==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-JUL-98 1BK9 . COMPND 2 MOLECULE: PHOSPHOLIPASE A2; . SOURCE 2 ORGANISM_SCIENTIFIC: GLOYDIUS HALYS; . AUTHOR H.ZHAO,L.TANG,X.WANG,Z.LIN,Y.ZHOU . 124 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7294.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 76 61.3 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 . 10 8.1 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 . 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 . 5 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 37.1 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 2 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 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 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 9 0, 0.0 4,-2.0 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 166.6 10.9 57.6 -8.1 2 2 A L H 3> + 0 0 63 58,-2.0 4,-2.5 1,-0.3 5,-0.2 0.846 360.0 57.8 -62.3 -31.5 12.8 59.9 -5.8 3 3 A I H 3> S+ 0 0 124 57,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.886 107.5 49.2 -63.2 -38.6 9.6 61.1 -4.2 4 4 A Q H <> S+ 0 0 29 -3,-0.6 4,-2.7 2,-0.2 -2,-0.2 0.917 107.0 54.6 -71.4 -36.1 8.9 57.4 -3.3 5 5 A F H X S+ 0 0 31 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.938 108.4 49.0 -62.5 -44.7 12.4 57.0 -1.8 6 6 A E H X S+ 0 0 42 -4,-2.5 4,-2.3 1,-0.2 11,-0.3 0.924 110.9 52.1 -55.5 -40.9 11.7 60.0 0.5 7 7 A T H X S+ 0 0 45 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.920 108.5 48.7 -63.8 -47.1 8.4 58.4 1.4 8 8 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.4 0.881 109.3 53.0 -62.7 -35.1 10.1 55.0 2.3 9 9 A I H X>S+ 0 0 3 -4,-2.2 4,-2.1 2,-0.2 6,-0.8 0.946 111.3 47.2 -66.7 -42.5 12.7 56.9 4.5 10 10 A M H X5S+ 0 0 96 -4,-2.3 4,-0.7 4,-0.2 -2,-0.2 0.918 115.6 45.2 -63.7 -42.9 9.8 58.6 6.4 11 11 A K H <5S+ 0 0 84 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.935 126.7 26.2 -67.0 -44.6 8.0 55.4 6.8 12 12 A V H <5S+ 0 0 21 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.918 133.3 27.8 -88.9 -51.6 10.9 53.2 7.9 13 13 A A H <5S- 0 0 2 -4,-2.1 -3,-0.2 -5,-0.4 -2,-0.1 0.491 93.3-132.0 -91.1 -6.3 13.5 55.5 9.5 14 14 A K S < - 0 0 27 -2,-0.3 4,-2.4 1,-0.2 5,-0.3 -0.763 18.0-150.3 -85.2 137.1 13.1 63.0 6.1 17 18 A G H > S+ 0 0 6 -2,-0.4 4,-2.5 -11,-0.3 5,-0.2 0.906 97.2 50.9 -68.6 -41.4 15.6 62.1 3.4 18 19 A M H 4 S+ 0 0 122 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.884 115.8 41.2 -71.6 -34.1 16.0 65.6 2.2 19 20 A F H 4 S+ 0 0 157 2,-0.1 -1,-0.2 1,-0.1 -2,-0.2 0.847 130.9 21.8 -83.9 -31.9 16.6 67.0 5.7 20 21 A W H < S+ 0 0 91 -4,-2.4 -3,-0.2 1,-0.1 -2,-0.2 0.709 129.0 31.4-109.6 -15.9 18.9 64.2 7.0 21 22 A Y S < S+ 0 0 14 -4,-2.5 3,-0.2 -5,-0.3 -3,-0.2 0.135 87.2 90.9-132.4 18.3 20.5 62.3 4.0 22 23 A S S S+ 0 0 41 -4,-0.4 8,-0.4 -5,-0.2 -4,-0.1 0.650 105.7 12.7 -96.4 -12.5 21.0 64.8 1.1 23 24 A N S S+ 0 0 74 6,-0.2 87,-2.9 -4,-0.1 2,-0.5 -0.265 88.0 132.3-155.7 54.1 24.5 66.0 1.9 24 25 A Y B > S-AB 28 109A 0 4,-2.2 4,-2.1 85,-0.2 3,-0.4 -0.950 70.6 -36.6-113.3 124.9 26.0 63.7 4.6 25 26 A G T 4 S- 0 0 9 83,-2.9 86,-0.3 -2,-0.5 87,-0.3 -0.134 102.8 -44.1 64.2-155.3 29.5 62.3 4.1 26 27 A a T 4 S+ 0 0 13 9,-0.3 7,-0.6 1,-0.1 -1,-0.2 0.755 136.1 25.1 -80.1 -26.6 30.9 61.3 0.7 27 28 A Y T 4 S+ 0 0 13 -3,-0.4 2,-1.8 5,-0.2 -2,-0.2 0.643 85.9 96.3-121.5 -21.3 27.8 59.5 -0.6 28 29 A b B < S+A 24 0A 3 -4,-2.1 -4,-2.2 -8,-0.1 2,-0.3 -0.625 89.0 43.2 -80.7 88.2 24.5 60.7 1.0 29 30 A G S S- 0 0 30 -2,-1.8 2,-0.2 -6,-0.2 -6,-0.2 -0.912 114.0 -36.1 161.7-174.5 23.7 63.1 -1.7 30 31 A W S S- 0 0 201 -8,-0.4 -2,-0.0 -2,-0.3 18,-0.0 -0.544 109.8 -24.0 -73.9 136.0 23.8 63.0 -5.5 31 32 A G S S- 0 0 36 -2,-0.2 2,-0.2 1,-0.1 -2,-0.2 -0.146 76.1-163.6 62.6-155.6 26.7 61.0 -6.9 32 33 A G - 0 0 39 -4,-0.1 2,-0.3 16,-0.0 -5,-0.2 -0.727 16.5-158.4 153.9 161.8 29.8 60.7 -4.7 33 34 A Q + 0 0 81 -7,-0.6 85,-0.2 -2,-0.2 2,-0.1 -0.914 52.8 38.2-151.5 171.8 33.5 59.8 -4.5 34 35 A G S S- 0 0 0 83,-0.5 88,-1.3 -2,-0.3 82,-0.1 -0.355 96.4 -28.9 82.0-163.1 35.9 58.7 -1.8 35 36 A R - 0 0 143 80,-0.3 -9,-0.3 86,-0.2 2,-0.3 -0.715 62.5-106.6 -89.9 142.0 35.4 56.3 1.0 36 37 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.570 36.6-151.5 -57.3 125.3 32.0 55.7 2.7 37 38 A Q - 0 0 52 -2,-0.3 2,-0.3 1,-0.1 -12,-0.1 0.754 60.8 -14.2 -80.7 -27.8 32.8 57.6 6.0 38 39 A D S > S- 0 0 28 1,-0.1 4,-2.2 70,-0.0 5,-0.2 -0.876 87.8 -70.9-158.0-170.1 30.6 55.7 8.4 39 40 A A H > S+ 0 0 33 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.937 128.0 47.6 -66.6 -47.0 27.6 53.3 8.5 40 41 A T H > S+ 0 0 0 59,-0.3 4,-1.6 1,-0.2 3,-0.2 0.938 113.3 50.0 -57.1 -47.3 24.9 55.8 7.2 41 42 A D H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.853 108.0 52.3 -61.2 -37.0 27.3 56.9 4.4 42 43 A R H X S+ 0 0 99 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.901 103.8 57.8 -67.3 -35.8 27.9 53.2 3.4 43 44 A c H X S+ 0 0 4 -4,-2.0 4,-1.9 -3,-0.2 -2,-0.2 0.896 109.7 45.5 -58.3 -39.8 24.1 52.8 3.2 44 45 A b H X S+ 0 0 10 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.871 110.1 53.4 -70.7 -37.2 24.1 55.6 0.6 45 46 A F H X S+ 0 0 11 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.925 110.3 46.5 -60.0 -46.1 27.0 54.1 -1.2 46 47 A V H X S+ 0 0 85 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.925 110.4 53.9 -66.6 -38.2 25.3 50.8 -1.6 47 48 A H H X S+ 0 0 13 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.867 109.0 49.2 -61.6 -41.4 22.1 52.6 -2.7 48 49 A D H X S+ 0 0 50 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.905 112.4 47.3 -60.3 -44.4 24.2 54.4 -5.5 49 50 A d H X S+ 0 0 23 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.918 110.7 52.1 -65.1 -43.1 25.6 51.1 -6.6 50 51 A e H >< S+ 0 0 45 -4,-2.9 3,-0.9 1,-0.2 4,-0.4 0.954 112.0 46.0 -59.5 -46.6 22.1 49.4 -6.6 51 52 A Y H >< S+ 0 0 36 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.908 107.3 58.5 -61.3 -40.5 20.7 52.2 -8.8 52 53 A G H 3< S+ 0 0 66 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.735 104.0 52.8 -62.1 -26.2 23.8 52.0 -11.0 53 54 A K T << S+ 0 0 168 -4,-1.1 2,-0.6 -3,-0.9 -1,-0.3 0.440 80.7 109.4 -88.2 -6.2 22.9 48.3 -11.7 54 55 A V < - 0 0 18 -3,-1.8 2,-0.4 -4,-0.4 3,-0.1 -0.659 46.6-178.3 -77.8 120.9 19.3 49.0 -12.8 55 56 A T + 0 0 120 -2,-0.6 3,-0.1 1,-0.1 -2,-0.0 -0.972 59.9 29.9-116.1 125.2 19.1 48.4 -16.6 56 59 A G S S+ 0 0 78 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.330 113.1 37.8 114.8 -10.1 15.8 49.0 -18.4 57 61 A f S S- 0 0 27 24,-0.1 -1,-0.2 -3,-0.1 -3,-0.0 -0.941 81.6 -97.6-165.0 177.6 14.1 51.8 -16.4 58 67 A D > - 0 0 53 -2,-0.3 4,-2.2 1,-0.1 -3,-0.1 -0.925 12.5-159.1-121.7 116.5 14.9 55.0 -14.5 59 68 A P T 4 S+ 0 0 20 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.712 93.4 49.9 -64.2 -25.7 15.3 55.1 -10.7 60 69 A K T 4 S+ 0 0 104 -59,-0.2 -58,-2.0 -58,-0.1 -57,-0.3 0.936 125.2 20.0 -74.3 -52.0 14.7 58.9 -10.6 61 70 A M T 4 S+ 0 0 126 -60,-0.2 -58,-0.1 -59,-0.1 -1,-0.1 0.845 96.5 95.2 -91.8 -41.6 11.5 59.1 -12.6 62 71 A D < - 0 0 47 -4,-2.2 2,-0.5 1,-0.1 -5,-0.0 -0.266 64.0-135.4 -67.8 145.8 9.8 55.7 -12.7 63 72 A V - 0 0 95 -62,-0.1 2,-0.2 -59,-0.0 -1,-0.1 -0.835 20.0-165.8-101.6 126.7 7.1 54.9 -10.2 64 73 A Y - 0 0 9 -2,-0.5 2,-0.3 -63,-0.1 13,-0.1 -0.635 15.7-122.2-106.7 172.8 7.1 51.5 -8.5 65 74 A S E +C 76 0B 65 11,-0.6 11,-2.7 -2,-0.2 2,-0.3 -0.876 32.9 161.8-115.6 150.2 4.4 49.8 -6.4 66 75 A F E -C 75 0B 46 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.977 17.8-158.5-156.4 161.4 4.6 48.5 -2.8 67 76 A S E -C 74 0B 56 7,-1.9 7,-2.9 -2,-0.3 2,-0.5 -0.936 24.6-118.5-138.4 161.1 2.3 47.5 0.0 68 77 A E E +C 73 0B 116 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.920 48.6 151.9-101.6 128.8 2.8 47.3 3.8 69 78 A E E > +C 72 0B 103 3,-2.3 3,-2.3 -2,-0.5 -2,-0.1 -0.982 55.9 3.9-157.7 145.9 2.4 43.7 5.0 70 79 A N T 3 S- 0 0 154 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.712 128.2 -57.3 47.2 29.7 3.6 41.5 7.9 71 80 A G T 3 S+ 0 0 89 1,-0.3 -1,-0.3 0, 0.0 2,-0.3 0.694 120.1 92.7 77.0 24.6 5.5 44.5 9.4 72 81 A D E < S-C 69 0B 69 -3,-2.3 -3,-2.3 2,-0.0 2,-0.5 -0.880 80.2-107.3-143.6 163.7 7.5 45.1 6.2 73 82 A I E -C 68 0B 11 -2,-0.3 2,-0.6 -5,-0.2 -5,-0.2 -0.869 35.4-160.5 -89.1 125.0 7.6 47.1 2.9 74 83 A V E -C 67 0B 55 -7,-2.9 -7,-1.9 -2,-0.5 2,-0.3 -0.943 7.8-144.5-112.7 114.6 6.8 44.6 0.1 75 84 A g E +C 66 0B 7 -2,-0.6 -9,-0.3 -9,-0.2 2,-0.1 -0.589 36.7 151.1 -74.8 135.9 7.9 45.8 -3.4 76 85 A G E +C 65 0B 24 -11,-2.7 -11,-0.6 -2,-0.3 3,-0.2 -0.451 9.5 113.7-140.2-149.7 5.5 44.6 -6.1 77 86 A G S S- 0 0 60 -2,-0.1 -13,-0.0 1,-0.1 6,-0.0 -0.282 72.0 -82.8 98.5 174.7 3.9 45.4 -9.5 78 88 A D S S+ 0 0 164 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.0 0.285 100.0 88.5 -98.8 7.9 4.2 43.5 -12.8 79 89 A D > - 0 0 50 -3,-0.2 4,-2.3 1,-0.2 5,-0.2 -0.899 57.5-161.6-113.9 116.7 7.5 45.1 -13.9 80 90 A P H > S+ 0 0 102 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.897 93.0 51.9 -60.7 -42.8 10.8 43.4 -12.8 81 91 A f H > S+ 0 0 15 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.954 110.8 45.9 -65.3 -44.7 12.8 46.5 -13.5 82 92 A K H > S+ 0 0 66 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.871 110.0 54.6 -65.1 -37.7 10.6 48.8 -11.4 83 93 A K H X S+ 0 0 80 -4,-2.3 4,-2.6 2,-0.2 -1,-0.3 0.893 103.6 56.8 -62.1 -39.1 10.6 46.3 -8.6 84 94 A E H X S+ 0 0 83 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.927 106.7 49.6 -55.0 -44.4 14.5 46.4 -8.7 85 95 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.935 110.1 50.3 -61.4 -43.5 14.3 50.1 -8.0 86 96 A g H X S+ 0 0 0 -4,-1.9 4,-3.0 1,-0.2 5,-0.2 0.942 107.8 53.2 -62.0 -44.4 11.9 49.6 -5.1 87 97 A E H X S+ 0 0 62 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.929 107.8 50.9 -59.0 -39.8 14.2 47.0 -3.6 88 98 A e H X S+ 0 0 5 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.946 114.4 43.9 -61.4 -47.4 17.2 49.5 -3.8 89 99 A D H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.903 113.6 49.9 -65.9 -41.2 15.1 52.2 -2.0 90 100 A R H X S+ 0 0 52 -4,-3.0 4,-2.3 2,-0.2 5,-0.2 0.945 110.9 48.9 -63.8 -50.9 13.6 49.7 0.6 91 101 A A H X S+ 0 0 51 -4,-2.6 4,-2.7 -5,-0.2 -2,-0.2 0.922 112.7 47.9 -55.2 -45.2 17.1 48.3 1.5 92 102 A A H X S+ 0 0 4 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.936 109.8 53.0 -65.9 -39.5 18.5 51.8 1.9 93 103 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.918 113.1 43.5 -61.3 -39.5 15.5 53.0 4.1 94 104 A I H X S+ 0 0 34 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.928 111.1 55.0 -72.3 -40.7 16.1 50.0 6.5 95 105 A c H X S+ 0 0 37 -4,-2.7 4,-1.4 -5,-0.2 -2,-0.2 0.922 109.3 47.7 -59.3 -40.0 19.8 50.6 6.4 96 106 A F H >< S+ 0 0 2 -4,-2.6 3,-0.6 2,-0.2 4,-0.3 0.958 113.1 47.6 -64.8 -47.7 19.2 54.2 7.6 97 107 A R H >< S+ 0 0 106 -4,-2.3 3,-1.4 1,-0.3 4,-0.2 0.933 112.4 49.5 -56.1 -50.5 16.8 53.1 10.3 98 108 A D H 3< S+ 0 0 93 -4,-3.1 3,-0.3 1,-0.3 -1,-0.3 0.735 112.0 48.3 -68.2 -18.6 19.3 50.5 11.5 99 109 A N T XX S+ 0 0 35 -4,-1.4 3,-1.2 -3,-0.6 4,-0.6 0.207 73.3 108.2-109.1 19.7 22.2 52.9 11.6 100 110 A L G X4 + 0 0 57 -3,-1.4 3,-1.0 -4,-0.3 -1,-0.2 0.850 69.1 68.4 -61.4 -30.5 20.5 55.7 13.5 101 111 A T G 34 S+ 0 0 131 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.839 109.4 37.8 -53.7 -33.1 22.7 54.9 16.6 102 112 A L G <4 S+ 0 0 84 -3,-1.2 -1,-0.3 2,-0.0 -2,-0.2 0.482 83.3 127.6 -95.2 -14.6 25.7 56.1 14.6 103 113 A Y << + 0 0 41 -3,-1.0 2,-0.2 -4,-0.6 -3,-0.0 -0.277 27.1 169.3 -58.5 133.8 24.2 59.1 12.7 104 114 A N > + 0 0 64 1,-0.1 4,-2.7 2,-0.0 3,-0.3 -0.633 16.7 169.4-154.0 82.3 26.3 62.2 13.2 105 115 A D H > S+ 0 0 54 1,-0.2 4,-2.6 2,-0.2 -80,-0.1 0.783 77.7 67.7 -64.9 -24.2 25.6 65.2 11.1 106 116 A K H 4 S+ 0 0 184 2,-0.2 -1,-0.2 1,-0.2 -2,-0.0 0.938 113.2 30.9 -63.6 -44.4 27.8 67.4 13.2 107 117 A K H 4 S+ 0 0 119 -3,-0.3 -2,-0.2 1,-0.1 -1,-0.2 0.938 133.0 30.0 -77.8 -48.2 30.8 65.5 12.0 108 118 A Y H >< S+ 0 0 34 -4,-2.7 -83,-2.9 -84,-0.0 3,-0.9 0.545 79.6 112.2-100.3 -7.1 29.6 64.5 8.5 109 119 A W B 3< S+B 24 0A 97 -4,-2.6 -85,-0.2 1,-0.3 -88,-0.0 -0.481 98.9 0.2 -68.8 138.9 27.2 67.1 7.0 110 120 A A T 3 S+ 0 0 56 -87,-2.9 -1,-0.3 -2,-0.1 -86,-0.1 0.943 82.5 178.3 46.3 56.1 28.7 68.9 4.0 111 121 A F < - 0 0 34 -3,-0.9 4,-0.2 -86,-0.3 -2,-0.1 0.783 34.7-125.0 -60.9 -33.2 31.8 66.8 4.5 112 122 A G > - 0 0 43 -87,-0.3 3,-0.8 -4,-0.1 4,-0.3 0.440 9.0 -96.9 95.8 140.6 33.5 68.4 1.5 113 123 A A G > S+ 0 0 71 1,-0.2 3,-1.9 2,-0.2 -1,-0.1 0.780 115.0 60.6 -61.1 -36.4 35.1 67.1 -1.7 114 124 A K G 3 S+ 0 0 172 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 0.920 104.2 55.4 -57.9 -36.4 38.8 67.1 -0.6 115 125 A N G < S+ 0 0 89 -3,-0.8 -80,-0.3 1,-0.3 -1,-0.3 0.541 104.9 53.7 -73.8 -6.0 37.7 64.7 2.0 116 126 A a S < S- 0 0 5 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.1 -0.479 85.4-163.9-126.0 60.9 36.3 62.4 -0.6 117 127 A P > - 0 0 22 0, 0.0 3,-1.7 0, 0.0 -83,-0.5 -0.156 25.0-132.1 -55.0 132.5 39.3 61.9 -3.0 118 128 A Q G > S+ 0 0 126 1,-0.3 3,-1.3 2,-0.2 -84,-0.2 0.848 107.8 58.4 -50.2 -35.6 38.6 60.6 -6.4 119 129 A E G 3 S+ 0 0 147 1,-0.3 -1,-0.3 -86,-0.1 -3,-0.0 0.755 100.4 54.6 -73.6 -21.4 41.5 58.1 -5.8 120 130 A E G < S+ 0 0 77 -3,-1.7 2,-0.5 2,-0.1 -1,-0.3 0.298 74.1 137.7 -93.0 12.2 39.9 56.6 -2.6 121 131 A S < - 0 0 49 -3,-1.3 -86,-0.2 -4,-0.2 -3,-0.1 -0.425 50.9-139.5 -68.1 113.0 36.6 55.7 -4.4 122 132 A E - 0 0 73 -88,-1.3 -1,-0.1 -2,-0.5 2,-0.1 -0.530 21.6-121.9 -64.4 127.0 35.7 52.3 -3.3 123 133 A P 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -74,-0.0 -0.441 360.0 360.0 -70.5 154.3 34.3 50.2 -6.3 124 134 A d 0 0 140 -2,-0.1 -75,-0.0 -75,-0.1 -2,-0.0 0.906 360.0 360.0 -68.5 360.0 30.8 48.8 -6.1