==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-DEC-08 3FO7 . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLI PULCHELLA; . AUTHOR N.SINGH,R.PREM KUMAR,S.SHARMA,P.KAUR,T.P.SINGH . 121 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7510.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 75 62.0 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 . 7 5.8 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 . 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 . 6 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 37.2 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+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 0 1 0 1 0 0 0 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 . 1 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 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 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 9 0, 0.0 4,-2.7 0, 0.0 60,-0.2 0.000 360.0 360.0 360.0 159.7 40.8 38.1 4.9 2 2 A L H > + 0 0 91 58,-2.3 4,-2.3 1,-0.2 5,-0.1 0.863 360.0 49.1 -48.5 -47.3 42.4 34.7 5.5 3 3 A L H > S+ 0 0 150 57,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.887 112.8 47.4 -64.9 -39.8 39.3 32.7 4.5 4 4 A E H > S+ 0 0 35 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.912 111.4 50.4 -66.3 -44.6 39.0 34.7 1.2 5 5 A F H X S+ 0 0 23 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.908 109.2 53.5 -60.0 -39.9 42.7 34.3 0.5 6 6 A G H X S+ 0 0 17 -4,-2.3 4,-2.1 -5,-0.2 11,-0.5 0.903 109.8 46.4 -62.9 -39.8 42.2 30.6 1.2 7 7 A K H X S+ 0 0 112 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.878 110.5 53.0 -69.7 -38.2 39.4 30.4 -1.4 8 8 A M H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.910 109.4 49.8 -62.1 -42.7 41.4 32.3 -3.9 9 9 A I H X>S+ 0 0 4 -4,-2.4 4,-3.0 2,-0.2 5,-0.5 0.919 111.4 48.4 -61.9 -44.9 44.2 29.9 -3.5 10 10 A L H X5S+ 0 0 74 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.942 111.6 49.1 -61.6 -49.2 41.9 26.9 -4.0 11 11 A E H <5S+ 0 0 86 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.856 117.9 41.6 -57.4 -38.2 40.3 28.4 -7.1 12 12 A E H <5S+ 0 0 43 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.928 131.5 17.9 -77.9 -47.9 43.7 29.1 -8.5 13 13 A T H <5S- 0 0 20 -4,-3.0 -3,-0.2 2,-0.3 -2,-0.2 0.700 87.3-126.1-101.4 -27.4 45.6 25.9 -7.7 14 14 A G S < - 0 0 105 -2,-0.3 4,-1.8 1,-0.2 5,-0.4 -0.620 19.8-136.0 -74.3 127.9 43.4 23.5 -0.2 17 18 A A H > S+ 0 0 16 -11,-0.5 4,-3.2 -2,-0.4 5,-0.4 0.905 87.5 77.7 -49.1 -45.6 45.2 26.5 1.4 18 19 A I H 4 S+ 0 0 120 1,-0.3 -1,-0.2 2,-0.2 11,-0.0 -0.965 112.3 0.5-107.9 123.6 45.1 24.5 4.6 19 20 A P H 4 S+ 0 0 68 0, 0.0 4,-0.5 0, 0.0 -1,-0.3 -0.953 128.5 60.3-100.2 13.2 47.2 22.4 4.8 20 21 A S H < S+ 0 0 18 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.825 126.7 12.7 -65.5 -33.9 48.9 22.8 1.4 21 22 A Y S < S+ 0 0 12 -4,-3.2 -1,-0.2 -5,-0.4 -3,-0.2 0.176 108.1 82.9-129.0 15.7 50.1 26.4 2.0 22 23 A S S S+ 0 0 40 -5,-0.4 -2,-0.1 -3,-0.2 -4,-0.1 0.651 110.2 15.5 -96.7 -17.3 49.5 27.0 5.8 23 24 A S S S+ 0 0 31 -4,-0.5 87,-1.3 6,-0.1 86,-1.2 -0.016 89.8 140.0-143.8 32.8 52.7 25.4 7.0 24 25 A Y B > -A 108 0A 0 84,-0.2 4,-2.0 85,-0.2 3,-0.4 -0.658 65.4 -43.6 -89.2 128.2 54.9 25.1 3.9 25 26 A G T 4 S- 0 0 9 82,-2.7 85,-0.1 -2,-0.4 90,-0.1 -0.102 100.6 -41.1 56.9-148.8 58.6 25.9 4.1 26 27 A a T 4 S+ 0 0 12 9,-0.1 7,-0.5 1,-0.1 6,-0.3 0.676 135.8 26.8 -89.1 -19.0 59.9 28.9 6.0 27 28 A Y T > S+ 0 0 7 -3,-0.4 4,-1.4 4,-0.2 2,-0.6 0.560 86.1 103.2-125.2 -10.0 57.4 31.5 5.1 28 29 A b T < S- 0 0 4 -4,-2.0 -4,-0.2 1,-0.2 13,-0.1 -0.694 104.0 -11.3 -84.9 117.9 54.0 29.9 4.2 29 30 A G T 4 S+ 0 0 47 -2,-0.6 -1,-0.2 -6,-0.2 -7,-0.1 0.148 150.7 25.8 84.9 -20.7 51.5 30.3 7.0 30 31 A W T 4 S+ 0 0 223 -6,-0.2 -2,-0.2 0, 0.0 -1,-0.1 0.182 77.9 170.5-161.7 30.5 54.1 31.5 9.5 31 32 A G < + 0 0 24 -4,-1.4 -4,-0.2 1,-0.1 3,-0.1 0.195 18.7 132.2 -41.9 167.2 57.1 33.1 7.8 32 33 A G - 0 0 59 -6,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.085 63.5 -1.6 175.6 -45.3 59.7 34.9 9.8 33 34 A K S S+ 0 0 90 -7,-0.5 -1,-0.2 85,-0.1 85,-0.2 -0.962 78.6 57.9-158.6 172.0 63.2 34.0 9.0 34 35 A G S S- 0 0 1 83,-4.2 85,-0.2 -2,-0.3 81,-0.1 -0.133 82.7 -56.1 92.1 172.1 65.5 31.9 6.8 35 36 A T - 0 0 104 81,-0.2 -9,-0.1 83,-0.1 81,-0.1 -0.792 63.2-105.4 -89.4 127.5 66.1 31.4 3.1 36 37 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.251 25.0-136.0 -52.2 138.3 62.9 30.3 1.3 37 38 A K S S- 0 0 70 1,-0.1 2,-0.3 70,-0.1 -12,-0.1 0.754 70.9 -24.0 -71.6 -28.6 63.1 26.6 0.4 38 39 A D S > S- 0 0 18 1,-0.1 4,-2.4 66,-0.0 5,-0.2 -0.934 84.0 -65.6-165.8-174.7 61.8 26.9 -3.1 39 40 A A H > S+ 0 0 14 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.886 127.9 50.9 -55.3 -45.6 59.7 29.0 -5.5 40 41 A T H > S+ 0 0 0 59,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.927 110.7 48.8 -59.4 -44.8 56.5 28.4 -3.7 41 42 A D H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.880 107.1 56.3 -63.6 -37.1 58.1 29.4 -0.4 42 43 A R H X S+ 0 0 137 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.862 100.4 58.8 -62.6 -34.7 59.4 32.5 -2.1 43 44 A c H X S+ 0 0 4 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.915 108.8 45.3 -57.0 -42.1 55.8 33.3 -3.0 44 45 A b H X S+ 0 0 7 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.874 109.0 54.4 -71.4 -38.0 55.1 33.3 0.7 45 46 A F H X S+ 0 0 23 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.956 112.2 44.4 -58.5 -50.7 58.1 35.4 1.5 46 47 A V H X S+ 0 0 91 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.903 112.2 52.5 -61.7 -38.7 57.0 38.1 -1.0 47 48 A H H X S+ 0 0 17 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.904 108.7 50.7 -64.3 -39.8 53.4 37.9 0.3 48 49 A D H X S+ 0 0 56 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.943 111.9 47.1 -60.8 -48.9 54.7 38.4 3.8 49 50 A d H X S+ 0 0 16 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.890 109.2 55.2 -59.2 -39.3 56.7 41.4 2.6 50 51 A e H >< S+ 0 0 31 -4,-2.8 3,-1.1 1,-0.2 4,-0.2 0.941 109.2 45.1 -61.6 -47.8 53.6 42.7 0.8 51 52 A Y H >< S+ 0 0 42 -4,-2.5 3,-2.1 1,-0.3 -1,-0.2 0.877 107.4 62.1 -61.3 -36.8 51.5 42.6 4.0 52 53 A G H 3< S+ 0 0 53 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.709 91.5 63.9 -62.9 -21.9 54.5 44.2 5.7 53 54 A N T << S+ 0 0 108 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.571 101.1 57.3 -74.3 -10.6 54.1 47.2 3.4 54 55 A L X + 0 0 8 -3,-2.1 3,-2.0 -4,-0.2 -1,-0.2 -0.510 58.7 159.1-121.7 61.8 50.7 47.7 5.1 55 56 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.765 79.0 48.0 -63.8 -9.3 51.4 48.1 8.9 56 59 A D T 3 S+ 0 0 149 -3,-0.1 2,-0.2 2,-0.0 25,-0.1 0.277 97.8 84.0-123.5 21.5 48.1 49.8 9.5 57 61 A f < - 0 0 12 -3,-2.0 -3,-0.1 -6,-0.2 25,-0.0 -0.688 69.7-139.4-110.9 165.9 46.0 47.3 7.6 58 67 A N >> + 0 0 107 -2,-0.2 4,-2.7 1,-0.1 3,-1.0 -0.684 22.1 175.1-131.9 76.1 44.6 44.0 8.9 59 68 A P T 34 S+ 0 0 17 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.730 73.1 61.3 -55.7 -30.9 44.9 41.3 6.2 60 69 A K T 34 S+ 0 0 145 -59,-0.2 -58,-2.3 1,-0.1 -57,-0.4 0.858 122.8 16.1 -67.4 -35.2 43.6 38.4 8.3 61 70 A S T <4 S+ 0 0 89 -3,-1.0 2,-0.4 -60,-0.2 -1,-0.1 0.706 97.3 98.9-112.4 -27.7 40.2 39.9 9.0 62 71 A D < - 0 0 37 -4,-2.7 2,-0.4 1,-0.1 -5,-0.0 -0.515 63.2-146.2 -70.6 121.4 39.6 42.7 6.5 63 72 A R - 0 0 178 -2,-0.4 2,-0.2 -59,-0.0 19,-0.1 -0.708 16.3-172.6 -92.1 138.0 37.5 41.4 3.6 64 73 A Y - 0 0 7 -2,-0.4 2,-0.4 -63,-0.1 13,-0.1 -0.744 19.4-121.4-119.9 169.4 37.9 42.7 0.1 65 74 A K + 0 0 157 11,-0.5 11,-2.6 -2,-0.2 2,-0.3 -0.933 31.7 166.6-116.8 139.0 35.9 42.1 -3.1 66 75 A Y E -B 75 0B 37 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.983 15.2-154.8-146.6 154.0 37.3 40.7 -6.4 67 76 A K E -B 74 0B 100 7,-2.4 7,-2.7 -2,-0.3 2,-0.5 -0.786 19.4-118.3-124.9 169.3 35.9 39.3 -9.6 68 77 A R E -B 73 0B 83 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.941 17.9-169.7-110.7 125.4 36.9 36.9 -12.3 69 78 A V E > S-B 72 0B 71 3,-2.6 3,-0.9 -2,-0.5 4,-0.1 -0.714 81.1 -41.6-117.0 79.2 37.3 38.2 -15.8 70 79 A N T 3 S- 0 0 173 -2,-0.5 3,-0.1 1,-0.2 -1,-0.1 0.920 124.9 -38.7 65.8 47.7 37.8 35.1 -17.9 71 80 A G T 3 S+ 0 0 50 1,-0.3 -1,-0.2 0, 0.0 2,-0.1 -0.050 114.7 119.1 95.6 -32.1 40.0 33.6 -15.3 72 81 A A E < -B 69 0B 53 -3,-0.9 -3,-2.6 1,-0.1 2,-0.5 -0.413 64.0-127.8 -70.8 140.7 41.8 36.8 -14.5 73 82 A I E -B 68 0B 5 -5,-0.2 2,-0.5 -3,-0.1 -5,-0.2 -0.805 25.6-172.8 -89.9 124.2 41.6 38.1 -10.9 74 83 A V E -B 67 0B 52 -7,-2.7 -7,-2.4 -2,-0.5 2,-0.4 -0.957 17.6-140.8-121.6 112.3 40.4 41.7 -10.7 75 84 A g E -B 66 0B 23 -2,-0.5 -9,-0.3 -9,-0.2 2,-0.2 -0.570 22.6-140.9 -70.7 125.5 40.4 43.4 -7.3 76 85 A E - 0 0 75 -11,-2.6 -11,-0.5 -2,-0.4 10,-0.1 -0.580 29.7 -82.0 -91.2 153.4 37.3 45.6 -7.0 77 86 A K + 0 0 182 -2,-0.2 2,-0.2 -13,-0.1 -1,-0.1 -0.295 68.3 130.5 -60.0 122.7 37.3 49.1 -5.4 78 88 A G - 0 0 23 1,-0.4 -14,-0.1 -2,-0.1 2,-0.1 -0.469 65.5 -32.6-137.0-142.1 37.0 49.0 -1.6 79 89 A T > - 0 0 71 -2,-0.2 4,-2.8 1,-0.1 -1,-0.4 -0.353 65.6-103.7 -75.9 168.3 39.0 50.9 1.1 80 90 A S H > S+ 0 0 87 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.928 124.0 49.1 -58.7 -44.4 42.7 51.6 0.4 81 91 A f H > S+ 0 0 31 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.926 110.9 49.9 -60.5 -45.4 43.7 48.7 2.8 82 92 A E H > S+ 0 0 43 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.918 110.2 50.2 -62.3 -42.7 41.3 46.3 1.1 83 93 A N H X S+ 0 0 51 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.924 114.9 43.3 -60.6 -44.7 42.6 47.2 -2.4 84 94 A R H X S+ 0 0 129 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.882 113.0 50.9 -72.1 -39.8 46.2 46.7 -1.3 85 95 A I H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.2 5,-0.2 0.944 110.2 51.5 -61.5 -44.9 45.5 43.5 0.7 86 96 A g H X S+ 0 0 1 -4,-2.6 4,-3.1 -5,-0.2 5,-0.2 0.925 108.3 50.3 -58.7 -47.1 43.7 42.1 -2.4 87 97 A E H X S+ 0 0 97 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.881 110.4 51.3 -62.3 -33.4 46.6 42.9 -4.7 88 98 A e H X S+ 0 0 4 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.935 114.0 42.8 -65.7 -47.1 48.9 41.1 -2.2 89 99 A D H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.890 111.7 54.4 -67.3 -41.4 46.7 38.0 -2.1 90 100 A K H X S+ 0 0 50 -4,-3.1 4,-2.4 -5,-0.2 5,-0.2 0.921 109.0 48.8 -56.9 -48.3 46.2 38.0 -5.9 91 101 A A H X S+ 0 0 55 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.926 111.9 48.9 -59.5 -45.3 49.9 38.1 -6.5 92 102 A A H X S+ 0 0 4 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.928 111.0 49.0 -61.9 -46.7 50.5 35.2 -4.1 93 103 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.921 114.3 45.5 -60.4 -45.7 47.7 33.0 -5.6 94 104 A I H X S+ 0 0 69 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.911 112.0 52.5 -63.1 -42.1 49.1 33.6 -9.1 95 105 A c H X S+ 0 0 34 -4,-2.7 4,-0.9 -5,-0.2 -2,-0.2 0.913 108.7 50.0 -61.4 -41.5 52.6 32.9 -7.8 96 106 A F H >< S+ 0 0 5 -4,-2.7 3,-0.8 1,-0.2 4,-0.2 0.933 111.5 49.2 -62.3 -44.3 51.4 29.6 -6.3 97 107 A R H >< S+ 0 0 125 -4,-2.2 3,-0.9 1,-0.2 -2,-0.2 0.883 109.1 51.8 -60.6 -42.1 49.8 28.7 -9.7 98 108 A Q H 3< S+ 0 0 146 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.642 115.4 42.6 -70.9 -15.7 52.9 29.6 -11.6 99 109 A N T XX S+ 0 0 32 -4,-0.9 3,-1.7 -3,-0.8 4,-0.7 0.214 74.3 108.0-119.6 17.6 55.0 27.3 -9.3 100 110 A L G X4 S+ 0 0 48 -3,-0.9 3,-0.6 1,-0.3 -1,-0.1 0.790 70.6 71.3 -62.8 -25.7 52.9 24.3 -8.9 101 111 A N G 34 S+ 0 0 136 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.618 109.4 30.9 -66.3 -16.3 55.4 22.4 -11.2 102 112 A T G <4 S+ 0 0 61 -3,-1.7 -1,-0.2 2,-0.0 -2,-0.2 0.353 84.2 132.6-122.1 0.4 57.9 22.5 -8.3 103 113 A Y << - 0 0 28 -4,-0.7 2,-0.4 -3,-0.6 -3,-0.0 -0.313 39.8-161.6 -54.5 133.0 55.6 22.3 -5.3 104 114 A S > - 0 0 41 1,-0.1 3,-2.2 0, 0.0 4,-0.2 -0.966 23.8-152.6-128.6 121.9 57.0 19.7 -2.9 105 115 A K G > S+ 0 0 158 -2,-0.4 3,-1.7 1,-0.3 -1,-0.1 0.699 91.4 78.1 -60.4 -19.3 55.0 18.0 -0.1 106 116 A K G 3 S+ 0 0 154 1,-0.3 -1,-0.3 -82,-0.0 -3,-0.0 0.693 89.2 56.5 -63.5 -19.2 58.3 17.4 1.7 107 117 A Y G X S+ 0 0 36 -3,-2.2 -82,-2.7 3,-0.1 3,-1.3 0.440 78.9 112.7 -93.8 -0.3 58.2 21.1 2.7 108 118 A M B < S+A 24 0A 52 -3,-1.7 -84,-0.2 1,-0.3 -88,-0.1 -0.535 89.3 9.0 -72.2 137.5 54.8 20.8 4.4 109 119 A L T 3 S- 0 0 138 -86,-1.2 -1,-0.3 -2,-0.2 -85,-0.2 0.821 91.2-172.1 61.5 32.7 55.1 21.3 8.2 110 120 A Y < - 0 0 48 -87,-1.3 -1,-0.2 -3,-1.3 2,-0.1 -0.313 26.5-106.7 -59.2 135.4 58.7 22.4 7.7 111 121 A P > - 0 0 58 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.424 15.1-133.9 -69.7 138.3 60.5 22.8 11.1 112 122 A D G > S+ 0 0 115 1,-0.2 3,-2.1 2,-0.2 -2,-0.1 0.820 99.4 65.6 -58.1 -39.2 61.3 26.3 12.3 113 124 A F G 3 S+ 0 0 145 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.692 94.0 61.6 -65.1 -15.8 65.0 25.5 13.3 114 125 A L G < S+ 0 0 78 -3,-1.3 2,-0.6 1,-0.1 -1,-0.3 0.353 89.8 77.7 -90.2 6.7 65.9 24.9 9.6 115 126 A a < + 0 0 7 -3,-2.1 2,-0.3 -81,-0.1 -81,-0.2 -0.936 67.4 169.5-116.9 102.6 64.9 28.5 8.8 116 127 A K + 0 0 169 -2,-0.6 -81,-0.2 -83,-0.1 -3,-0.0 -0.897 31.9 13.5-120.8 147.4 67.8 30.8 10.0 117 128 A G S S- 0 0 38 -2,-0.3 -83,-4.2 -84,-0.1 2,-0.4 0.220 79.2 -78.2 79.5 160.0 68.7 34.4 9.5 118 129 A E - 0 0 162 -85,-0.2 2,-0.5 -83,-0.0 -85,-0.1 -0.820 33.1-161.0 -99.8 134.1 66.8 37.5 8.3 119 130 A L - 0 0 72 -2,-0.4 2,-0.1 -85,-0.2 -2,-0.0 -0.968 24.4-124.2-114.0 120.8 66.3 38.0 4.6 120 131 A K 0 0 187 -2,-0.5 -71,-0.0 1,-0.1 -2,-0.0 -0.379 360.0 360.0 -70.7 140.3 65.4 41.6 3.7 121 133 A d 0 0 139 -2,-0.1 -1,-0.1 -72,-0.1 -72,-0.0 0.852 360.0 360.0 -67.7 360.0 62.2 42.5 1.8