==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-MAY-06 2DPZ . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR N.SINGH,S.SHARMA,T.P.SINGH . 121 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7356.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 79 65.3 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 7.4 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 0.8 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 . 1 0.8 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 . 16 13.2 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 . 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 S > 0 0 7 0, 0.0 4,-1.8 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 164.3 13.1 15.4 -4.8 2 2 A L H > + 0 0 76 58,-2.5 4,-1.3 1,-0.2 59,-0.1 0.714 360.0 58.1 -66.0 -22.8 9.8 16.9 -5.5 3 3 A L H > S+ 0 0 144 57,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.855 108.7 43.5 -78.8 -35.3 7.9 13.7 -4.4 4 4 A E H > S+ 0 0 28 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.808 109.2 55.7 -83.7 -23.2 9.4 13.7 -1.0 5 5 A F H X S+ 0 0 20 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.896 108.2 52.3 -67.3 -37.4 8.8 17.4 -0.5 6 6 A G H X S+ 0 0 18 -4,-1.3 4,-2.1 -5,-0.2 11,-0.3 0.915 111.6 44.5 -60.0 -43.0 5.2 16.7 -1.3 7 7 A K H X S+ 0 0 123 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.846 111.0 52.9 -76.9 -33.1 5.1 14.0 1.3 8 8 A M H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.921 110.3 49.2 -62.6 -46.3 6.9 16.1 3.9 9 9 A I H X>S+ 0 0 5 -4,-2.4 4,-3.0 2,-0.2 5,-0.5 0.941 110.8 49.4 -58.3 -50.6 4.4 18.9 3.4 10 10 A L H X5S+ 0 0 75 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.927 111.9 49.2 -55.6 -46.7 1.4 16.5 3.7 11 11 A E H <5S+ 0 0 86 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.875 117.0 41.6 -61.1 -39.5 2.9 15.0 6.9 12 12 A E H <5S+ 0 0 34 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.898 131.5 17.1 -74.1 -43.9 3.4 18.5 8.4 13 13 A T H <5S- 0 0 19 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.621 87.6-123.5-109.7 -22.6 0.3 20.3 7.4 14 14 A G S < - 0 0 107 -2,-0.4 4,-1.5 1,-0.1 5,-0.4 -0.543 18.5-133.7 -74.2 134.8 -1.8 17.9 -0.3 17 18 A A H > S+ 0 0 22 -11,-0.3 4,-2.2 -2,-0.3 5,-0.4 0.894 88.9 76.5 -55.0 -45.8 1.1 19.7 -2.0 18 19 A I H 4 S+ 0 0 126 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 -0.978 113.4 0.9-104.7 121.0 -1.0 19.6 -5.2 19 20 A P H >> S+ 0 0 72 0, 0.0 3,-0.7 0, 0.0 4,-0.6 -0.986 126.3 60.3-103.4 3.1 -3.0 21.6 -5.2 20 21 A S H 3< S+ 0 0 18 -4,-1.5 -3,-0.2 1,-0.2 -2,-0.2 0.832 123.3 17.8 -57.9 -37.1 -2.7 23.5 -1.9 21 22 A Y T 3< S+ 0 0 12 -4,-2.2 -1,-0.2 -5,-0.4 3,-0.2 0.223 107.3 80.9-121.8 13.5 0.8 24.7 -2.4 22 23 A S T <4 S+ 0 0 36 -3,-0.7 -2,-0.1 -5,-0.4 -1,-0.1 0.543 106.9 21.4-100.4 -5.2 1.3 24.4 -6.1 23 24 A S S < S+ 0 0 32 -4,-0.6 86,-1.4 6,-0.2 87,-1.3 -0.128 88.5 135.8-149.2 44.3 -0.4 27.6 -7.3 24 25 A Y B > -AB 28 108A 0 4,-0.6 4,-1.9 -3,-0.2 3,-0.4 -0.819 67.7 -45.2-103.9 133.1 -0.4 29.8 -4.2 25 26 A G T 4 S- 0 0 9 82,-2.3 85,-0.1 -2,-0.5 90,-0.1 -0.145 99.5 -45.3 53.0-138.0 0.4 33.4 -4.3 26 27 A a T 4 S+ 0 0 6 9,-0.1 6,-0.5 5,-0.1 7,-0.4 0.674 134.6 27.8-102.4 -21.7 3.4 34.5 -6.3 27 28 A Y T 4 S+ 0 0 16 -3,-0.4 2,-0.7 4,-0.2 4,-0.3 0.441 90.0 97.3-123.8 -6.9 6.1 32.0 -5.3 28 29 A b B < S-A 24 0A 3 -4,-1.9 2,-1.0 2,-0.2 -4,-0.6 -0.801 100.2 -8.9 -88.7 120.0 4.4 28.8 -4.3 29 30 A G S S+ 0 0 53 -2,-0.7 2,-0.4 -6,-0.2 -6,-0.2 -0.654 141.7 10.1 110.8 -77.3 4.3 26.3 -7.2 30 31 A W S S+ 0 0 229 -2,-1.0 2,-0.4 -6,-0.1 -2,-0.2 -0.957 87.4 158.1-143.7 102.0 5.6 28.1 -10.2 31 32 A G + 0 0 25 -2,-0.4 -4,-0.2 -4,-0.3 -2,-0.1 -0.984 23.0 153.9-146.0 136.4 7.0 31.5 -9.2 32 33 A G - 0 0 61 -6,-0.5 2,-0.3 -2,-0.4 -1,-0.1 0.654 61.3 -3.7-129.5 -24.6 9.3 34.0 -10.5 33 34 A K + 0 0 120 -7,-0.4 -1,-0.3 2,-0.1 2,-0.1 -0.947 69.6 69.4-161.5 179.3 8.6 37.5 -9.2 34 35 A G S S- 0 0 0 -2,-0.3 83,-0.3 83,-0.3 81,-0.1 -0.386 82.0 -50.2 95.0-175.0 6.6 40.1 -7.3 35 36 A T - 0 0 77 81,-1.4 81,-0.2 -2,-0.1 2,-0.1 -0.805 63.5-104.8 -93.6 134.5 6.2 40.6 -3.6 36 37 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.429 26.8-139.6 -58.8 133.6 5.1 37.5 -1.6 37 38 A K - 0 0 62 -2,-0.1 2,-0.3 1,-0.1 -12,-0.1 0.785 68.4 -19.4 -71.0 -33.0 1.4 37.9 -0.7 38 39 A D S >> S- 0 0 20 1,-0.1 4,-1.9 69,-0.0 3,-0.6 -0.950 84.5 -68.9-162.5 179.4 1.5 36.5 2.8 39 40 A A H 3> S+ 0 0 13 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.857 127.0 50.3 -46.4 -50.4 3.5 34.4 5.3 40 41 A T H 3> S+ 0 0 0 1,-0.3 4,-1.3 59,-0.2 -1,-0.2 0.881 111.7 48.9 -58.4 -42.0 2.9 31.1 3.5 41 42 A D H <> S+ 0 0 0 -3,-0.6 4,-2.1 1,-0.2 -1,-0.3 0.770 106.8 56.3 -69.4 -26.5 4.0 32.7 0.2 42 43 A R H X S+ 0 0 138 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.881 102.4 56.4 -74.2 -32.4 7.1 34.1 2.0 43 44 A c H X S+ 0 0 2 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.905 108.6 46.2 -58.4 -44.7 7.9 30.5 2.9 44 45 A b H X S+ 0 0 9 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.870 110.9 53.1 -65.8 -38.0 7.8 29.6 -0.8 45 46 A F H X S+ 0 0 23 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.952 111.9 44.0 -61.0 -49.7 10.0 32.6 -1.6 46 47 A V H X S+ 0 0 91 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.910 111.2 55.5 -63.5 -38.9 12.6 31.6 1.0 47 48 A H H X S+ 0 0 12 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.915 108.5 47.4 -58.1 -43.7 12.3 28.0 -0.3 48 49 A D H X S+ 0 0 55 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.881 111.5 50.4 -65.5 -39.2 13.1 29.2 -3.8 49 50 A d H X S+ 0 0 15 -4,-2.1 4,-1.0 2,-0.2 -2,-0.2 0.904 107.5 55.2 -64.6 -39.2 16.1 31.3 -2.6 50 51 A e H >< S+ 0 0 34 -4,-2.9 3,-1.1 1,-0.2 -2,-0.2 0.949 109.8 44.0 -61.5 -47.9 17.3 28.3 -0.7 51 52 A Y H >< S+ 0 0 27 -4,-2.1 3,-2.4 1,-0.2 -1,-0.2 0.871 106.9 63.9 -60.1 -37.5 17.4 26.1 -3.9 52 53 A G H 3< S+ 0 0 56 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.718 91.2 63.2 -62.5 -22.7 18.9 29.1 -5.6 53 54 A N T << S+ 0 0 124 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.452 97.8 62.5 -76.3 -2.7 22.0 28.8 -3.4 54 55 A L X + 0 0 14 -3,-2.4 3,-1.6 1,-0.1 -1,-0.2 -0.523 56.6 161.1-123.6 66.7 22.6 25.4 -5.0 55 56 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.760 78.0 46.6 -57.7 -32.4 23.2 26.1 -8.7 56 59 A D T 3 S+ 0 0 154 2,-0.0 2,-0.3 25,-0.0 25,-0.1 0.188 99.2 84.5-104.0 23.2 24.9 22.6 -9.3 57 61 A f S < S- 0 0 13 -3,-1.6 -3,-0.1 -6,-0.2 25,-0.0 -0.754 70.1-139.0-115.4 159.8 22.3 20.5 -7.4 58 67 A N >> + 0 0 107 -2,-0.3 4,-2.9 1,-0.1 3,-0.7 -0.713 22.8 175.8-127.8 78.0 19.0 19.2 -8.9 59 68 A P T 34 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.788 74.6 53.9 -49.3 -44.1 16.3 19.6 -6.2 60 69 A K T 34 S+ 0 0 114 -59,-0.2 -58,-2.5 1,-0.2 -57,-0.3 0.804 124.6 21.9 -67.0 -29.8 13.3 18.4 -8.1 61 70 A S T <4 S+ 0 0 87 -3,-0.7 2,-0.4 -60,-0.2 -1,-0.2 0.647 95.9 95.0-115.5 -19.0 14.8 15.1 -9.1 62 71 A D < - 0 0 38 -4,-2.9 2,-0.3 19,-0.0 -5,-0.0 -0.654 66.6-140.6 -77.8 127.6 17.6 14.3 -6.6 63 72 A R - 0 0 170 -2,-0.4 2,-0.3 -62,-0.1 19,-0.1 -0.692 20.3-176.9 -93.7 140.1 16.3 12.0 -3.8 64 73 A Y - 0 0 6 -2,-0.3 2,-0.4 -63,-0.1 13,-0.1 -0.776 20.5-123.5-121.9 170.0 17.3 12.4 -0.2 65 74 A K + 0 0 144 11,-0.4 11,-2.4 -2,-0.3 2,-0.3 -0.915 30.8 165.6-116.1 145.8 16.5 10.4 2.9 66 75 A Y E -C 75 0B 33 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.980 14.8-158.9-152.6 159.3 15.0 11.7 6.1 67 76 A K E -C 74 0B 103 7,-2.2 7,-2.9 -2,-0.3 2,-0.6 -0.868 21.5-119.0-135.4 165.4 13.4 10.4 9.2 68 77 A R E -C 73 0B 78 -2,-0.3 2,-1.4 5,-0.2 5,-0.2 -0.934 14.5-164.7-114.6 111.1 11.1 11.7 11.9 69 78 A V E > S-C 72 0B 78 3,-2.5 3,-0.8 -2,-0.6 4,-0.1 -0.625 83.5 -42.8 -93.7 72.3 12.4 11.6 15.5 70 79 A N T 3 S- 0 0 170 -2,-1.4 -1,-0.2 1,-0.2 3,-0.1 0.716 123.0 -37.2 79.2 27.1 9.1 12.2 17.2 71 80 A G T 3 S+ 0 0 44 1,-0.5 -1,-0.2 0, 0.0 2,-0.2 -0.086 114.9 113.9 112.9 -35.4 7.9 14.8 14.8 72 81 A A E < -C 69 0B 60 -3,-0.8 -3,-2.5 1,-0.1 -1,-0.5 -0.540 67.7-128.8 -69.7 136.2 11.2 16.4 14.3 73 82 A I E -C 68 0B 4 -5,-0.2 2,-0.5 -2,-0.2 -5,-0.2 -0.747 24.0-169.3 -87.1 126.5 12.6 16.0 10.8 74 83 A V E -C 67 0B 49 -7,-2.9 -7,-2.2 -2,-0.5 2,-0.4 -0.963 14.7-141.5-123.8 118.2 16.1 14.7 10.6 75 84 A g E -C 66 0B 26 -2,-0.5 -9,-0.2 -9,-0.2 2,-0.2 -0.637 20.5-139.8 -77.7 127.8 18.0 14.7 7.3 76 85 A E - 0 0 75 -11,-2.4 -11,-0.4 -2,-0.4 2,-0.1 -0.563 30.1 -86.1 -87.9 156.4 20.0 11.6 6.8 77 86 A K + 0 0 193 -2,-0.2 2,-0.2 -13,-0.1 -1,-0.1 -0.370 66.9 128.9 -65.2 131.1 23.5 11.6 5.3 78 88 A G - 0 0 31 1,-0.4 -14,-0.1 -2,-0.1 -1,-0.1 -0.497 64.0 -27.4-147.1-143.6 23.8 11.5 1.5 79 89 A T > - 0 0 70 -2,-0.2 4,-2.2 1,-0.1 -1,-0.4 -0.325 67.2-102.6 -75.4 165.3 25.6 13.6 -1.1 80 90 A S H > S+ 0 0 76 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.892 124.0 48.8 -55.9 -42.3 26.4 17.2 -0.3 81 91 A f H > S+ 0 0 22 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.907 109.5 50.6 -64.9 -46.2 23.5 18.2 -2.6 82 92 A E H > S+ 0 0 43 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.871 110.4 50.6 -58.6 -40.8 21.0 15.8 -1.0 83 93 A N H X S+ 0 0 49 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.925 115.1 41.9 -65.8 -43.9 21.9 17.1 2.4 84 94 A R H X S+ 0 0 110 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.865 113.8 50.9 -73.2 -38.7 21.4 20.7 1.5 85 95 A I H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 3,-0.2 0.969 109.7 52.2 -60.6 -52.8 18.3 20.1 -0.6 86 96 A g H X S+ 0 0 1 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.873 107.5 51.2 -49.3 -44.7 16.8 18.2 2.4 87 97 A E H X S+ 0 0 104 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.881 109.0 52.0 -63.9 -38.1 17.6 21.2 4.7 88 98 A e H X S+ 0 0 7 -4,-1.9 4,-1.8 -3,-0.2 -2,-0.2 0.892 113.6 43.6 -58.8 -43.6 15.8 23.6 2.3 89 99 A D H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.892 110.5 53.6 -72.4 -45.2 12.7 21.4 2.2 90 100 A K H X S+ 0 0 50 -4,-2.5 4,-2.1 -5,-0.2 5,-0.2 0.906 109.7 49.6 -52.5 -48.7 12.6 20.8 5.9 91 101 A A H X S+ 0 0 55 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.904 111.1 49.1 -58.3 -47.5 12.7 24.5 6.5 92 102 A A H X S+ 0 0 4 -4,-1.8 4,-3.0 2,-0.2 -2,-0.2 0.926 110.0 50.7 -58.8 -48.4 9.8 25.1 4.1 93 103 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.868 113.8 45.0 -58.0 -41.1 7.7 22.4 5.6 94 104 A I H X S+ 0 0 73 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.917 111.1 53.1 -68.6 -44.8 8.2 23.9 9.1 95 105 A c H X S+ 0 0 35 -4,-2.9 4,-1.4 1,-0.2 -2,-0.2 0.946 110.2 48.8 -55.7 -46.9 7.6 27.4 7.7 96 106 A F H >< S+ 0 0 4 -4,-3.0 3,-0.6 1,-0.2 4,-0.4 0.947 110.6 49.8 -56.0 -49.5 4.3 26.1 6.3 97 107 A R H >< S+ 0 0 135 -4,-2.3 3,-1.2 1,-0.2 4,-0.2 0.922 109.2 52.9 -55.1 -45.9 3.3 24.5 9.6 98 108 A Q H 3< S+ 0 0 148 -4,-2.8 3,-0.2 1,-0.3 -1,-0.2 0.746 115.6 39.1 -62.7 -28.6 4.0 27.7 11.4 99 109 A N T XX S+ 0 0 35 -4,-1.4 3,-1.4 -3,-0.6 4,-0.6 0.200 76.0 111.9-111.8 16.2 1.8 29.8 9.2 100 110 A L G X4 S+ 0 0 44 -3,-1.2 3,-0.9 -4,-0.4 -1,-0.2 0.826 71.5 67.3 -54.4 -33.2 -1.1 27.4 8.6 101 111 A N G 34 S+ 0 0 132 -4,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.749 106.1 38.3 -61.3 -28.5 -3.3 29.8 10.6 102 112 A T G <4 S+ 0 0 67 -3,-1.4 -1,-0.2 2,-0.1 -2,-0.2 0.382 81.2 130.7-105.5 1.4 -3.1 32.6 8.0 103 113 A Y << - 0 0 37 -3,-0.9 2,-0.4 -4,-0.6 -3,-0.0 -0.330 42.9-160.6 -53.9 133.3 -3.3 30.3 4.9 104 114 A S > - 0 0 37 1,-0.1 3,-2.2 -66,-0.0 4,-0.2 -0.973 27.1-148.8-134.0 125.8 -5.9 31.8 2.6 105 115 A K G > S+ 0 0 49 -2,-0.4 3,-1.6 1,-0.3 -1,-0.1 0.711 94.1 74.5 -58.2 -23.9 -7.9 30.3 -0.3 106 116 A K G 3 S+ 0 0 152 1,-0.3 -1,-0.3 -82,-0.0 0, 0.0 0.681 93.6 54.7 -67.6 -12.7 -8.1 33.7 -2.0 107 117 A Y G X S+ 0 0 41 -3,-2.2 -82,-2.3 3,-0.1 3,-0.9 0.480 82.1 108.1 -97.5 -3.2 -4.4 33.2 -2.9 108 118 A M B < S+B 24 0A 70 -3,-1.6 -84,-0.2 1,-0.3 -88,-0.1 -0.470 91.1 8.3 -69.8 146.8 -4.9 29.8 -4.6 109 119 A L T 3 S- 0 0 140 -86,-1.4 -1,-0.3 1,-0.2 -85,-0.2 0.903 93.5-169.9 48.2 43.8 -4.6 29.9 -8.4 110 120 A Y < - 0 0 45 -87,-1.3 -1,-0.2 -3,-0.9 -3,-0.1 -0.513 22.7-109.5 -72.7 129.3 -3.4 33.5 -8.0 111 121 A P > - 0 0 57 0, 0.0 3,-1.2 0, 0.0 4,-0.2 -0.292 15.3-132.5 -62.9 138.0 -3.1 35.4 -11.3 112 122 A D G > S+ 0 0 114 1,-0.2 3,-0.9 2,-0.2 -2,-0.1 0.667 99.7 64.0 -65.5 -19.0 0.3 36.2 -12.6 113 124 A F G 3 S+ 0 0 136 1,-0.2 -1,-0.2 3,-0.0 -3,-0.0 0.777 95.0 62.3 -78.4 -18.3 -0.4 40.0 -13.4 114 125 A L G < S+ 0 0 56 -3,-1.2 2,-1.3 1,-0.1 -1,-0.2 0.526 79.0 94.8 -81.1 -4.0 -0.9 40.6 -9.7 115 126 A a < + 0 0 11 -3,-0.9 2,-0.4 -4,-0.2 -81,-0.1 -0.764 55.6 159.5 -88.4 99.8 2.6 39.6 -8.9 116 127 A K + 0 0 128 -2,-1.3 -81,-1.4 -81,-0.2 2,-0.3 -0.972 24.1 50.6-123.0 134.9 4.2 43.0 -9.0 117 128 A G - 0 0 54 -2,-0.4 2,-0.3 -83,-0.3 -83,-0.3 -0.957 62.4 -94.9 148.5-165.6 7.5 43.8 -7.4 118 129 A E + 0 0 179 -2,-0.3 2,-0.3 -85,-0.1 -85,-0.1 -0.942 33.0 163.2-157.1 138.0 11.0 43.2 -6.8 119 130 A L - 0 0 90 -2,-0.3 2,-0.4 -84,-0.1 -85,-0.1 -0.930 24.2-140.6-159.4 140.1 12.7 41.4 -4.0 120 131 A K 0 0 192 -2,-0.3 -2,-0.0 1,-0.0 -71,-0.0 -0.873 360.0 360.0-107.4 140.4 16.2 40.0 -3.6 121 133 A d 0 0 115 -2,-0.4 -75,-0.1 -72,-0.0 -1,-0.0 -0.299 360.0 360.0 -58.3 360.0 17.0 36.6 -1.9