==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 13-JUN-03 1PO7 . COMPND 2 MOLECULE: BENZOYLFORMATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR A.K.BERA,M.S.HASSON . 524 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21038.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 81 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.1 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 . 0 0.0 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 . 39 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 147 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.7 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 1 1 3 2 1 1 5 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 3 3 4 3 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 . 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 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 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 2 A A 0 0 104 0, 0.0 165,-2.9 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 150.8 49.0 35.2 146.4 2 3 A S B > -A 165 0A 38 163,-0.2 4,-2.7 1,-0.1 5,-0.3 -0.447 360.0-110.1 -85.4 166.4 51.2 38.1 147.1 3 4 A V H > S+ 0 0 0 161,-2.5 4,-2.4 158,-0.4 5,-0.2 0.903 121.0 55.6 -58.4 -39.3 54.8 38.4 146.3 4 5 A H H > S+ 0 0 18 158,-2.5 4,-2.5 160,-0.3 5,-0.3 0.963 110.2 43.1 -57.4 -53.1 55.4 38.2 150.1 5 6 A G H > S+ 0 0 33 157,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.928 115.7 48.0 -65.0 -38.5 53.5 34.9 150.5 6 7 A T H X S+ 0 0 11 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.882 111.8 50.5 -67.2 -38.0 55.0 33.3 147.4 7 8 A T H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.941 110.7 46.7 -68.0 -43.8 58.5 34.3 148.5 8 9 A Y H X S+ 0 0 3 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.886 111.7 52.8 -66.3 -34.8 58.2 32.9 152.0 9 10 A E H X S+ 0 0 54 -4,-2.1 4,-2.7 -5,-0.3 -2,-0.2 0.935 109.6 49.0 -62.6 -44.8 56.7 29.7 150.5 10 11 A L H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.947 111.6 49.1 -58.0 -47.5 59.7 29.4 148.1 11 12 A L H <>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 3,-0.4 0.954 113.5 45.5 -57.6 -49.8 62.1 29.9 151.0 12 13 A R H ><5S+ 0 0 79 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.908 112.2 51.4 -59.1 -44.5 60.4 27.3 153.2 13 14 A R H 3<5S+ 0 0 102 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.788 109.3 51.7 -66.6 -26.0 60.2 24.8 150.3 14 15 A Q T 3<5S- 0 0 43 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.247 126.1-100.1 -94.0 10.4 63.9 25.3 149.7 15 16 A G T < 5S+ 0 0 45 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.565 76.5 136.5 87.6 10.4 64.8 24.6 153.3 16 17 A I < + 0 0 8 -5,-2.8 -1,-0.3 -6,-0.2 -2,-0.1 -0.780 8.0 149.8 -92.3 130.3 65.2 28.2 154.7 17 18 A D + 0 0 64 -2,-0.4 22,-1.9 1,-0.1 2,-0.4 0.276 53.0 68.8-138.9 8.2 63.6 28.9 158.0 18 19 A T E -b 39 0B 4 20,-0.2 47,-0.6 2,-0.0 2,-0.5 -0.996 55.2-160.2-136.1 136.2 65.8 31.6 159.6 19 20 A V E -bc 40 65B 0 20,-2.9 22,-2.9 -2,-0.4 2,-0.5 -0.985 6.5-158.8-116.8 120.4 66.4 35.3 158.7 20 21 A F E +bc 41 66B 1 45,-2.7 47,-2.3 -2,-0.5 2,-0.3 -0.859 38.2 149.7 -91.1 123.4 69.5 36.9 160.0 21 22 A G E -bc 42 67B 0 20,-2.4 22,-1.7 -2,-0.5 47,-0.2 -0.978 55.9-150.6-153.9 164.2 68.8 40.7 159.9 22 23 A N - 0 0 33 45,-1.5 47,-0.2 -2,-0.3 22,-0.1 -0.964 47.8-132.3-130.7 118.7 69.1 44.3 161.0 23 24 A P + 0 0 62 0, 0.0 2,-0.3 0, 0.0 46,-0.1 -0.280 30.6 166.7 -79.2 160.3 65.7 45.9 160.1 24 25 A G > - 0 0 17 44,-0.1 3,-1.1 -2,-0.0 4,-0.3 -0.950 48.9 -94.9-156.3 175.3 64.9 49.1 158.3 25 26 A S G > S+ 0 0 61 -2,-0.3 3,-1.4 1,-0.3 -1,-0.0 0.810 115.9 62.8 -67.4 -32.2 61.8 50.7 156.7 26 27 A N G 3 S+ 0 0 3 1,-0.3 71,-0.4 70,-0.2 -1,-0.3 0.759 109.8 43.6 -63.8 -23.1 62.5 49.6 153.2 27 28 A A G X> S+ 0 0 1 -3,-1.1 4,-2.4 69,-0.2 3,-1.3 0.382 81.9 101.5 -99.4 -0.4 62.1 46.0 154.4 28 29 A L H <> S+ 0 0 102 -3,-1.4 4,-2.3 -4,-0.3 -1,-0.2 0.878 81.3 52.0 -56.9 -42.1 59.1 46.5 156.6 29 30 A P H 34 S+ 0 0 3 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.695 113.1 46.4 -69.7 -16.8 56.7 45.0 154.0 30 31 A F H <4 S+ 0 0 0 -3,-1.3 -2,-0.2 1,-0.1 -3,-0.1 0.819 116.8 42.6 -80.8 -42.2 58.9 41.9 153.8 31 32 A L H >< S+ 0 0 26 -4,-2.4 3,-0.5 3,-0.1 -3,-0.2 0.710 93.5 93.9 -82.1 -23.6 59.2 41.5 157.6 32 33 A K T 3< S+ 0 0 88 -4,-2.3 0, 0.0 -5,-0.2 0, 0.0 -0.257 88.6 24.8 -64.7 161.0 55.6 42.2 158.5 33 34 A D T 3 S- 0 0 127 1,-0.2 -1,-0.2 2,-0.0 3,-0.1 0.904 89.9-166.6 53.0 37.5 53.4 39.2 158.9 34 35 A F < - 0 0 56 -3,-0.5 -1,-0.2 1,-0.1 -3,-0.1 -0.355 26.4-104.0 -61.7 128.7 56.6 37.3 159.6 35 36 A P > - 0 0 19 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.249 16.3-133.2 -65.9 143.0 55.7 33.6 159.4 36 37 A E T 3 S+ 0 0 204 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.714 105.1 56.9 -64.1 -23.2 55.4 31.7 162.6 37 38 A D T 3 S+ 0 0 86 2,-0.0 -1,-0.3 -19,-0.0 2,-0.3 0.429 96.9 78.5 -89.7 -0.2 57.6 28.8 161.4 38 39 A F < - 0 0 14 -3,-1.7 2,-0.4 -20,-0.0 -20,-0.2 -0.697 69.7-144.6-103.0 156.7 60.5 31.2 160.6 39 40 A R E -b 18 0B 86 -22,-1.9 -20,-2.9 -2,-0.3 2,-0.5 -0.969 5.5-149.6-119.5 138.2 62.9 32.6 163.2 40 41 A Y E -b 19 0B 52 -2,-0.4 2,-0.6 -22,-0.2 -20,-0.2 -0.935 5.9-162.1-106.5 129.3 64.4 36.1 163.0 41 42 A I E -b 20 0B 6 -22,-2.9 -20,-2.4 -2,-0.5 2,-0.3 -0.940 12.5-156.5-113.2 109.2 67.9 36.6 164.5 42 43 A L E -b 21 0B 42 -2,-0.6 2,-0.3 -22,-0.2 -20,-0.2 -0.645 12.3-178.0 -82.8 135.4 68.6 40.3 165.2 43 44 A A - 0 0 1 -22,-1.7 393,-0.1 -2,-0.3 6,-0.1 -0.959 30.0-128.0-127.0 159.0 72.1 41.7 165.4 44 45 A L S S+ 0 0 67 -2,-0.3 2,-0.3 391,-0.3 -22,-0.1 0.497 89.5 27.6 -87.6 -11.1 73.0 45.3 166.1 45 46 A Q S >> S- 0 0 62 -24,-0.1 4,-2.1 388,-0.1 3,-0.7 -0.978 79.1-120.0-149.8 148.4 75.3 46.0 163.1 46 47 A E H 3> S+ 0 0 15 -2,-0.3 4,-2.6 1,-0.3 5,-0.3 0.794 110.3 59.8 -72.4 -25.2 75.4 44.4 159.7 47 48 A A H 3> S+ 0 0 17 29,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.874 110.5 46.7 -60.4 -37.4 79.0 43.1 159.9 48 49 A C H <> S+ 0 0 0 -3,-0.7 4,-2.6 2,-0.2 5,-0.3 0.910 109.2 52.9 -69.7 -44.3 77.6 41.1 162.8 49 50 A V H X S+ 0 0 2 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.952 115.1 40.8 -52.5 -53.4 74.5 40.0 161.0 50 51 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.922 113.5 53.3 -70.8 -38.0 76.5 38.6 158.1 51 52 A G H X S+ 0 0 2 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.904 110.9 46.7 -61.0 -41.2 79.2 37.1 160.3 52 53 A I H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.950 114.0 47.8 -62.7 -49.7 76.6 35.2 162.4 53 54 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 -5,-0.3 -2,-0.2 0.873 110.7 53.4 -57.2 -40.0 74.8 34.0 159.2 54 55 A D H X S+ 0 0 1 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.956 109.2 46.1 -62.8 -51.4 78.2 33.0 157.7 55 56 A G H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.926 113.6 51.2 -57.9 -40.3 79.1 30.9 160.8 56 57 A Y H X S+ 0 0 17 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.942 113.2 44.4 -60.7 -48.5 75.6 29.3 160.7 57 58 A A H X>S+ 0 0 1 -4,-2.9 4,-1.4 2,-0.2 5,-1.0 0.905 113.7 49.0 -64.7 -43.0 75.9 28.5 157.0 58 59 A Q H <5S+ 0 0 7 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.931 117.8 39.8 -65.9 -41.6 79.5 27.1 157.2 59 60 A A H <5S+ 0 0 3 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.882 119.4 45.6 -75.7 -36.5 78.6 24.9 160.2 60 61 A S H <5S- 0 0 36 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.633 98.1-137.2 -77.5 -20.3 75.2 23.8 158.9 61 62 A R T <5S+ 0 0 76 -4,-1.4 -3,-0.2 1,-0.2 -4,-0.1 0.887 71.7 94.6 59.8 43.4 76.5 23.2 155.4 62 63 A K S - d 0 96B 31 -2,-0.3 4,-2.5 26,-0.2 5,-0.4 -0.838 57.9 -74.4-101.7 108.9 68.7 47.8 154.9 70 71 A S H > S- 0 0 3 26,-1.3 4,-2.0 -2,-0.7 5,-0.2 0.103 88.7 -33.5 51.6-154.7 69.6 49.6 151.7 71 72 A A H > S+ 0 0 34 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.872 135.6 53.1 -71.6 -41.0 73.0 50.8 150.8 72 73 A A H > S+ 0 0 70 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.935 113.3 43.2 -66.0 -43.6 74.2 51.7 154.3 73 74 A G H X S+ 0 0 2 -4,-2.5 4,-0.9 2,-0.2 -3,-0.2 0.919 116.8 47.1 -64.3 -45.9 73.3 48.3 155.8 74 75 A T H >< S+ 0 0 0 -4,-2.0 3,-1.1 -5,-0.4 4,-0.3 0.942 112.6 50.7 -57.8 -48.2 74.8 46.5 152.8 75 76 A G H >< S+ 0 0 35 -4,-3.1 3,-1.8 1,-0.3 4,-0.4 0.903 103.2 57.2 -61.1 -40.3 77.9 48.6 153.0 76 77 A N H 3< S+ 0 0 78 -4,-2.4 -1,-0.3 1,-0.3 3,-0.3 0.753 109.5 49.1 -59.5 -22.4 78.4 48.0 156.7 77 78 A A T S+ 0 0 35 -3,-1.8 4,-1.5 -4,-0.3 -1,-0.2 0.817 80.4 53.8 -72.5 -28.6 81.0 44.4 152.9 79 80 A G H > S+ 0 0 49 -4,-0.4 4,-1.4 -3,-0.3 -1,-0.2 0.917 109.3 49.9 -62.2 -41.4 84.0 43.4 155.0 80 81 A A H > S+ 0 0 13 1,-0.2 4,-2.3 -4,-0.2 -2,-0.2 0.901 106.8 55.6 -62.5 -39.3 82.1 40.4 156.2 81 82 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.853 98.3 62.0 -64.9 -29.7 81.3 39.6 152.6 82 83 A S H X S+ 0 0 30 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.926 108.1 43.0 -59.1 -45.3 85.0 39.6 151.7 83 84 A N H X S+ 0 0 5 -4,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.954 111.6 54.1 -61.6 -47.7 85.5 36.7 154.1 84 85 A A H <>S+ 0 0 0 -4,-2.3 5,-2.4 1,-0.2 4,-0.4 0.846 105.8 53.8 -60.4 -34.8 82.4 34.9 152.9 85 86 A W H ><5S+ 0 0 72 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.956 110.6 45.6 -60.1 -50.8 83.7 35.1 149.3 86 87 A N H 3<5S+ 0 0 30 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.783 114.5 48.2 -67.5 -26.3 87.0 33.4 150.2 87 88 A S T 3<5S- 0 0 7 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.394 106.6-123.6 -93.3 2.1 85.2 30.7 152.3 88 89 A H T < 5 + 0 0 15 -3,-1.2 -3,-0.2 -4,-0.4 63,-0.2 0.897 45.3 180.0 55.7 41.4 82.7 29.9 149.6 89 90 A S < - 0 0 0 -5,-2.4 2,-1.6 -6,-0.2 -1,-0.2 -0.606 29.9-131.4 -79.9 126.7 79.9 30.6 152.1 90 91 A P + 0 0 5 0, 0.0 -26,-2.2 0, 0.0 2,-0.5 -0.544 44.1 161.8 -80.1 88.9 76.4 30.2 150.7 91 92 A L E -d 64 0B 0 -2,-1.6 62,-2.4 -28,-0.2 2,-0.8 -0.932 32.6-155.7-114.8 129.8 74.8 33.4 151.8 92 93 A I E -de 65 153B 0 -28,-3.0 -26,-3.0 -2,-0.5 2,-0.7 -0.883 18.3-167.4-102.5 100.4 71.6 34.9 150.3 93 94 A V E -de 66 154B 0 60,-2.5 62,-2.7 -2,-0.8 2,-0.4 -0.845 5.9-176.3 -97.0 110.8 71.9 38.6 151.1 94 95 A T E -de 67 155B 4 -28,-2.4 -26,-2.8 -2,-0.7 2,-0.4 -0.831 3.8-166.6-103.9 146.5 68.7 40.6 150.5 95 96 A A E -de 68 156B 2 60,-2.3 62,-2.2 -2,-0.4 2,-0.3 -0.995 21.4-120.9-135.2 130.0 68.6 44.3 150.9 96 97 A G E -de 69 157B 3 -28,-2.6 -26,-1.3 -2,-0.4 2,-0.2 -0.549 30.1-165.0 -72.6 132.7 65.5 46.5 151.1 97 98 A Q E - e 0 158B 2 60,-2.3 62,-2.0 -71,-0.4 13,-0.1 -0.694 27.5 -89.4-110.0 159.3 65.2 49.2 148.4 98 99 A Q - 0 0 27 11,-0.3 -1,-0.2 -2,-0.2 62,-0.2 -0.140 59.3 -77.8 -60.4 161.1 63.0 52.3 148.2 99 100 A T >> - 0 0 29 59,-0.2 3,-2.2 60,-0.2 4,-0.7 -0.391 45.7-114.5 -58.9 145.0 59.6 52.1 146.7 100 101 A R H >> S+ 0 0 72 1,-0.3 3,-1.2 2,-0.2 4,-0.6 0.859 114.4 59.1 -56.0 -35.6 59.9 52.1 142.9 101 102 A A H 34 S+ 0 0 94 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.637 109.2 44.0 -70.3 -14.7 58.1 55.5 142.6 102 103 A M H <4>S+ 0 0 82 -3,-2.2 5,-1.8 2,-0.1 4,-0.4 0.400 90.1 85.2-105.0 -2.7 60.8 57.2 144.8 103 104 A I H X<5S+ 0 0 44 -3,-1.2 3,-1.2 -4,-0.7 -2,-0.1 0.918 84.6 55.6 -68.7 -40.7 63.9 55.6 143.2 104 105 A G T 3<5S+ 0 0 75 -4,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.886 107.8 46.9 -61.6 -40.2 64.3 58.1 140.3 105 106 A V T 3 5S- 0 0 119 -4,-0.2 -1,-0.3 1,-0.0 -2,-0.2 0.580 111.3-123.8 -75.4 -8.8 64.4 61.2 142.6 106 107 A E T < 5 - 0 0 122 -3,-1.2 -3,-0.2 -4,-0.4 -2,-0.1 0.969 36.9-164.3 58.2 57.4 66.9 59.4 144.8 107 108 A A > < - 0 0 20 -5,-1.8 3,-2.0 1,-0.1 -9,-0.1 -0.239 37.6 -72.7 -56.7 156.2 64.8 59.8 148.0 108 109 A L T 3 S+ 0 0 148 1,-0.3 -1,-0.1 3,-0.0 3,-0.1 -0.280 124.9 29.3 -48.2 138.1 66.6 59.1 151.2 109 110 A L T 3 S+ 0 0 60 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.400 83.9 141.4 82.3 2.9 67.2 55.4 151.7 110 111 A T < - 0 0 18 -3,-2.0 2,-1.0 -13,-0.1 -1,-0.3 -0.617 49.6-139.9 -72.0 132.9 67.5 54.7 147.9 111 112 A N > - 0 0 4 -2,-0.3 3,-1.0 -3,-0.1 2,-0.3 -0.851 24.1-146.5 -92.7 97.4 70.2 52.2 147.1 112 113 A V T 3 S- 0 0 79 -2,-1.0 5,-0.1 1,-0.3 4,-0.1 -0.527 75.4 -6.5 -72.2 133.0 71.7 53.8 144.0 113 114 A D T >> S- 0 0 112 -2,-0.3 3,-1.8 1,-0.1 4,-0.7 0.913 86.9-177.7 52.1 45.2 73.0 51.4 141.4 114 115 A A G X4 + 0 0 6 -3,-1.0 3,-1.3 1,-0.3 -2,-0.1 0.791 67.5 57.5 -53.4 -45.2 72.3 48.7 143.9 115 116 A A G 34 S+ 0 0 21 1,-0.3 -1,-0.3 2,-0.2 4,-0.3 0.758 105.6 53.0 -62.8 -23.2 73.5 45.6 142.1 116 117 A N G X4 S+ 0 0 76 -3,-1.8 3,-0.8 1,-0.2 -1,-0.3 0.713 88.8 82.1 -81.2 -20.4 77.0 47.2 141.7 117 118 A L T << S+ 0 0 61 -3,-1.3 -1,-0.2 -4,-0.7 -2,-0.2 0.901 95.4 37.8 -56.6 -51.1 77.4 47.9 145.4 118 119 A P T > S+ 0 0 0 0, 0.0 3,-2.2 0, 0.0 -1,-0.2 0.587 93.9 147.6 -81.2 -6.8 78.6 44.5 146.7 119 120 A R T < + 0 0 126 -3,-0.8 4,-0.1 1,-0.3 -3,-0.0 -0.459 55.8 25.0 -66.2 143.5 80.7 43.7 143.6 120 121 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.3 0, 0.0 -3,-0.1 -0.868 115.3 65.3 -97.2 27.1 83.2 42.1 143.4 121 122 A L S < S+ 0 0 36 -3,-2.2 2,-0.3 30,-0.0 -2,-0.2 0.294 91.6 68.9 -97.9 10.8 82.4 40.1 146.5 122 123 A V - 0 0 16 29,-0.1 31,-0.2 1,-0.1 3,-0.1 -0.937 68.2-139.1-129.8 152.1 79.3 38.2 145.2 123 124 A K S S+ 0 0 53 29,-3.2 2,-0.3 -2,-0.3 30,-0.2 0.757 94.1 6.7 -73.3 -27.8 78.6 35.5 142.7 124 125 A W - 0 0 41 28,-0.5 30,-2.3 2,-0.0 2,-0.3 -0.960 64.4-173.7-159.0 141.0 75.5 37.2 141.4 125 126 A S E +f 154 0B 7 -2,-0.3 2,-0.3 28,-0.2 30,-0.2 -0.990 18.6 159.0-148.2 132.4 73.9 40.6 142.2 126 127 A Y E -f 155 0B 57 28,-2.0 30,-2.4 -2,-0.3 -2,-0.0 -0.999 34.3-157.7-159.0 148.4 70.5 41.8 141.0 127 128 A E - 0 0 54 -2,-0.3 30,-0.1 28,-0.2 28,-0.0 -0.984 38.4-121.8-126.2 123.4 67.6 44.1 141.3 128 129 A P - 0 0 2 0, 0.0 6,-0.1 0, 0.0 3,-0.1 -0.248 6.4-136.5 -68.0 150.2 64.3 42.8 139.6 129 130 A A S S+ 0 0 83 1,-0.1 2,-0.3 4,-0.0 3,-0.1 0.501 84.7 15.2 -81.6 -9.9 62.6 44.8 136.9 130 131 A S S > S- 0 0 55 1,-0.1 3,-0.8 31,-0.0 4,-0.4 -0.979 77.1-110.0-158.7 159.8 59.1 44.2 138.4 131 132 A A G > S+ 0 0 13 -2,-0.3 3,-2.0 1,-0.2 -1,-0.1 0.901 114.2 57.7 -60.1 -42.8 57.4 43.0 141.5 132 133 A A G 3 S+ 0 0 43 1,-0.3 35,-0.5 2,-0.2 4,-0.4 0.707 100.0 60.2 -67.1 -19.2 56.2 39.8 139.9 133 134 A E G <> S+ 0 0 35 -3,-0.8 4,-2.6 1,-0.2 -1,-0.3 0.598 80.0 90.5 -75.5 -15.4 59.8 38.8 139.1 134 135 A V H <> S+ 0 0 0 -3,-2.0 4,-2.4 -4,-0.4 5,-0.2 0.892 84.1 48.8 -57.8 -46.5 60.8 38.9 142.8 135 136 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.917 113.3 48.0 -57.9 -42.9 60.1 35.2 143.5 136 137 A H H > S+ 0 0 87 -4,-0.4 4,-2.4 -3,-0.2 -2,-0.2 0.916 111.7 49.8 -62.4 -42.3 62.0 34.1 140.4 137 138 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.872 109.3 51.8 -62.7 -38.8 64.9 36.3 141.3 138 139 A M H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.888 108.0 52.4 -62.7 -41.2 64.9 34.9 144.8 139 140 A S H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.924 108.8 49.9 -56.9 -47.6 65.0 31.4 143.3 140 141 A R H X S+ 0 0 88 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.914 110.5 50.8 -57.3 -43.3 68.0 32.4 141.2 141 142 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.921 109.1 50.2 -61.1 -47.9 69.7 33.8 144.4 142 143 A I H X S+ 0 0 2 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.951 116.5 40.8 -55.1 -51.3 69.1 30.6 146.3 143 144 A H H X S+ 0 0 16 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.899 112.6 53.5 -70.4 -40.3 70.5 28.4 143.6 144 145 A M H < S+ 0 0 57 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.888 111.9 46.4 -58.5 -40.1 73.4 30.7 142.7 145 146 A A H < S+ 0 0 0 -4,-2.3 6,-1.6 -5,-0.2 -1,-0.2 0.860 117.9 43.9 -66.8 -35.9 74.5 30.7 146.4 146 147 A S H < S+ 0 0 33 -4,-1.5 -2,-0.2 -5,-0.2 4,-0.2 0.695 90.8 90.2 -90.7 -22.8 74.2 27.0 146.6 147 148 A M S < S- 0 0 53 -4,-2.2 4,-0.1 2,-0.2 32,-0.1 -0.494 91.3 -61.5 -74.4 146.6 75.8 25.7 143.5 148 149 A A S S+ 0 0 34 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 -0.446 127.3 42.0 -64.5 140.8 79.5 24.9 143.5 149 150 A P S S- 0 0 24 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.450 97.0-150.4 -76.4 126.7 81.6 26.9 144.1 150 151 A Q + 0 0 59 -4,-0.2 -4,-0.2 -62,-0.1 -5,-0.1 -0.169 31.1 139.6 -62.4 158.8 79.2 28.2 146.8 151 152 A G - 0 0 2 -6,-1.6 -60,-0.2 -63,-0.2 2,-0.1 -0.985 48.6 -59.4 178.4 175.3 79.3 31.8 147.7 152 153 A P - 0 0 0 0, 0.0 -29,-3.2 0, 0.0 -28,-0.5 -0.442 42.4-172.2 -75.8 149.7 77.4 35.0 148.6 153 154 A V E -e 92 0B 0 -62,-2.4 -60,-2.5 -31,-0.2 2,-0.4 -0.901 11.1-140.1-135.1 162.8 74.8 36.6 146.4 154 155 A Y E -ef 93 125B 0 -30,-2.3 -28,-2.0 -2,-0.3 2,-0.4 -0.987 14.7-179.8-136.9 133.6 72.8 39.8 146.5 155 156 A L E -ef 94 126B 0 -62,-2.7 -60,-2.3 -2,-0.4 2,-0.5 -0.985 10.8-159.5-135.3 121.8 69.2 40.7 145.8 156 157 A S E -e 95 0B 0 -30,-2.4 -60,-0.2 -2,-0.4 -41,-0.1 -0.862 12.7-170.7-100.5 126.4 67.8 44.2 146.1 157 158 A V E -e 96 0B 3 -62,-2.2 -60,-2.3 -2,-0.5 5,-0.1 -0.954 21.4-125.3-126.7 117.9 64.0 44.5 146.5 158 159 A P E > -e 97 0B 0 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.299 25.7-120.0 -55.6 139.4 61.9 47.6 146.3 159 160 A Y G > S+ 0 0 99 -62,-2.0 3,-0.7 1,-0.3 4,-0.3 0.788 108.5 54.5 -43.8 -47.5 59.6 48.1 149.4 160 161 A D G 3 S+ 0 0 32 1,-0.2 4,-0.3 -62,-0.2 3,-0.3 0.549 88.7 77.6 -78.4 -6.9 56.4 48.1 147.3 161 162 A D G X S+ 0 0 2 -3,-1.9 3,-1.2 1,-0.2 -158,-0.4 0.852 80.8 67.4 -71.1 -32.6 56.9 44.8 145.5 162 163 A W T < S+ 0 0 8 -3,-0.7 -158,-2.5 -4,-0.4 -159,-0.3 0.820 99.1 47.4 -62.8 -37.1 55.9 42.6 148.5 163 164 A D T 3 S+ 0 0 84 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.530 92.9 101.6 -82.9 -8.3 52.3 43.5 148.6 164 165 A K S < S- 0 0 107 -3,-1.2 -161,-2.5 -4,-0.3 -160,-0.3 -0.342 85.5 -87.7 -73.3 161.2 51.8 43.1 144.8 165 166 A D B -A 2 0A 134 -163,-0.2 -163,-0.2 -162,-0.1 2,-0.2 -0.441 41.4-135.1 -67.9 134.0 50.2 40.0 143.2 166 167 A A - 0 0 14 -165,-2.9 -34,-0.1 -2,-0.2 -33,-0.1 -0.509 24.9-101.2 -79.7 159.3 52.5 37.2 142.4 167 168 A D > - 0 0 78 -35,-0.5 3,-2.2 -2,-0.2 4,-0.2 -0.693 24.9-139.9 -76.2 124.4 52.5 35.3 139.2 168 169 A P G > S+ 0 0 106 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.827 100.7 68.5 -57.1 -27.0 50.7 31.9 139.8 169 170 A Q G > S+ 0 0 109 1,-0.3 3,-1.6 2,-0.1 4,-0.2 0.640 75.4 85.2 -72.4 -6.7 53.3 30.3 137.6 170 171 A S G X + 0 0 8 -3,-2.2 3,-2.1 1,-0.3 4,-0.5 0.683 67.5 82.9 -63.9 -13.0 55.9 31.0 140.3 171 172 A H G X S+ 0 0 94 -3,-1.9 3,-1.2 1,-0.3 4,-0.5 0.792 76.9 69.0 -61.9 -25.8 54.7 27.7 141.9 172 173 A H G < S+ 0 0 116 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.664 92.7 60.2 -66.1 -16.3 57.1 25.9 139.5 173 174 A L G X S+ 0 0 18 -3,-2.1 3,-1.3 -4,-0.2 -1,-0.3 0.771 84.9 80.2 -74.9 -27.6 60.0 27.5 141.5 174 175 A F T < S+ 0 0 25 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.1 0.859 101.2 26.9 -58.2 -47.3 59.1 25.9 144.8 175 176 A D T 3 S+ 0 0 83 -4,-0.5 -1,-0.3 -3,-0.1 2,-0.1 0.133 79.9 142.7-107.4 19.7 60.5 22.4 144.4 176 177 A R < - 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