==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE INHIBITOR 15-DEC-10 3Q02 . COMPND 2 MOLECULE: PLASMINOGEN ACTIVATOR INHIBITOR 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.K JENSEN,J.P.MORTH . 720 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29363.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 515 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 148 20.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 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-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 . 67 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 172 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.0 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 2 0 0 3 1 3 2 0 3 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 0 0 0 2 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 2 0 0 6 4 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 0 0 0 2 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 6 A S > 0 0 115 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -97.1 48.8 12.8 -2.1 2 7 A Y H > + 0 0 156 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.910 360.0 36.7 -54.4 -52.3 52.5 12.0 -2.7 3 8 A V H > S+ 0 0 12 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.827 112.8 60.0 -74.3 -28.7 53.3 15.0 -4.8 4 9 A A H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 346,-0.3 0.894 108.5 45.3 -62.3 -40.1 50.9 17.2 -2.9 5 10 A H H X S+ 0 0 69 -4,-2.5 4,-3.6 2,-0.2 5,-0.3 0.928 112.7 49.0 -68.4 -49.0 53.0 16.5 0.3 6 11 A L H X S+ 0 0 23 -4,-2.0 4,-2.6 -5,-0.2 5,-0.2 0.950 114.4 46.6 -53.4 -50.4 56.4 17.1 -1.5 7 12 A A H X S+ 0 0 1 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.939 117.3 43.0 -58.7 -49.7 55.1 20.4 -2.9 8 13 A S H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.921 112.7 50.6 -64.1 -48.8 53.7 21.5 0.4 9 14 A D H X S+ 0 0 41 -4,-3.6 4,-2.1 2,-0.2 -1,-0.2 0.943 113.4 48.0 -54.8 -46.6 56.6 20.4 2.5 10 15 A F H X S+ 0 0 0 -4,-2.6 4,-1.5 -5,-0.3 -2,-0.2 0.942 113.2 46.5 -58.5 -51.7 58.9 22.3 0.1 11 16 A G H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.822 109.0 54.8 -61.9 -34.9 56.7 25.4 0.1 12 17 A V H X S+ 0 0 1 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.895 105.8 53.2 -68.0 -37.3 56.4 25.4 3.9 13 18 A R H X S+ 0 0 70 -4,-2.1 4,-1.4 -5,-0.2 -2,-0.2 0.874 109.7 48.3 -62.3 -35.7 60.2 25.4 4.1 14 19 A V H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 3,-0.3 0.925 108.0 54.8 -70.3 -43.3 60.3 28.4 1.8 15 20 A F H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.925 104.7 55.2 -52.7 -43.9 57.7 30.1 4.0 16 21 A Q H X S+ 0 0 24 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.851 105.8 49.7 -61.2 -38.9 60.0 29.5 7.0 17 22 A Q H < S+ 0 0 45 -4,-1.4 4,-0.3 -3,-0.3 -1,-0.2 0.912 112.5 48.7 -62.8 -43.4 62.9 31.3 5.5 18 23 A V H >X S+ 0 0 8 -4,-2.1 4,-1.2 1,-0.2 3,-1.0 0.932 114.0 46.6 -60.9 -45.3 60.6 34.2 4.6 19 24 A A H 3< S+ 0 0 4 -4,-2.9 3,-0.3 1,-0.2 -2,-0.2 0.883 107.3 54.9 -65.8 -41.9 59.3 34.2 8.2 20 25 A Q T 3< S+ 0 0 92 -4,-2.6 -1,-0.2 1,-0.2 3,-0.2 0.497 112.0 47.3 -70.9 -2.0 62.7 34.0 9.9 21 26 A A T <4 S+ 0 0 74 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.2 0.621 117.0 37.4-113.3 -23.2 63.7 37.1 7.9 22 27 A S S >< S+ 0 0 30 -4,-1.2 3,-2.2 -3,-0.3 -1,-0.1 -0.454 77.6 165.2-116.8 55.0 60.7 39.4 8.5 23 28 A K T 3 S+ 0 0 109 1,-0.3 -1,-0.1 -3,-0.2 220,-0.1 0.709 72.4 31.8 -54.0 -27.9 60.4 38.1 12.0 24 29 A D T 3 S+ 0 0 87 -3,-0.1 2,-0.3 2,-0.1 -1,-0.3 -0.058 102.9 89.2-121.2 34.4 58.1 40.9 13.2 25 30 A R S < S- 0 0 159 -3,-2.2 330,-0.1 -6,-0.2 -3,-0.1 -0.964 79.7 -94.5-135.1 150.2 56.1 41.7 10.1 26 31 A N - 0 0 63 -2,-0.3 2,-0.4 332,-0.2 330,-0.2 -0.325 45.6-178.3 -58.8 134.0 52.8 40.6 8.4 27 32 A V E -A 355 0A 3 328,-2.1 328,-1.9 250,-0.1 2,-0.4 -0.994 20.1-177.3-140.2 131.2 53.2 37.9 5.8 28 33 A V E +A 354 0A 1 -2,-0.4 2,-0.3 326,-0.2 291,-0.3 -0.997 23.0 163.9-120.6 137.4 50.9 36.0 3.4 29 34 A F E -A 353 0A 0 324,-2.8 324,-2.3 -2,-0.4 -2,-0.0 -0.887 34.5-131.2-145.1 165.4 52.5 33.3 1.3 30 35 A S > - 0 0 0 -2,-0.3 4,-2.3 322,-0.2 5,-0.3 -0.822 13.3-176.5-130.0 95.4 51.6 30.3 -0.9 31 36 A P H > S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.907 91.4 49.7 -50.5 -46.8 53.6 27.1 -0.3 32 37 A Y H > S+ 0 0 9 318,-1.4 4,-2.1 1,-0.2 319,-0.1 0.902 108.9 52.1 -62.2 -42.9 51.8 25.5 -3.1 33 38 A G H > S+ 0 0 2 318,-0.4 4,-1.8 1,-0.2 5,-0.2 0.894 108.9 48.2 -62.2 -44.0 52.4 28.4 -5.5 34 39 A V H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.833 112.0 50.5 -69.2 -28.9 56.2 28.5 -5.0 35 40 A A H X S+ 0 0 2 -4,-1.7 4,-1.4 -5,-0.3 -2,-0.2 0.901 108.7 53.7 -72.0 -37.1 56.4 24.7 -5.5 36 41 A S H X S+ 0 0 15 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.911 112.0 40.9 -62.9 -44.2 54.4 25.0 -8.7 37 42 A V H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.747 113.6 52.8 -81.7 -24.1 56.7 27.6 -10.4 38 43 A L H X S+ 0 0 1 -4,-1.3 4,-1.0 2,-0.2 -1,-0.2 0.713 106.8 53.9 -80.6 -20.4 59.9 26.0 -9.2 39 44 A A H X S+ 0 0 0 -4,-1.4 4,-0.7 2,-0.2 3,-0.3 0.900 109.3 48.2 -75.9 -42.4 58.6 22.7 -10.7 40 45 A M H >X S+ 0 0 10 -4,-1.8 3,-1.9 1,-0.2 4,-0.6 0.961 107.6 56.1 -53.5 -52.2 58.1 24.6 -14.0 41 46 A L H >X S+ 0 0 2 -4,-2.1 3,-1.3 1,-0.3 4,-0.8 0.818 93.9 69.0 -51.6 -33.5 61.6 26.0 -13.6 42 47 A Q H >< S+ 0 0 0 -4,-1.0 3,-0.5 1,-0.3 -1,-0.3 0.822 93.1 58.8 -56.6 -32.8 63.0 22.5 -13.3 43 48 A L H << S+ 0 0 9 -3,-1.9 -1,-0.3 -4,-0.7 -2,-0.2 0.805 106.9 46.3 -67.7 -29.2 62.2 22.0 -17.0 44 49 A T H << S+ 0 0 0 -3,-1.3 259,-1.3 -4,-0.6 260,-1.2 0.589 101.9 79.5 -90.4 -10.4 64.4 24.9 -18.1 45 50 A T << - 0 0 0 -4,-0.8 256,-0.3 -3,-0.5 2,-0.3 -0.481 50.9-177.7-103.6 165.3 67.5 24.1 -16.0 46 51 A G >> + 0 0 6 254,-2.1 4,-2.1 -2,-0.1 3,-0.8 -0.874 46.6 7.2-145.3 179.6 70.4 21.7 -16.3 47 52 A G H 3> S- 0 0 40 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 -0.014 123.3 -11.6 47.1-137.7 73.5 20.5 -14.5 48 53 A E H 3> S+ 0 0 111 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.796 134.5 58.9 -67.7 -31.4 74.1 21.8 -11.0 49 54 A T H <> S+ 0 0 1 -3,-0.8 4,-1.9 1,-0.2 -1,-0.2 0.951 110.5 43.8 -61.5 -47.2 71.4 24.5 -11.2 50 55 A Q H X S+ 0 0 45 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.880 111.3 54.1 -62.1 -40.8 68.9 21.7 -11.9 51 56 A Q H X S+ 0 0 95 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.855 106.2 53.1 -66.5 -33.5 70.4 19.5 -9.2 52 57 A Q H X S+ 0 0 31 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.954 110.4 46.0 -64.7 -49.8 70.0 22.3 -6.6 53 58 A I H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.902 115.3 48.0 -56.8 -43.1 66.3 22.7 -7.4 54 59 A Q H X S+ 0 0 22 -4,-2.3 4,-1.7 1,-0.2 5,-0.3 0.870 107.8 52.8 -71.2 -36.8 65.8 18.9 -7.3 55 60 A A H < S+ 0 0 89 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.812 114.1 44.8 -66.2 -29.1 67.6 18.3 -4.0 56 61 A A H < S+ 0 0 8 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.809 116.3 42.8 -86.0 -32.8 65.4 21.0 -2.3 57 62 A M H < S- 0 0 1 -4,-1.8 -47,-0.2 -5,-0.2 -2,-0.2 0.690 99.1-130.7 -88.0 -23.3 62.0 20.0 -3.7 58 63 A G S < S+ 0 0 48 -4,-1.7 2,-0.3 -5,-0.2 -3,-0.1 0.413 74.9 63.5 88.9 -2.2 62.5 16.2 -3.3 59 64 A F S S- 0 0 13 -5,-0.3 2,-0.5 -53,-0.1 -2,-0.2 -0.991 73.4-122.3-150.0 160.1 61.4 15.2 -6.8 60 65 A K > - 0 0 102 -2,-0.3 3,-1.5 1,-0.1 6,-0.1 -0.889 19.3-143.5-106.4 131.1 62.4 15.5 -10.4 61 66 A I T 3 S+ 0 0 1 -2,-0.5 6,-0.7 1,-0.3 -1,-0.1 0.751 95.5 55.2 -69.0 -24.3 59.7 17.0 -12.7 62 67 A D T 3 S+ 0 0 91 4,-0.1 -1,-0.3 5,-0.1 3,-0.1 0.395 80.4 111.8 -93.7 1.9 60.5 14.8 -15.7 63 68 A D S X> S- 0 0 74 -3,-1.5 3,-0.8 1,-0.1 4,-0.7 -0.399 85.7 -84.5 -68.8 154.0 60.1 11.5 -13.9 64 69 A K T 34 S+ 0 0 205 1,-0.2 2,-0.2 2,-0.1 -1,-0.1 -0.351 113.3 10.0 -65.9 139.0 57.0 9.5 -14.9 65 70 A G T 3> S+ 0 0 37 -3,-0.1 4,-2.9 1,-0.1 -1,-0.2 -0.072 102.2 101.0 86.0 -34.9 53.9 10.5 -13.1 66 71 A M H <> S+ 0 0 28 -3,-0.8 4,-2.0 1,-0.2 -2,-0.1 0.939 86.6 35.0 -49.5 -63.4 55.5 13.6 -11.7 67 72 A A H X S+ 0 0 5 -6,-0.7 4,-2.0 -4,-0.7 -1,-0.2 0.904 118.0 50.2 -63.0 -46.3 54.0 16.1 -14.1 68 73 A P H > S+ 0 0 47 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.900 108.1 56.7 -58.9 -38.6 50.6 14.5 -14.6 69 74 A A H X S+ 0 0 34 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.972 106.2 49.3 -51.5 -56.4 50.3 14.3 -10.9 70 75 A L H X S+ 0 0 16 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.848 110.6 50.0 -55.1 -38.1 50.8 18.1 -10.6 71 76 A R H X S+ 0 0 51 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.908 110.2 48.9 -67.4 -42.1 48.2 18.8 -13.3 72 77 A H H X S+ 0 0 100 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.905 111.2 52.4 -65.1 -37.3 45.6 16.5 -11.6 73 78 A L H X S+ 0 0 7 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.935 107.1 51.5 -58.5 -48.3 46.5 18.4 -8.4 74 79 A Y H X S+ 0 0 95 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.905 111.8 46.7 -59.2 -41.9 45.9 21.7 -10.1 75 80 A K H < S+ 0 0 152 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.780 108.3 55.8 -71.9 -26.9 42.5 20.6 -11.3 76 81 A E H < S+ 0 0 109 -4,-1.7 3,-0.4 -5,-0.2 -1,-0.2 0.890 118.2 34.3 -69.7 -36.7 41.6 19.2 -7.9 77 82 A L H < S+ 0 0 5 -4,-2.0 2,-2.0 1,-0.2 -2,-0.2 0.970 117.5 47.4 -81.1 -62.7 42.3 22.7 -6.4 78 83 A M S < S+ 0 0 29 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.1 -0.323 77.7 143.6 -80.6 55.0 41.2 25.2 -9.0 79 84 A G > > - 0 0 9 -2,-2.0 3,-3.7 -3,-0.4 5,-0.5 -0.853 44.4-159.3-100.4 104.4 37.9 23.4 -9.6 80 85 A P G > 5S+ 0 0 110 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.567 90.4 84.3 -54.4 -5.5 35.0 25.9 -10.3 81 86 A W G 3 5S+ 0 0 249 1,-0.2 -3,-0.1 2,-0.1 -2,-0.0 0.871 88.4 48.1 -57.5 -40.6 33.2 22.7 -9.3 82 87 A N G < 5S- 0 0 38 -3,-3.7 -1,-0.2 -5,-0.1 3,-0.1 0.478 113.0-122.5 -79.1 -3.0 33.9 24.0 -5.7 83 88 A K T < 5 - 0 0 168 -3,-0.8 2,-0.3 -4,-0.3 -2,-0.1 0.928 53.4-176.8 55.3 45.7 32.6 27.5 -6.7 84 89 A D < - 0 0 25 -5,-0.5 2,-0.8 -7,-0.1 -1,-0.2 -0.563 37.2-148.6 -89.3 135.6 36.0 28.5 -5.5 85 90 A E + 0 0 75 -2,-0.3 82,-2.1 -3,-0.1 2,-0.5 -0.496 55.6 125.1 -95.6 60.0 37.4 32.0 -5.3 86 91 A I E -I 166 0B 10 -2,-0.8 2,-0.4 80,-0.2 80,-0.2 -0.989 35.8-175.3-111.1 127.7 41.0 31.1 -6.0 87 92 A S E +I 165 0B 15 78,-2.4 78,-2.1 -2,-0.5 2,-0.3 -0.990 11.5 177.3-121.8 135.2 42.7 33.0 -8.8 88 93 A T E -I 164 0B 19 -2,-0.4 2,-0.3 76,-0.2 76,-0.2 -0.977 15.6-176.3-142.9 144.0 46.2 31.9 -9.8 89 94 A T E -I 163 0B 10 74,-2.1 74,-2.2 -2,-0.3 2,-0.3 -0.980 2.3-177.3-143.9 133.3 48.9 32.7 -12.3 90 95 A D E +I 162 0B 26 -2,-0.3 2,-0.3 72,-0.2 72,-0.2 -0.945 18.3 166.1-118.8 147.5 52.4 31.2 -13.0 91 96 A A E -I 161 0B 4 70,-1.8 70,-2.8 -2,-0.3 2,-0.5 -0.881 27.2-160.7-168.8 129.8 54.6 32.7 -15.7 92 97 A I E -I 160 0B 4 23,-0.3 25,-2.4 -2,-0.3 2,-0.4 -0.967 16.7-164.6-108.3 125.8 58.2 32.6 -16.9 93 98 A F E -Ij 159 117B 3 66,-3.1 66,-2.8 -2,-0.5 2,-0.3 -0.954 8.0-175.1-111.6 132.7 59.3 35.6 -19.2 94 99 A V E -Ij 158 118B 0 23,-2.5 25,-1.9 -2,-0.4 64,-0.2 -0.940 37.1 -88.0-127.3 146.8 62.4 35.3 -21.3 95 100 A Q E > - j 0 119B 17 62,-2.2 3,-0.8 -2,-0.3 25,-0.2 -0.244 42.8-127.7 -52.4 137.7 64.3 37.9 -23.5 96 101 A R T 3 S+ 0 0 123 23,-2.0 24,-0.1 1,-0.2 -1,-0.1 0.732 93.5 52.0 -69.6 -34.1 62.9 37.6 -27.0 97 102 A D T 3 S+ 0 0 114 22,-0.2 2,-0.5 2,-0.1 -1,-0.2 -0.058 78.6 111.2-102.1 34.1 65.8 37.1 -29.4 98 103 A L S < S- 0 0 11 -3,-0.8 2,-0.5 -4,-0.1 -4,-0.0 -0.916 74.9-116.0-103.0 132.1 67.4 34.2 -27.7 99 104 A K - 0 0 115 -2,-0.5 208,-0.4 1,-0.0 209,-0.3 -0.534 31.5-145.8 -70.4 116.5 67.3 30.9 -29.6 100 105 A L - 0 0 22 -2,-0.5 205,-0.2 205,-0.1 204,-0.1 -0.522 30.2 -90.1 -82.6 149.4 65.2 28.5 -27.5 101 106 A V > - 0 0 36 203,-2.0 3,-2.1 -2,-0.2 4,-0.5 -0.368 49.4-108.1 -57.6 130.3 66.1 24.9 -27.5 102 107 A Q T 3 S+ 0 0 167 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 -0.438 105.2 21.5 -62.4 129.1 64.1 23.2 -30.3 103 108 A G T 3> S+ 0 0 33 -2,-0.2 4,-0.9 -3,-0.1 -1,-0.3 0.274 93.3 105.1 96.8 -11.5 61.4 21.1 -28.7 104 109 A F H <> S+ 0 0 11 -3,-2.1 4,-3.2 2,-0.2 3,-0.5 0.964 77.3 49.5 -65.8 -53.9 61.3 22.9 -25.4 105 110 A M H > S+ 0 0 47 -4,-0.5 4,-2.6 1,-0.3 5,-0.2 0.907 110.9 47.5 -54.5 -50.7 58.1 24.9 -25.9 106 111 A P H > S+ 0 0 86 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.825 116.2 47.3 -61.4 -26.2 56.0 21.9 -27.1 107 112 A H H X S+ 0 0 49 -4,-0.9 4,-2.3 -3,-0.5 -2,-0.2 0.946 111.0 48.0 -81.4 -49.4 57.3 19.9 -24.1 108 113 A F H X S+ 0 0 2 -4,-3.2 4,-2.5 1,-0.2 6,-0.4 0.903 113.9 50.1 -51.4 -45.7 56.7 22.6 -21.5 109 114 A F H X S+ 0 0 103 -4,-2.6 4,-1.7 -5,-0.3 -1,-0.2 0.856 108.0 51.1 -67.7 -36.6 53.2 23.1 -22.8 110 115 A R H < S+ 0 0 147 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.921 116.8 41.1 -65.2 -40.6 52.4 19.3 -22.7 111 116 A L H < S+ 0 0 13 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.889 134.2 16.1 -74.3 -40.4 53.5 19.1 -19.1 112 117 A F H < S- 0 0 29 -4,-2.5 -3,-0.2 2,-0.3 -2,-0.2 0.507 89.0-129.7-116.3 -9.0 52.1 22.3 -17.7 113 118 A R S < S+ 0 0 135 -4,-1.7 2,-0.3 -5,-0.4 -4,-0.2 0.817 80.9 83.9 57.2 31.7 49.6 23.4 -20.3 114 119 A S - 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