==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 28-MAY-07 2Q2J . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 HOMOLOG 1; . SOURCE 2 ORGANISM_SCIENTIFIC: BOTHROPS PIRAJAI; . AUTHOR J.I.DOS SANTOS,M.R.FONTES . 242 2 14 14 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12283.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 61.2 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 . 15 6.2 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 1 0.4 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 . 9 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 37.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 2 0 0 0 0 0 0 2 0 1 1 0 0 0 2 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 2 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 . 2 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 S >> 0 0 6 0, 0.0 4,-2.3 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 166.6 19.3 23.7 24.9 2 2 A L H 3> + 0 0 51 58,-2.3 4,-3.0 1,-0.2 5,-0.3 0.803 360.0 61.1 -46.9 -35.6 21.3 23.3 28.1 3 3 A F H 3> S+ 0 0 45 57,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.954 108.1 40.0 -62.6 -47.6 18.0 23.0 30.0 4 4 A E H <> S+ 0 0 17 -3,-0.6 4,-3.0 2,-0.2 5,-0.2 0.922 116.7 51.3 -67.3 -40.3 16.8 19.9 28.1 5 5 A L H X S+ 0 0 19 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.953 111.2 46.7 -62.6 -48.3 20.2 18.4 28.2 6 6 A G H X S+ 0 0 2 -4,-3.0 4,-2.1 -5,-0.2 -1,-0.2 0.910 113.2 49.0 -63.2 -38.6 20.6 18.9 31.9 7 7 A K H X S+ 0 0 99 -4,-2.1 4,-3.3 -5,-0.3 -1,-0.2 0.936 110.8 50.0 -67.7 -42.3 17.2 17.5 32.6 8 8 A M H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.917 109.3 51.8 -62.4 -39.9 17.8 14.5 30.4 9 9 A I H X>S+ 0 0 13 -4,-2.6 4,-2.6 1,-0.2 6,-0.6 0.927 112.9 45.8 -62.9 -37.2 21.0 13.8 32.1 10 10 A L H X5S+ 0 0 38 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.932 113.0 50.4 -69.1 -43.3 19.2 14.0 35.5 11 11 A Q H <5S+ 0 0 42 -4,-3.3 -2,-0.2 2,-0.2 -1,-0.2 0.887 119.5 35.0 -62.8 -39.3 16.4 11.9 34.3 12 12 A E H <5S+ 0 0 27 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.949 131.3 26.8 -80.9 -50.3 18.6 9.2 32.9 13 13 A T H <5S- 0 0 12 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.725 85.1-138.3 -87.3 -24.3 21.4 9.2 35.4 14 15 A G << + 0 0 58 -4,-2.2 2,-0.2 -5,-0.5 -4,-0.2 0.470 65.6 123.7 78.5 0.3 19.8 10.5 38.5 15 16 A K S S- 0 0 88 -6,-0.6 -1,-0.3 1,-0.1 -2,-0.2 -0.649 78.6-101.0 -96.2 153.8 22.9 12.5 39.0 16 17 A N > - 0 0 23 -2,-0.2 4,-2.8 1,-0.2 5,-0.4 -0.594 37.8-146.8 -66.3 115.3 23.3 16.3 39.4 17 18 A P H > S+ 0 0 2 0, 0.0 4,-2.6 0, 0.0 5,-0.4 0.922 91.7 43.7 -56.3 -47.5 24.4 17.0 35.8 18 19 A A H > S+ 0 0 6 3,-0.2 4,-2.0 2,-0.2 5,-0.3 0.946 117.0 46.9 -64.3 -47.0 26.6 20.0 36.6 19 20 A K H 4 S+ 0 0 82 1,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.933 124.6 28.8 -63.1 -45.5 28.2 18.3 39.5 20 21 A S H < S+ 0 0 4 -4,-2.8 -1,-0.2 1,-0.1 -2,-0.2 0.778 139.3 16.9 -87.4 -27.1 28.9 15.0 37.9 21 22 A Y H < S+ 0 0 11 -4,-2.6 3,-0.5 -5,-0.4 -3,-0.2 0.371 96.9 88.0-130.0 4.3 29.3 16.0 34.3 22 23 A G S < S+ 0 0 5 -4,-2.0 8,-0.6 -5,-0.4 -3,-0.1 0.714 112.7 13.1 -77.9 -16.1 29.9 19.7 34.2 23 24 A A E S+A 29 0A 22 -5,-0.3 86,-1.7 6,-0.2 2,-0.4 -0.524 91.1 131.2-157.8 76.3 33.6 19.1 34.6 24 25 A Y E >> -AB 28 108A 0 4,-2.6 4,-1.7 -3,-0.5 3,-0.6 -0.994 66.5 -36.6-137.6 127.5 34.5 15.5 34.1 25 26 A G T 34 S- 0 0 4 82,-2.8 10,-0.1 -2,-0.4 90,-0.0 -0.128 98.7 -49.2 59.9-154.2 37.3 14.0 32.0 26 27 A a T 34 S+ 0 0 8 9,-0.2 -1,-0.2 8,-0.1 92,-0.1 0.493 134.0 28.9 -97.1 -5.4 38.2 15.6 28.6 27 28 A N T <4 S+ 0 0 1 -3,-0.6 2,-0.8 6,-0.2 -2,-0.2 0.641 92.6 86.6-131.3 -19.3 34.8 15.9 27.2 28 29 A b E < S+A 24 0A 3 -4,-1.7 -4,-2.6 -8,-0.1 2,-0.3 -0.762 87.9 31.8 -88.2 114.8 32.2 16.3 29.8 29 30 A G E S-A 23 0A 18 -2,-0.8 -6,-0.2 -6,-0.2 3,-0.1 -0.967 103.5 -63.2 141.3-160.7 32.0 19.9 30.5 30 31 A V S S+ 0 0 62 -8,-0.6 3,-0.1 -2,-0.3 152,-0.1 0.061 101.8 88.2-118.4 21.3 32.4 23.2 28.6 31 32 A L S S- 0 0 61 1,-0.4 -1,-0.1 151,-0.1 -3,-0.1 -0.305 92.0-116.0-114.9 44.7 36.1 23.0 27.7 32 33 A G - 0 0 30 -3,-0.1 -1,-0.4 -5,-0.1 2,-0.2 -0.070 51.4 -35.3 61.2-153.8 35.6 21.2 24.4 33 34 A R + 0 0 72 -3,-0.1 85,-0.3 85,-0.1 2,-0.3 -0.602 51.8 158.9-108.7 165.0 36.9 17.7 23.6 34 35 A G - 0 0 0 83,-0.2 83,-0.2 -2,-0.2 -8,-0.1 -0.963 56.5 -51.4-167.5 174.8 39.9 15.6 24.4 35 36 A K S S- 0 0 107 81,-2.5 81,-0.2 -2,-0.3 -9,-0.2 -0.448 72.9-109.9 -60.6 114.9 41.1 12.0 24.5 36 37 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.113 22.7-156.1 -49.9 142.0 38.3 10.3 26.5 37 38 A K - 0 0 91 1,-0.2 2,-0.3 -13,-0.1 -12,-0.1 0.778 69.4 -21.2 -88.8 -33.0 39.4 9.2 30.0 38 39 A D S > S- 0 0 15 1,-0.1 4,-3.0 69,-0.0 -1,-0.2 -0.894 84.1 -69.2-160.5-173.2 36.7 6.6 30.4 39 40 A A H > S+ 0 0 17 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.903 129.4 51.1 -58.2 -44.1 33.3 5.4 29.2 40 41 A T H > S+ 0 0 0 59,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.938 111.3 47.5 -58.7 -45.0 31.6 8.3 30.7 41 42 A D H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 3,-0.3 0.921 107.1 57.1 -64.8 -41.4 34.0 10.7 29.1 42 43 A R H X S+ 0 0 135 -4,-3.0 4,-2.5 1,-0.3 5,-0.3 0.891 100.5 58.9 -58.5 -34.9 33.6 8.9 25.8 43 44 A c H X S+ 0 0 2 -4,-1.9 4,-1.9 1,-0.2 -1,-0.3 0.936 106.6 46.4 -58.7 -44.8 29.9 9.6 26.1 44 45 A b H X S+ 0 0 8 -4,-1.4 4,-2.4 -3,-0.3 -1,-0.2 0.780 108.8 56.9 -69.0 -23.9 30.5 13.3 26.2 45 46 A Y H X S+ 0 0 39 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.964 108.6 44.5 -68.2 -53.4 32.9 13.0 23.3 46 47 A V H X S+ 0 0 89 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.876 112.7 55.3 -57.9 -36.2 30.3 11.5 21.1 47 48 A H H X S+ 0 0 16 -4,-1.9 4,-2.1 -5,-0.3 -1,-0.2 0.951 107.6 45.8 -64.9 -48.0 27.9 14.1 22.4 48 49 A K H X S+ 0 0 34 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.893 113.7 50.5 -64.1 -34.4 30.1 17.0 21.4 49 50 A d H X S+ 0 0 17 -4,-2.6 4,-0.9 1,-0.2 3,-0.4 0.900 105.7 56.3 -68.2 -37.7 30.7 15.4 18.1 50 51 A e H >X S+ 0 0 28 -4,-2.6 3,-0.8 1,-0.2 4,-0.5 0.901 102.1 56.3 -60.1 -38.7 27.0 15.0 17.7 51 52 A Y H >< S+ 0 0 43 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.849 98.9 63.3 -62.8 -31.9 26.6 18.8 18.2 52 53 A K H 3< S+ 0 0 110 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.790 96.4 54.0 -66.0 -28.7 29.0 19.4 15.3 53 57 A K H << S+ 0 0 150 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.623 84.3 112.6 -80.8 -10.1 26.8 17.9 12.6 54 58 A L << - 0 0 17 -3,-1.0 2,-0.6 -4,-0.5 27,-0.1 -0.355 61.2-143.8 -62.5 139.9 24.0 20.1 13.7 55 59 A T - 0 0 119 1,-0.1 2,-0.5 -2,-0.0 26,-0.1 -0.911 63.4 -24.2-118.8 111.5 23.0 22.6 11.1 56 60 A G S S+ 0 0 84 -2,-0.6 2,-0.1 1,-0.2 -1,-0.1 -0.164 104.0 102.7 91.8 -41.4 21.9 26.0 11.9 57 61 A f S S- 0 0 21 -2,-0.5 -1,-0.2 1,-0.1 3,-0.1 -0.403 70.4-120.9 -83.7 158.7 20.6 25.5 15.4 58 67 A N > - 0 0 77 1,-0.2 4,-3.1 -2,-0.1 -1,-0.1 -0.847 14.6-162.4-100.6 108.1 22.3 26.4 18.7 59 68 A P T 4 S+ 0 0 25 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.822 92.1 43.6 -57.0 -37.2 22.8 23.3 20.9 60 69 A K T 4 S+ 0 0 48 -59,-0.2 -58,-2.3 1,-0.1 -57,-0.3 0.898 126.9 26.4 -78.4 -38.2 23.3 25.5 24.0 61 70 A K T 4 S+ 0 0 57 -60,-0.2 2,-0.5 -59,-0.1 -1,-0.1 0.788 92.7 94.0 -99.3 -29.3 20.5 27.9 23.4 62 71 A D < - 0 0 59 -4,-3.1 2,-0.2 1,-0.0 -5,-0.0 -0.551 61.0-145.3 -79.6 123.2 17.7 26.3 21.4 63 72 A R + 0 0 142 -2,-0.5 2,-0.3 -60,-0.1 -5,-0.1 -0.482 21.4 179.5 -78.6 146.6 14.9 24.8 23.3 64 73 A Y - 0 0 10 -2,-0.2 2,-0.4 -63,-0.1 19,-0.0 -0.926 25.3-108.6-142.7 167.2 13.3 21.7 21.9 65 74 A S + 0 0 77 -2,-0.3 11,-2.2 11,-0.1 2,-0.3 -0.781 37.4 157.8-102.1 144.8 10.5 19.3 23.0 66 75 A Y E -C 75 0B 35 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.964 29.3-132.8-158.2 150.0 10.8 15.8 24.2 67 76 A S E -C 74 0B 69 7,-2.9 7,-2.6 -2,-0.3 -2,-0.0 -0.773 4.3-159.8-106.4 156.6 8.6 13.6 26.3 68 77 A W >> + 0 0 75 -2,-0.3 3,-1.5 5,-0.2 4,-0.5 0.133 35.4 156.9-117.0 14.4 9.7 11.5 29.2 69 78 A K G >4 S+ 0 0 162 1,-0.3 3,-0.6 2,-0.2 -2,-0.1 -0.126 72.0 5.1 -50.3 130.4 6.8 9.1 29.0 70 79 A D G 34 S- 0 0 139 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.837 128.4 -71.6 62.3 34.1 7.5 5.8 30.6 71 80 A K G <4 S+ 0 0 161 -3,-1.5 2,-0.4 1,-0.2 -1,-0.2 0.861 108.4 116.7 48.3 44.9 10.8 7.1 31.7 72 81 A T << - 0 0 73 -3,-0.6 2,-0.5 -4,-0.5 -1,-0.2 -0.988 67.4-122.9-136.8 136.7 12.1 7.1 28.2 73 82 A I - 0 0 0 -2,-0.4 2,-0.5 -5,-0.1 -5,-0.2 -0.769 28.4-176.2 -84.9 124.5 13.2 10.2 26.3 74 83 A V E -C 67 0B 77 -7,-2.6 -7,-2.9 -2,-0.5 2,-0.3 -0.987 22.3-136.0-122.4 115.1 11.3 10.6 23.1 75 84 A g E -C 66 0B 10 -2,-0.5 -9,-0.3 -9,-0.2 8,-0.1 -0.578 23.3-130.7 -70.6 127.1 12.4 13.5 21.0 76 85 A G - 0 0 22 -11,-2.2 10,-0.1 -2,-0.3 3,-0.1 -0.307 28.8 -99.2 -72.5 165.3 9.3 15.3 19.7 77 86 A E + 0 0 57 1,-0.1 6,-0.2 -2,-0.0 -1,-0.1 0.943 67.1 146.5 -50.3 -53.9 9.2 16.1 16.1 78 87 A N - 0 0 75 4,-0.1 -1,-0.1 5,-0.1 -14,-0.1 -0.287 67.5 -54.9 46.3-129.7 10.3 19.7 16.4 79 88 A N > - 0 0 75 -3,-0.1 4,-3.6 1,-0.1 5,-0.4 -0.906 59.0 -85.8-135.3 164.3 12.3 20.2 13.3 80 90 A P H > S+ 0 0 113 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.843 125.0 39.2 -33.6 -58.2 15.2 18.5 11.7 81 91 A f H > S+ 0 0 17 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.949 119.3 44.5 -64.8 -50.1 17.9 20.4 13.6 82 92 A L H > S+ 0 0 20 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.873 113.8 52.9 -60.5 -37.5 16.2 20.5 16.9 83 93 A K H X S+ 0 0 75 -4,-3.6 4,-2.5 -6,-0.2 -1,-0.2 0.929 111.7 44.6 -62.1 -48.7 15.2 16.8 16.5 84 94 A E H X S+ 0 0 74 -4,-2.5 4,-2.0 -5,-0.4 -2,-0.2 0.873 113.3 51.6 -63.5 -38.3 18.8 15.9 15.9 85 95 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.942 109.1 50.8 -63.2 -49.0 19.9 18.1 18.7 86 96 A g H X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.2 -2,-0.2 0.917 109.6 49.7 -55.2 -44.9 17.4 16.4 21.0 87 97 A E H X S+ 0 0 64 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.854 106.6 55.7 -65.9 -32.9 18.8 13.0 19.9 88 98 A e H X S+ 0 0 1 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.943 113.0 42.3 -62.6 -45.8 22.3 14.1 20.6 89 99 A D H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.917 112.9 51.5 -67.9 -40.9 21.2 15.0 24.1 90 100 A K H X S+ 0 0 45 -4,-3.2 4,-2.7 1,-0.2 5,-0.3 0.944 110.0 52.2 -59.5 -45.9 19.1 11.9 24.6 91 101 A A H X S+ 0 0 49 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.891 109.9 45.5 -60.3 -41.3 22.1 9.8 23.6 92 102 A V H X S+ 0 0 5 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.917 111.7 52.2 -72.7 -38.8 24.5 11.3 25.9 93 103 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.943 114.0 44.2 -59.1 -45.7 22.1 11.1 28.9 94 104 A I H X S+ 0 0 40 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.948 113.6 50.5 -64.0 -46.4 21.5 7.4 28.1 95 105 A c H X S+ 0 0 32 -4,-2.9 4,-1.3 -5,-0.3 -2,-0.2 0.932 109.5 50.1 -59.0 -44.7 25.2 6.8 27.6 96 106 A L H >< S+ 0 0 1 -4,-2.9 3,-0.6 1,-0.2 -1,-0.2 0.930 112.0 48.0 -61.3 -41.4 26.1 8.5 30.9 97 107 A R H >< S+ 0 0 99 -4,-2.2 3,-1.9 1,-0.3 4,-0.3 0.953 109.1 54.3 -63.0 -45.2 23.5 6.4 32.7 98 108 A E H 3< S+ 0 0 118 -4,-3.1 3,-0.3 1,-0.3 -1,-0.3 0.731 112.7 44.2 -60.4 -22.1 24.8 3.3 31.0 99 109 A N T X< S+ 0 0 39 -4,-1.3 3,-1.7 -3,-0.6 4,-0.3 0.236 74.1 110.0-112.2 17.8 28.3 4.1 32.2 100 110 A L G X + 0 0 46 -3,-1.9 3,-1.4 1,-0.3 -1,-0.2 0.809 69.0 70.7 -57.5 -33.2 27.6 5.0 35.7 101 111 A G G 3 S+ 0 0 81 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.697 108.2 32.7 -59.9 -22.5 29.2 1.8 36.8 102 112 A T G < S+ 0 0 81 -3,-1.7 -1,-0.3 2,-0.0 -2,-0.2 0.211 84.6 135.5-116.1 8.8 32.7 3.1 35.9 103 113 A Y < - 0 0 38 -3,-1.4 2,-0.5 -4,-0.3 -3,-0.0 -0.424 38.5-162.9 -59.6 129.8 32.0 6.7 36.7 104 114 A N > - 0 0 64 -2,-0.1 3,-2.4 1,-0.1 4,-0.2 -0.949 22.7-153.7-128.2 114.2 35.0 7.9 38.6 105 115 A K G > S+ 0 0 144 -2,-0.5 3,-1.9 1,-0.3 -1,-0.1 0.694 90.3 77.7 -54.8 -20.0 35.0 11.1 40.7 106 116 A K G 3 S+ 0 0 142 1,-0.3 -1,-0.3 -82,-0.1 -3,-0.0 0.685 86.9 59.3 -66.1 -16.0 38.7 11.3 40.1 107 117 A Y G < S+ 0 0 52 -3,-2.4 -82,-2.8 2,-0.1 -1,-0.3 0.507 83.1 101.9 -91.5 -4.0 38.0 12.6 36.6 108 118 A R B < +B 24 0A 71 -3,-1.9 2,-0.3 -84,-0.3 -84,-0.2 -0.470 50.8 171.6 -73.0 154.7 36.1 15.6 38.0 109 119 A Y - 0 0 30 -86,-1.7 3,-0.2 1,-0.1 -2,-0.1 -0.930 39.3-152.0-154.2 170.8 38.0 18.9 38.0 110 120 A H S S+ 0 0 128 1,-0.5 2,-0.4 -2,-0.3 -1,-0.1 0.623 95.8 36.8-113.1 -46.5 37.5 22.6 38.6 111 121 A L S S- 0 0 81 1,-0.1 -1,-0.5 -88,-0.1 -88,-0.0 -0.898 110.8 -86.4-109.5 135.0 40.3 23.6 36.3 112 122 A K - 0 0 135 -2,-0.4 -1,-0.1 -3,-0.2 3,-0.1 0.019 48.3-148.3 -35.3 128.5 40.9 21.7 33.1 113 123 A P - 0 0 62 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.232 39.6 -54.6 -95.0-165.6 43.1 18.7 33.6 114 125 A F + 0 0 84 -2,-0.1 2,-0.4 0, 0.0 -88,-0.0 -0.537 64.9 169.9 -71.6 117.1 45.6 17.1 31.3 115 126 A a - 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