 A Q S << S- 0 0 2 -3,-1.1 -5,-0.1 -4,-0.9 3,-0.0 -0.482 72.2-125.6 -76.1 146.3 5.9 7.8 26.7 90 90 A D >> - 0 0 72 -2,-0.2 4,-2.1 1,-0.1 3,-0.8 -0.792 10.3-141.5 -89.5 123.9 9.4 6.7 25.5 91 91 A P H 3> S+ 0 0 17 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.780 101.5 59.7 -58.1 -28.6 9.7 7.0 21.7 92 92 A E H 3> S+ 0 0 135 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.887 109.3 43.4 -68.2 -34.7 11.8 3.8 21.6 93 93 A Q H <> S+ 0 0 88 -3,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.809 109.4 56.3 -77.4 -33.9 8.9 1.9 23.2 94 94 A I H X S+ 0 0 6 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.929 107.0 50.8 -58.6 -45.9 6.3 3.6 20.9 95 95 A Q H X S+ 0 0 64 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.932 109.9 49.1 -59.6 -42.8 8.4 2.3 18.0 96 96 A T H X S+ 0 0 54 -4,-1.6 4,-2.6 1,-0.2 5,-0.2 0.903 108.1 55.1 -60.3 -41.2 8.2 -1.2 19.5 97 97 A L H X S+ 0 0 3 -4,-2.4 4,-1.7 2,-0.2 5,-0.5 0.902 108.0 48.0 -56.6 -44.2 4.5 -0.8 19.9 98 98 A I H X>S+ 0 0 4 -4,-2.1 5,-2.3 2,-0.2 4,-1.6 0.946 113.2 49.2 -63.5 -42.9 4.1 -0.0 16.2 99 99 A E H <>S+ 0 0 67 -4,-2.5 5,-1.5 1,-0.2 -2,-0.2 0.946 114.0 43.8 -60.3 -48.4 6.3 -3.1 15.3 100 100 A N H <5S+ 0 0 24 -4,-2.6 -1,-0.2 3,-0.2 -2,-0.2 0.792 129.0 23.1 -70.2 -29.1 4.4 -5.5 17.5 101 101 A N H X5S+ 0 0 1 -4,-1.7 4,-1.0 -5,-0.2 -3,-0.2 0.867 131.1 25.8-106.2 -53.9 0.9 -4.4 16.6 102 102 A L H X5S+ 0 0 0 -4,-1.6 4,-2.7 -5,-0.5 -3,-0.2 0.931 122.9 45.0 -83.4 -50.8 0.7 -2.6 13.2 103 103 A S H >< S+ 0 0 18 -4,-2.7 3,-2.2 -5,-0.2 5,-0.5 0.265 73.7 112.4-130.3 8.9 -4.8 -17.5 0.0 117 117 A K T 3< S+ 0 0 42 -4,-1.5 47,-1.6 1,-0.3 -4,-0.1 0.785 87.0 52.7 -57.4 -28.6 -7.4 -14.8 -1.0 118 118 A D T 3 S+ 0 0 95 -5,-0.2 -1,-0.3 45,-0.2 -2,-0.1 0.146 100.1 79.3 -93.4 18.0 -8.9 -17.3 -3.4 119 119 A Q S < S- 0 0 72 -3,-2.2 2,-2.4 2,-0.1 -3,-0.1 -0.895 94.4-106.1-121.5 153.1 -9.2 -20.0 -0.7 120 120 A P + 0 0 89 0, 0.0 2,-0.4 0, 0.0 44,-0.2 -0.239 61.7 155.4 -76.1 58.7 -12.0 -20.3 1.9 121 121 A V - 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