==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 08-AUG-07 2QVD . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR S.KUMAR,D.N.CHANDRA,N.SINGH,O.JITHESH,S.SHARMA,M.HARIDAS,T.P . 121 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7450.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 72 59.5 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 . 2 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 36.4 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 4 0, 0.0 4,-2.5 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 172.1 15.7 40.1 -5.2 2 2 A L H 3> + 0 0 99 58,-1.9 4,-2.7 1,-0.2 5,-0.2 0.783 360.0 62.5 -59.6 -26.4 16.8 43.8 -5.5 3 3 A L H 3> S+ 0 0 106 57,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.914 109.7 38.0 -63.5 -45.3 13.3 44.8 -4.3 4 4 A E H <> S+ 0 0 29 -3,-0.6 4,-2.5 2,-0.2 -2,-0.2 0.889 116.6 51.9 -72.7 -40.3 13.9 43.1 -0.9 5 5 A F H X S+ 0 0 23 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.921 109.0 51.2 -62.5 -44.8 17.5 44.1 -0.7 6 6 A G H X S+ 0 0 22 -4,-2.7 4,-2.2 -5,-0.2 11,-0.3 0.902 109.9 48.9 -57.9 -45.2 16.6 47.8 -1.4 7 7 A K H X S+ 0 0 113 -4,-1.5 4,-2.8 1,-0.2 5,-0.2 0.926 110.0 50.9 -66.4 -43.6 14.0 47.7 1.4 8 8 A M H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.915 110.1 50.7 -53.1 -49.7 16.4 46.2 3.9 9 9 A I H X>S+ 0 0 3 -4,-2.3 4,-3.2 2,-0.2 5,-0.5 0.943 112.2 45.5 -58.3 -49.0 19.0 48.8 3.1 10 10 A L H X5S+ 0 0 72 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.928 114.1 49.6 -59.7 -47.8 16.5 51.7 3.6 11 11 A E H <5S+ 0 0 82 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.930 118.0 39.9 -58.3 -46.8 15.2 50.2 6.8 12 12 A E H <5S+ 0 0 38 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.909 133.3 17.0 -70.4 -48.1 18.7 49.7 8.2 13 13 A T H <5S- 0 0 16 -4,-3.2 -3,-0.2 2,-0.3 -2,-0.2 0.511 87.7-127.8-107.9 -9.1 20.4 52.9 7.1 14 14 A G S < - 0 0 108 -2,-0.3 4,-1.6 1,-0.1 5,-0.4 -0.650 19.8-131.3 -79.8 134.8 17.8 54.7 -0.5 17 18 A A H > S+ 0 0 23 -2,-0.3 4,-2.4 -11,-0.3 5,-0.5 0.870 87.1 79.7 -55.6 -43.0 19.9 52.0 -2.3 18 19 A I H 4 S+ 0 0 132 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 -0.963 110.9 1.5-103.9 120.9 19.8 54.0 -5.5 19 20 A P H > S+ 0 0 80 0, 0.0 4,-0.5 0, 0.0 -1,-0.3 -0.949 128.0 57.5-105.6 9.2 21.7 56.2 -5.5 20 21 A S H < S+ 0 0 22 -4,-1.6 -3,-0.2 1,-0.2 -2,-0.2 0.833 124.6 17.5 -66.9 -32.8 23.6 56.0 -2.2 21 22 A Y T < S+ 0 0 11 -4,-2.4 -1,-0.2 -5,-0.4 -3,-0.2 0.218 108.4 76.1-122.1 10.9 24.9 52.4 -2.7 22 23 A S T 4 S+ 0 0 47 -5,-0.5 8,-0.5 -3,-0.2 -2,-0.1 0.610 108.8 25.5-100.3 -9.5 24.6 51.7 -6.4 23 24 A S S < S+ 0 0 36 -4,-0.5 87,-1.5 6,-0.2 86,-0.9 -0.000 89.8 132.5-136.4 30.7 27.6 53.6 -7.6 24 25 A Y B > -A 108 0A 0 84,-0.2 4,-1.7 85,-0.2 3,-0.3 -0.721 68.4 -44.4 -97.6 128.3 29.8 53.7 -4.5 25 26 A G T 4 S- 0 0 11 82,-2.5 85,-0.1 -2,-0.4 6,-0.1 -0.141 97.8 -45.6 58.5-144.7 33.4 52.8 -4.7 26 27 A a T 4 S+ 0 0 7 9,-0.1 7,-0.8 88,-0.1 -1,-0.2 0.697 133.9 30.1 -95.6 -19.4 34.7 49.8 -6.7 27 28 A Y T 4 S+ 0 0 10 -3,-0.3 2,-0.4 5,-0.2 -2,-0.2 0.644 85.1 98.9-116.9 -23.4 32.2 47.2 -5.6 28 29 A b S < S- 0 0 7 -4,-1.7 3,-0.4 2,-0.0 2,-0.2 -0.577 95.3 -12.9 -73.4 126.8 28.8 48.7 -4.7 29 30 A G S S- 0 0 38 -2,-0.4 -6,-0.2 1,-0.2 -7,-0.1 -0.537 129.4 -0.8 83.3-162.6 26.5 48.2 -7.7 30 31 A W S S+ 0 0 250 -8,-0.5 -1,-0.2 -2,-0.2 -7,-0.1 0.742 109.2 85.8 -27.1 -57.6 27.7 47.2 -11.3 31 32 A G + 0 0 28 -3,-0.4 -5,-0.1 -6,-0.1 -2,-0.1 0.163 39.2 171.1 -57.7 167.9 31.3 46.9 -10.6 32 33 A G + 0 0 49 83,-0.1 2,-0.3 -4,-0.1 -5,-0.2 -0.151 40.5 99.9-171.7 68.1 33.6 44.3 -9.3 33 34 A K + 0 0 86 -7,-0.8 85,-0.1 85,-0.0 83,-0.1 -0.998 58.8 5.0-156.9 158.6 37.3 45.1 -9.6 34 35 A G S S- 0 0 1 83,-0.6 83,-0.3 -2,-0.3 85,-0.2 -0.238 96.6 -25.9 72.6-164.3 40.4 46.3 -7.7 35 36 A T - 0 0 74 81,-1.7 81,-0.2 83,-0.1 -9,-0.1 -0.741 67.1-110.9 -87.7 128.8 40.8 47.1 -4.0 36 37 A P - 0 0 10 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.331 23.7-140.8 -61.7 139.6 37.7 48.2 -2.0 37 38 A K - 0 0 76 1,-0.1 2,-0.3 70,-0.1 -12,-0.1 0.779 67.8 -15.0 -74.1 -35.5 38.0 51.9 -1.0 38 39 A D S > S- 0 0 20 69,-0.0 4,-2.3 1,-0.0 3,-0.3 -0.932 84.8 -72.3-158.0 177.4 36.6 51.9 2.5 39 40 A A H > S+ 0 0 14 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.839 127.9 51.4 -48.0 -46.5 34.5 49.8 5.0 40 41 A T H > S+ 0 0 0 59,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.928 110.4 49.6 -59.7 -44.9 31.2 50.4 3.1 41 42 A D H > S+ 0 0 0 -3,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.850 107.2 55.3 -61.1 -38.4 32.9 49.3 -0.2 42 43 A R H X S+ 0 0 133 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.862 101.9 57.2 -61.6 -37.7 34.2 46.2 1.6 43 44 A c H X S+ 0 0 2 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.908 109.3 45.4 -57.9 -46.9 30.7 45.3 2.6 44 45 A b H X S+ 0 0 8 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.900 110.4 54.5 -60.8 -44.2 29.8 45.4 -1.1 45 46 A F H X S+ 0 0 23 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.955 111.4 43.4 -53.6 -51.7 32.9 43.3 -1.9 46 47 A V H X S+ 0 0 87 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.922 112.3 54.7 -63.8 -36.8 31.9 40.6 0.6 47 48 A H H X S+ 0 0 17 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.901 107.8 48.6 -59.6 -43.6 28.3 40.8 -0.7 48 49 A D H X S+ 0 0 57 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.906 112.3 49.4 -63.5 -41.0 29.5 40.2 -4.3 49 50 A d H X S+ 0 0 17 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.881 108.0 54.8 -65.1 -38.9 31.5 37.2 -3.0 50 51 A e H >< S+ 0 0 34 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.919 110.5 43.4 -61.8 -46.5 28.5 35.9 -1.2 51 52 A Y H >< S+ 0 0 33 -4,-2.1 3,-2.6 1,-0.2 -1,-0.2 0.884 107.2 63.2 -63.8 -39.4 26.4 35.9 -4.3 52 53 A G H 3< S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.692 92.7 63.1 -59.3 -22.8 29.4 34.4 -6.1 53 54 A N T << S+ 0 0 113 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.472 95.7 66.5 -74.8 -7.1 29.0 31.4 -3.9 54 55 A L X + 0 0 10 -3,-2.6 3,-1.7 1,-0.1 -1,-0.2 -0.469 56.0 161.8-122.0 70.4 25.5 30.8 -5.5 55 56 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.798 77.7 44.4 -48.5 -50.1 26.0 29.8 -9.2 56 59 A D T 3 S+ 0 0 155 2,-0.0 2,-0.3 25,-0.0 25,-0.1 0.004 100.3 87.5 -95.2 24.1 22.7 28.3 -9.8 57 61 A f < - 0 0 10 -3,-1.7 -3,-0.1 -6,-0.2 25,-0.0 -0.834 65.3-144.8-119.5 158.2 20.7 31.0 -8.0 58 67 A N >> + 0 0 105 -2,-0.3 4,-2.5 1,-0.1 3,-1.3 -0.694 22.4 174.2-127.3 77.0 19.3 34.3 -9.4 59 68 A P T 34 S+ 0 0 22 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.661 73.0 58.6 -66.2 -20.5 19.7 36.8 -6.5 60 69 A K T 34 S+ 0 0 145 -59,-0.2 -58,-1.9 1,-0.1 -57,-0.3 0.810 122.5 19.5 -76.4 -28.9 18.6 39.8 -8.5 61 70 A S T <4 S+ 0 0 86 -3,-1.3 2,-0.6 -60,-0.2 -1,-0.1 0.570 95.4 99.1-120.0 -17.9 15.2 38.4 -9.4 62 71 A D < - 0 0 39 -4,-2.5 2,-0.3 19,-0.0 -5,-0.0 -0.680 65.7-142.8 -75.4 117.6 14.4 35.7 -7.0 63 72 A R - 0 0 161 -2,-0.6 2,-0.2 -60,-0.1 19,-0.1 -0.623 21.0-179.8 -84.1 135.4 12.1 37.1 -4.3 64 73 A Y - 0 0 5 -2,-0.3 2,-0.4 -63,-0.1 13,-0.1 -0.767 21.9-124.5-118.7 173.6 12.5 35.9 -0.6 65 74 A K + 0 0 153 11,-0.3 11,-2.4 -2,-0.2 2,-0.3 -0.959 27.2 175.1-119.4 141.7 10.6 36.9 2.5 66 75 A Y E -B 75 0B 28 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.971 8.9-162.3-138.3 159.4 12.0 38.3 5.7 67 76 A K E -B 74 0B 104 7,-2.6 7,-3.3 -2,-0.3 2,-0.5 -0.811 21.2-115.9-131.8 169.4 10.5 39.6 8.9 68 77 A R E -B 73 0B 85 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.956 23.5-176.0-110.6 125.3 11.7 41.7 11.8 69 78 A V E > S-B 72 0B 68 3,-2.4 3,-1.7 -2,-0.5 -2,-0.0 -0.953 81.4 -19.7-119.1 108.6 11.9 40.2 15.3 70 79 A N T 3 S- 0 0 174 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.868 128.9 -53.8 65.0 33.3 12.9 42.7 18.0 71 80 A G T 3 S+ 0 0 53 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.144 114.0 125.5 86.2 -19.6 14.3 44.9 15.2 72 81 A A E < -B 69 0B 52 -3,-1.7 -3,-2.4 1,-0.1 2,-0.4 -0.474 65.8-117.0 -79.2 141.9 16.4 41.9 14.0 73 82 A I E -B 68 0B 5 -5,-0.2 2,-0.5 -2,-0.2 -5,-0.2 -0.610 32.0-172.9 -77.7 127.8 16.2 40.7 10.4 74 83 A V E -B 67 0B 50 -7,-3.3 -7,-2.6 -2,-0.4 2,-0.4 -0.971 17.4-139.7-124.5 117.1 14.9 37.1 10.2 75 84 A g E -B 66 0B 24 -2,-0.5 -9,-0.2 -9,-0.2 2,-0.2 -0.609 21.9-137.7 -74.9 127.8 15.0 35.3 6.8 76 85 A E - 0 0 80 -11,-2.4 -11,-0.3 -2,-0.4 2,-0.2 -0.489 31.1 -85.2 -85.8 156.0 11.8 33.2 6.3 77 86 A K + 0 0 190 -2,-0.2 2,-0.2 -13,-0.1 -1,-0.1 -0.396 66.8 134.9 -66.2 126.9 11.8 29.7 4.9 78 88 A G - 0 0 26 1,-0.5 -14,-0.1 -2,-0.2 -1,-0.0 -0.465 62.9 -36.1-137.5-148.1 11.7 29.6 1.0 79 89 A T > - 0 0 73 -2,-0.2 4,-2.4 1,-0.1 -1,-0.5 -0.292 67.4 -99.2 -71.6 167.5 13.7 27.6 -1.5 80 90 A S H > S+ 0 0 83 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.925 126.0 48.9 -51.5 -50.5 17.3 26.8 -0.8 81 91 A f H > S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.934 109.7 51.8 -56.7 -49.8 18.4 29.7 -3.1 82 92 A E H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.870 110.4 49.1 -57.3 -39.8 15.9 32.1 -1.5 83 93 A N H X S+ 0 0 54 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.936 114.3 43.8 -65.2 -44.1 17.3 31.3 2.0 84 94 A R H X S+ 0 0 121 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.892 113.0 51.4 -75.8 -38.4 20.9 31.7 1.0 85 95 A I H X S+ 0 0 0 -4,-3.0 4,-2.1 -5,-0.2 -1,-0.2 0.937 108.5 51.4 -60.6 -50.3 20.2 34.9 -1.0 86 96 A g H X S+ 0 0 1 -4,-2.2 4,-3.1 -5,-0.2 -2,-0.2 0.897 107.7 53.1 -51.6 -45.3 18.4 36.5 2.0 87 97 A E H X S+ 0 0 101 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.908 109.0 49.5 -60.6 -43.0 21.4 35.6 4.3 88 98 A e H X S+ 0 0 6 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.913 115.3 43.5 -55.6 -47.8 23.9 37.4 1.9 89 99 A D H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.902 111.2 53.8 -68.7 -45.0 21.6 40.5 1.7 90 100 A K H X S+ 0 0 54 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.907 109.6 49.1 -54.8 -47.5 21.0 40.5 5.6 91 101 A A H X S+ 0 0 55 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.895 111.9 48.2 -61.2 -46.1 24.8 40.5 6.2 92 102 A A H X S+ 0 0 4 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.905 109.6 52.1 -59.7 -44.3 25.3 43.4 3.7 93 103 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.924 113.9 43.8 -61.4 -45.1 22.5 45.5 5.3 94 104 A I H X S+ 0 0 72 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.903 111.5 53.8 -63.7 -44.1 24.0 45.1 8.7 95 105 A c H X S+ 0 0 35 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.906 109.4 49.0 -57.2 -44.6 27.5 45.7 7.4 96 106 A F H < S+ 0 0 4 -4,-2.7 3,-0.4 1,-0.2 -1,-0.2 0.914 111.5 48.6 -60.7 -43.9 26.2 49.0 5.9 97 107 A R H >< S+ 0 0 135 -4,-1.9 3,-1.0 1,-0.2 4,-0.2 0.893 109.7 53.9 -63.5 -38.7 24.6 50.0 9.2 98 108 A Q H 3< S+ 0 0 146 -4,-2.9 3,-0.2 1,-0.2 -1,-0.2 0.765 115.7 38.0 -66.4 -24.7 27.8 49.2 11.0 99 109 A N T >< S+ 0 0 36 -4,-1.2 3,-1.0 -3,-0.4 4,-0.3 0.164 78.1 113.3-116.8 18.9 29.9 51.4 8.8 100 110 A L G X + 0 0 41 -3,-1.0 3,-0.9 1,-0.3 -1,-0.2 0.787 69.4 65.4 -61.6 -29.9 27.5 54.3 8.4 101 111 A N G 3 S+ 0 0 140 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.792 107.7 39.8 -64.5 -31.8 29.8 56.6 10.3 102 112 A T G < S+ 0 0 67 -3,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.332 79.8 130.0-101.8 3.3 32.5 56.4 7.6 103 113 A Y < - 0 0 33 -3,-0.9 2,-0.4 -4,-0.3 -3,-0.0 -0.424 44.2-159.6 -53.0 125.7 30.2 56.5 4.6 104 114 A S > - 0 0 34 1,-0.1 3,-2.4 -2,-0.1 4,-0.2 -0.965 27.3-148.8-123.3 132.3 31.7 59.2 2.3 105 115 A K G > S+ 0 0 170 -2,-0.4 3,-1.4 1,-0.3 -1,-0.1 0.713 95.1 77.3 -61.1 -19.6 30.0 61.2 -0.5 106 116 A K G 3 S+ 0 0 149 1,-0.3 -1,-0.3 -82,-0.0 -3,-0.0 0.763 91.0 51.6 -62.1 -27.1 33.4 61.2 -2.1 107 117 A Y G X S+ 0 0 30 -3,-2.4 -82,-2.5 3,-0.1 3,-1.0 0.449 81.6 111.3 -94.6 -0.5 33.1 57.6 -3.2 108 118 A M B < S+A 24 0A 66 -3,-1.4 -84,-0.2 1,-0.3 -88,-0.1 -0.508 91.2 6.7 -70.8 140.7 29.7 58.1 -4.9 109 119 A L T 3 S- 0 0 141 -86,-0.9 -1,-0.3 -90,-0.2 -85,-0.2 0.901 94.9-170.7 52.7 40.5 30.0 57.8 -8.7 110 120 A Y < - 0 0 46 -87,-1.5 -1,-0.1 -3,-1.0 -3,-0.1 -0.324 25.7 -95.4 -63.9 145.9 33.6 56.7 -8.2 111 121 A P - 0 0 51 0, 0.0 3,-0.3 0, 0.0 4,-0.1 -0.284 18.1-143.5 -59.1 140.3 35.9 56.3 -11.4 112 122 A D S > S+ 0 0 99 1,-0.2 3,-2.0 2,-0.2 -2,-0.1 0.918 99.5 58.8 -70.3 -39.6 36.2 53.0 -12.9 113 124 A F T 3 S+ 0 0 144 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.715 98.0 60.2 -66.1 -16.5 39.9 53.7 -13.7 114 125 A L T 3 S+ 0 0 76 -3,-0.3 2,-1.3 1,-0.1 -1,-0.3 0.408 77.3 97.3 -90.6 4.3 40.7 54.2 -10.1 115 126 A a < + 0 0 7 -3,-2.0 2,-0.3 -4,-0.1 -81,-0.1 -0.757 62.1 163.5 -92.5 91.1 39.6 50.7 -9.1 116 127 A K + 0 0 158 -2,-1.3 -81,-1.7 -81,-0.2 2,-0.3 -0.850 24.4 22.0-120.8 148.5 43.0 49.2 -9.2 117 128 A G S S- 0 0 50 -2,-0.3 -83,-0.6 -83,-0.3 2,-0.3 -0.738 76.7 -82.0 106.4-152.8 44.7 46.1 -7.9 118 129 A E + 0 0 130 -2,-0.3 2,-0.3 -85,-0.1 -83,-0.1 -0.985 29.9 177.0-158.3 148.6 43.2 42.8 -7.0 119 130 A L - 0 0 78 -2,-0.3 2,-0.1 -85,-0.2 -85,-0.0 -0.888 19.2-147.7-153.2 119.0 41.5 41.0 -4.1 120 131 A K 0 0 186 -2,-0.3 -71,-0.0 1,-0.1 -2,-0.0 -0.484 360.0 360.0 -86.2 158.5 40.1 37.4 -4.3 121 133 A d 0 0 117 -2,-0.1 -1,-0.1 -72,-0.1 -75,-0.1 0.198 360.0 360.0 -75.3 360.0 37.0 36.1 -2.4