==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-APR-98 1KVW . COMPND 2 MOLECULE: PHOSPHOLIPASE A2; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.SUNDARALINGAM . 123 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7192.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 79 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 7 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 35.8 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+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 1 0 0 0 0 0 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 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 A >> 0 0 0 0, 0.0 4,-2.0 0, 0.0 3,-1.4 0.000 360.0 360.0 360.0-155.4 32.8 4.4 76.2 2 2 A L H 3> + 0 0 60 67,-2.1 4,-2.8 1,-0.3 5,-0.2 0.662 360.0 49.6 -26.2 -75.0 33.2 1.7 73.6 3 3 A W H 3> S+ 0 0 154 66,-0.4 4,-1.3 1,-0.2 -1,-0.3 0.935 118.0 44.1 -45.5 -41.0 33.2 -1.4 76.0 4 4 A Q H <> S+ 0 0 34 -3,-1.4 4,-1.5 65,-0.2 -2,-0.3 0.868 112.4 50.7 -70.9 -39.7 30.0 0.2 77.4 5 5 A F H X S+ 0 0 23 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.851 105.5 55.5 -66.5 -39.0 28.5 1.0 74.1 6 6 A N H X S+ 0 0 26 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.924 109.4 48.6 -59.0 -40.7 29.1 -2.5 72.8 7 7 A G H X S+ 0 0 17 -4,-1.3 4,-1.7 -5,-0.2 -1,-0.2 0.805 106.5 55.3 -69.0 -33.3 27.1 -3.8 75.8 8 8 A M H X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.901 110.2 46.2 -63.8 -42.9 24.3 -1.3 75.2 9 9 A I H X S+ 0 0 5 -4,-2.0 4,-3.3 2,-0.2 -2,-0.2 0.876 113.3 48.8 -66.4 -41.8 23.9 -2.7 71.6 10 10 A K H < S+ 0 0 70 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.810 105.9 59.7 -68.8 -27.1 24.1 -6.3 72.9 11 11 A a H < S+ 0 0 5 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.944 118.2 28.4 -62.9 -48.7 21.5 -5.4 75.5 12 12 A K H < S+ 0 0 47 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.843 131.1 37.0 -82.1 -38.6 19.0 -4.4 72.8 13 13 A I S >< S- 0 0 34 -4,-3.3 3,-1.5 -5,-0.1 -1,-0.3 -0.785 71.4-179.1-120.5 86.2 20.2 -6.7 69.9 14 14 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.656 75.3 57.6 -57.1 -29.3 21.2 -9.9 71.9 15 15 A S T 3 S+ 0 0 115 2,-0.0 2,-0.1 0, 0.0 -5,-0.1 0.500 91.6 100.4 -84.7 -6.7 22.3 -11.9 68.8 16 16 A S < - 0 0 7 -3,-1.5 3,-0.1 -7,-0.2 -3,-0.0 -0.418 57.2-159.8 -86.8 160.2 24.9 -9.3 67.9 17 17 A E >> - 0 0 93 -2,-0.1 3,-2.4 1,-0.1 4,-2.2 -0.823 25.4-162.8-132.9 80.9 28.6 -9.0 68.4 18 18 A P H 3> S+ 0 0 4 0, 0.0 4,-2.1 0, 0.0 5,-0.3 0.713 81.4 55.3 -39.5 -47.3 28.7 -5.2 67.9 19 19 A L H 34 S+ 0 0 69 1,-0.2 -13,-0.0 2,-0.2 -3,-0.0 0.643 118.7 38.0 -71.3 -8.1 32.4 -4.6 67.2 20 20 A L H <4 S+ 0 0 111 -3,-2.4 -1,-0.2 2,-0.1 -4,-0.0 0.811 123.8 35.7-103.4 -46.3 32.0 -7.2 64.4 21 21 A D H < S+ 0 0 57 -4,-2.2 -2,-0.2 1,-0.2 -5,-0.0 0.683 127.7 32.4 -80.9 -28.6 28.6 -6.4 62.9 22 22 A F S < S+ 0 0 22 -4,-2.1 3,-0.4 -5,-0.3 2,-0.3 0.314 89.6 108.7-112.5 2.4 28.5 -2.6 63.3 23 23 A N S S+ 0 0 84 -5,-0.3 94,-0.4 1,-0.3 7,-0.2 -0.651 88.3 7.5 -84.8 140.8 32.2 -1.8 62.9 24 24 A N S S+ 0 0 62 5,-0.6 93,-3.0 -2,-0.3 94,-0.5 0.961 86.1 155.5 49.2 70.9 32.9 -0.0 59.6 25 25 A Y B > -AB 29 116A 0 4,-1.8 4,-1.6 -3,-0.4 3,-0.4 -0.984 55.9 -38.3-123.4 133.0 29.4 0.5 58.5 26 26 A G T 4 S- 0 0 7 89,-2.4 97,-0.1 -2,-0.4 96,-0.1 0.022 99.1 -50.6 51.5-151.1 28.6 3.3 56.1 27 27 A b T 4 S+ 0 0 8 9,-0.1 7,-0.8 95,-0.1 -1,-0.2 0.530 135.2 34.6 -94.9 -14.0 30.4 6.7 56.3 28 28 A Y T 4 S+ 0 0 25 -3,-0.4 2,-1.6 5,-0.2 -2,-0.2 0.717 83.9 93.3-114.5 -30.6 29.7 7.2 60.0 29 29 A c B < S+A 25 0A 9 -4,-1.6 -4,-1.8 -6,-0.1 -5,-0.6 -0.572 91.3 27.8 -75.5 89.7 29.8 3.9 62.0 30 30 A G S S- 0 0 26 -2,-1.6 2,-0.2 2,-0.3 -7,-0.0 -0.915 116.3 -22.6 149.7-166.6 33.4 3.9 63.1 31 31 A L S S- 0 0 137 -2,-0.3 2,-0.1 2,-0.0 -2,-0.0 -0.494 114.1 -5.1 -73.2 142.4 35.9 6.7 63.8 32 32 A G S S- 0 0 47 -2,-0.2 -2,-0.3 1,-0.1 2,-0.2 -0.354 70.6-141.2 74.0-163.4 35.2 10.0 62.1 33 33 A G + 0 0 31 -4,-0.1 2,-0.3 -2,-0.1 -5,-0.2 -0.547 22.8 165.5 161.8 130.7 32.3 10.4 59.6 34 34 A S + 0 0 65 -7,-0.8 2,-0.1 -2,-0.2 12,-0.0 -0.958 43.5 29.6-154.8 159.0 32.0 12.4 56.4 35 35 A G S S- 0 0 32 -2,-0.3 88,-0.1 88,-0.1 85,-0.0 -0.433 99.3 -42.8 88.4-158.6 29.5 12.5 53.5 36 36 A T - 0 0 105 86,-0.3 -9,-0.1 87,-0.3 -2,-0.1 -0.930 66.8-104.1-111.6 136.2 25.9 11.7 53.5 37 37 A P - 0 0 10 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.332 23.4-141.7 -57.3 146.1 24.8 8.6 55.5 38 38 A V S S- 0 0 50 77,-0.1 2,-0.2 -3,-0.0 -12,-0.0 0.742 73.1 -9.9 -84.4 -25.5 24.0 5.8 53.2 39 39 A D S > S- 0 0 22 1,-0.1 4,-1.3 76,-0.1 5,-0.1 -0.803 83.9 -77.3-154.1-169.6 21.0 4.5 55.2 40 40 A D H > S+ 0 0 96 -2,-0.2 4,-2.2 2,-0.2 5,-0.1 0.884 125.1 52.9 -67.4 -41.1 19.1 4.8 58.5 41 41 A L H > S+ 0 0 1 69,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.946 111.8 47.2 -58.5 -46.0 21.6 2.7 60.5 42 42 A D H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.803 107.9 54.9 -64.3 -35.6 24.4 5.1 59.2 43 43 A R H X S+ 0 0 107 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.896 103.6 57.3 -66.3 -37.5 22.2 8.1 60.1 44 44 A d H X S+ 0 0 3 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.930 109.0 45.2 -55.3 -49.7 22.1 6.6 63.7 45 45 A c H X S+ 0 0 3 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.848 109.2 54.9 -64.6 -38.7 25.8 6.7 63.8 46 46 A Q H X S+ 0 0 37 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.932 108.1 50.4 -59.6 -45.9 26.0 10.2 62.4 47 47 A T H X S+ 0 0 84 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.838 110.0 48.6 -58.9 -43.3 23.7 11.4 65.2 48 48 A Q H X S+ 0 0 17 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.858 108.3 54.7 -66.9 -39.4 25.8 9.8 67.8 49 49 A D H X S+ 0 0 14 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.904 109.0 48.6 -58.1 -41.7 28.9 11.4 66.3 50 50 A N H X S+ 0 0 80 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.778 109.7 52.6 -69.5 -29.6 27.2 14.8 66.6 51 51 A e H X S+ 0 0 28 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.924 111.1 45.6 -70.7 -48.8 26.3 14.1 70.2 52 52 A Y H X S+ 0 0 2 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.925 111.6 52.2 -60.6 -44.1 29.9 13.2 71.1 53 53 A K H X S+ 0 0 110 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.905 111.5 48.6 -58.4 -38.9 31.0 16.3 69.3 54 54 A Q H >< S+ 0 0 120 -4,-1.4 3,-0.7 1,-0.2 -2,-0.2 0.847 100.7 61.8 -71.7 -34.4 28.4 18.1 71.4 55 55 A A H >< S+ 0 0 3 -4,-2.4 3,-1.2 1,-0.2 6,-0.3 0.878 98.4 63.0 -60.7 -29.6 29.6 16.6 74.6 56 56 A K H 3< S+ 0 0 116 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.846 91.8 59.0 -63.3 -38.3 32.9 18.3 73.8 57 57 A K T << S+ 0 0 176 -4,-0.7 2,-0.5 -3,-0.7 -1,-0.3 0.171 87.0 105.3 -79.7 18.9 31.6 21.9 73.9 58 58 A L X - 0 0 50 -3,-1.2 3,-1.8 1,-0.1 4,-0.5 -0.893 68.3-144.8-104.6 130.6 30.5 21.3 77.6 59 59 A D G > S+ 0 0 131 -2,-0.5 3,-1.6 1,-0.3 -1,-0.1 0.873 102.4 63.8 -54.9 -39.1 32.5 22.8 80.5 60 60 A S G 3 S+ 0 0 63 1,-0.3 31,-0.5 -3,-0.1 -1,-0.3 0.652 101.1 49.4 -58.3 -25.7 31.7 19.5 82.4 61 61 A f G X S+ 0 0 23 -3,-1.8 3,-1.1 -6,-0.3 2,-1.1 0.468 85.3 102.3 -95.9 -0.1 33.7 17.5 79.9 62 62 A K T < S+ 0 0 154 -3,-1.6 -1,-0.1 -4,-0.5 -6,-0.0 -0.704 78.1 39.3 -91.0 94.5 36.8 19.7 80.1 63 63 A V T 3 S+ 0 0 135 -2,-1.1 2,-0.5 0, 0.0 -1,-0.2 0.190 88.1 100.4 149.6 1.4 39.3 17.9 82.3 64 64 A L X + 0 0 46 -3,-1.1 3,-1.7 1,-0.1 -2,-0.0 -0.574 36.3 171.4-113.8 75.3 38.8 14.3 81.0 65 65 A V T 3 + 0 0 144 -2,-0.5 -1,-0.1 1,-0.3 6,-0.0 0.714 62.9 90.1 -53.0 -23.2 41.5 13.3 78.5 66 66 A D T 3 S- 0 0 102 2,-0.1 -1,-0.3 1,-0.0 4,-0.2 0.706 89.6-136.4 -47.6 -26.8 40.2 9.7 78.5 67 67 A N X - 0 0 60 -3,-1.7 3,-2.3 1,-0.1 4,-0.1 0.608 19.1 -93.8 72.3 134.1 37.9 10.5 75.6 68 68 A P T 3 S+ 0 0 14 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.708 124.2 61.9 -48.6 -30.3 34.2 9.4 75.4 69 69 A Y T 3 S+ 0 0 52 -68,-0.2 -67,-2.1 1,-0.2 -66,-0.4 0.807 128.0 18.7 -68.3 -23.0 35.0 6.2 73.4 70 70 A T S < S+ 0 0 51 -3,-2.3 2,-1.0 -69,-0.3 -1,-0.2 0.109 94.6 116.0-133.0 21.8 37.0 5.4 76.5 71 71 A N - 0 0 11 -3,-0.2 2,-0.3 -4,-0.1 -4,-0.0 -0.853 67.1-137.1 -93.3 98.0 35.3 7.9 79.0 72 72 A N + 0 0 91 -2,-1.0 2,-0.2 -68,-0.0 20,-0.1 -0.507 30.8 171.1 -68.7 126.3 33.9 5.2 81.3 73 73 A Y - 0 0 11 -2,-0.3 2,-0.4 -72,-0.1 20,-0.1 -0.785 29.9-113.8-126.1 167.3 30.3 5.5 82.7 74 74 A S + 0 0 46 -2,-0.2 11,-2.2 11,-0.2 2,-0.3 -0.859 44.1 142.0-104.4 144.8 27.9 3.3 84.6 75 75 A Y E -C 84 0B 62 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.930 31.6-131.4-162.8 174.6 24.6 1.9 83.2 76 76 A S E -C 83 0B 60 7,-2.2 7,-2.1 -2,-0.3 2,-0.5 -0.948 4.8-149.1-141.7 157.0 22.6 -1.2 83.3 77 77 A a E +C 82 0B 61 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.988 23.5 169.6-122.4 114.9 20.8 -3.7 81.1 78 78 A S E > S-C 81 0B 75 3,-2.4 3,-1.4 -2,-0.5 -2,-0.1 -0.987 73.3 -22.8-129.2 125.4 17.8 -5.3 82.7 79 79 A N T 3 S- 0 0 147 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.879 129.2 -45.0 32.8 61.1 15.5 -7.4 80.4 80 80 A N T 3 S+ 0 0 88 1,-0.2 2,-0.4 -69,-0.1 -1,-0.3 0.603 113.2 111.7 64.3 23.9 16.6 -5.6 77.3 81 81 A E E < -C 78 0B 67 -3,-1.4 -3,-2.4 2,-0.0 2,-0.3 -0.980 56.3-139.1-129.8 139.1 16.5 -2.1 78.5 82 82 A I E -C 77 0B 3 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.723 16.1-172.7 -90.7 137.6 19.3 0.3 79.1 83 83 A T E -C 76 0B 75 -7,-2.1 -7,-2.2 -2,-0.3 2,-0.3 -0.993 17.0-140.9-135.1 124.2 19.5 2.6 82.1 84 84 A g E -C 75 0B 39 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.3 -0.684 32.5-112.3 -81.0 141.9 22.1 5.3 82.6 85 85 A S > - 0 0 42 -11,-2.2 3,-2.4 -2,-0.3 -11,-0.2 -0.577 5.2-141.4 -82.7 136.8 23.2 5.6 86.2 86 86 A S T 3 S+ 0 0 127 -2,-0.3 -1,-0.1 1,-0.3 7,-0.1 0.699 101.3 70.9 -60.5 -21.8 22.4 8.6 88.4 87 87 A E T 3 S+ 0 0 136 6,-0.0 -1,-0.3 -13,-0.0 2,-0.3 0.503 73.1 107.9 -75.2 -6.8 25.8 8.1 89.8 88 88 A N S < S- 0 0 14 -3,-2.4 -15,-0.1 -14,-0.1 -4,-0.0 -0.593 71.8-128.0 -74.3 133.4 27.3 9.4 86.4 89 89 A N > - 0 0 115 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.152 41.1 -80.5 -69.5 176.6 28.8 12.8 86.8 90 90 A A H > S+ 0 0 65 2,-0.2 4,-1.5 1,-0.2 -29,-0.1 0.861 126.6 40.5 -45.3 -55.0 27.7 15.5 84.2 91 91 A f H > S+ 0 0 2 -31,-0.5 4,-2.5 2,-0.2 3,-0.3 0.960 117.5 45.8 -62.5 -56.1 29.9 14.6 81.3 92 92 A E H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.774 110.1 55.6 -59.3 -33.0 29.6 10.8 81.6 93 93 A A H X S+ 0 0 37 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.899 109.4 47.1 -67.9 -39.6 25.9 11.1 82.0 94 94 A F H X S+ 0 0 61 -4,-1.5 4,-1.8 -3,-0.3 -2,-0.2 0.959 113.6 46.1 -66.7 -50.6 25.7 13.0 78.7 95 95 A I H X S+ 0 0 1 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.873 111.4 55.6 -56.9 -39.1 28.0 10.5 76.8 96 96 A g H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 3,-0.5 0.973 106.8 48.0 -58.1 -55.3 25.8 7.7 78.4 97 97 A N H X S+ 0 0 74 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.842 108.5 55.1 -55.5 -36.6 22.7 9.2 77.0 98 98 A e H X S+ 0 0 3 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.878 111.7 44.8 -63.0 -41.2 24.3 9.5 73.5 99 99 A D H X S+ 0 0 0 -4,-1.8 4,-2.0 -3,-0.5 -2,-0.2 0.768 111.0 52.6 -75.1 -31.3 25.2 5.8 73.6 100 100 A R H X S+ 0 0 71 -4,-2.3 4,-1.8 2,-0.2 5,-0.2 0.960 108.9 49.9 -70.5 -49.9 21.8 4.9 74.8 101 101 A N H X S+ 0 0 81 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.883 112.8 47.9 -52.6 -37.8 20.1 6.8 72.0 102 102 A A H X S+ 0 0 4 -4,-1.5 4,-2.8 2,-0.2 -1,-0.2 0.905 108.2 51.4 -71.9 -42.3 22.3 5.1 69.4 103 103 A A H X S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.831 113.0 48.0 -65.2 -30.6 21.9 1.6 70.6 104 104 A I H X S+ 0 0 39 -4,-1.8 4,-0.5 2,-0.2 3,-0.3 0.928 110.8 49.6 -74.0 -47.9 18.1 2.1 70.5 105 105 A d H >X S+ 0 0 43 -4,-2.1 3,-2.6 1,-0.2 4,-0.6 0.963 108.5 54.7 -55.1 -52.8 18.2 3.7 67.0 106 106 A F H >< S+ 0 0 10 -4,-2.8 3,-0.6 1,-0.3 -1,-0.2 0.788 106.7 51.3 -50.1 -40.6 20.3 0.7 65.8 107 107 A S H 3< S+ 0 0 45 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.549 108.9 51.7 -78.2 -6.9 17.7 -1.7 67.0 108 108 A K H << S+ 0 0 170 -3,-2.6 -1,-0.2 -4,-0.5 -2,-0.2 0.380 100.8 67.8-109.3 1.6 14.9 0.1 65.2 109 109 A V S << S- 0 0 34 -3,-0.6 2,-0.2 -4,-0.6 -70,-0.0 -0.774 84.4-101.0-120.5 161.7 16.4 0.3 61.6 110 110 A P - 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