==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER KETOSTEROID ISOMERASE 24-JUN-99 1QJG . COMPND 2 MOLECULE: KETOSTEROID ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS TESTOSTERONI; . AUTHOR H.-S.CHO,B.-H.OH . 750 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31967.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 570 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 211 28.1 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 . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 0.1 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 . 62 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 22.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 4 1 1 0 0 0 2 4 0 0 0 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 6 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 . 0 9 8 10 9 6 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 6 0 6 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 M 0 0 150 0, 0.0 2,-0.6 0, 0.0 103,-0.1 0.000 360.0 360.0 360.0 119.8 9.4 86.7 -18.1 2 2 A N + 0 0 20 4,-0.1 74,-0.3 101,-0.1 75,-0.1 -0.743 360.0 154.1-117.7 86.2 6.6 84.4 -19.4 3 3 A T > - 0 0 50 -2,-0.6 4,-2.1 1,-0.1 5,-0.2 -0.618 57.6-110.0 -97.7 161.9 3.9 86.3 -21.2 4 4 A P H > S+ 0 0 29 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.949 121.2 57.1 -57.6 -43.0 1.9 84.4 -23.9 5 5 A E H > S+ 0 0 99 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.877 107.3 47.0 -53.0 -44.2 3.6 86.5 -26.4 6 6 A H H > S+ 0 0 56 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.904 111.3 48.4 -69.0 -44.1 7.0 85.4 -25.2 7 7 A M H X S+ 0 0 3 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.877 112.6 51.2 -65.6 -32.9 6.3 81.7 -25.1 8 8 A T H X S+ 0 0 36 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.874 108.5 50.0 -71.6 -36.3 4.8 82.1 -28.6 9 9 A A H X S+ 0 0 26 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.871 109.8 52.2 -69.8 -34.8 7.9 83.8 -29.9 10 10 A V H X S+ 0 0 8 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.906 107.1 51.0 -67.3 -42.0 10.1 81.1 -28.5 11 11 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.940 112.2 49.3 -59.9 -43.4 8.0 78.3 -30.2 12 12 A Q H X S+ 0 0 107 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.836 109.0 49.6 -65.0 -36.9 8.5 80.2 -33.4 13 13 A R H X S+ 0 0 147 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.851 110.5 53.6 -70.4 -32.2 12.2 80.6 -33.0 14 14 A Y H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.933 109.6 44.7 -65.1 -51.0 12.4 76.9 -32.3 15 15 A V H X S+ 0 0 14 -4,-2.3 4,-2.1 1,-0.2 50,-0.3 0.917 116.5 48.7 -60.4 -41.9 10.6 75.9 -35.5 16 16 A A H X S+ 0 0 52 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.884 110.5 48.3 -66.1 -43.5 12.7 78.4 -37.4 17 17 A A H ><>S+ 0 0 8 -4,-2.7 5,-2.2 2,-0.2 3,-0.7 0.871 111.1 52.0 -65.4 -37.0 16.0 77.2 -35.9 18 18 A L H ><5S+ 0 0 9 -4,-2.3 3,-1.1 1,-0.2 45,-0.4 0.928 108.7 51.7 -64.0 -43.0 15.0 73.6 -36.7 19 19 A N H 3<5S+ 0 0 75 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.597 112.8 45.6 -68.4 -16.1 14.3 74.7 -40.3 20 20 A A T <<5S- 0 0 76 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.348 105.7-119.3-111.5 7.5 17.7 76.3 -40.6 21 21 A G T < 5 + 0 0 49 -3,-1.1 2,-1.2 -4,-0.4 -3,-0.2 0.830 57.4 159.8 57.2 31.5 19.9 73.5 -39.1 22 22 A D >< + 0 0 74 -5,-2.2 4,-1.9 1,-0.2 -1,-0.2 -0.700 16.3 178.5 -90.4 93.9 20.9 76.2 -36.5 23 23 A L H > S+ 0 0 37 -2,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.855 78.7 45.7 -66.4 -40.0 22.2 74.0 -33.7 24 24 A D H > S+ 0 0 95 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.781 108.5 56.9 -77.4 -24.7 23.1 76.9 -31.4 25 25 A G H > S+ 0 0 21 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.912 108.7 47.1 -70.6 -41.1 19.9 78.7 -32.0 26 26 A I H >< S+ 0 0 0 -4,-1.9 3,-1.4 1,-0.2 4,-0.4 0.972 114.0 46.1 -61.9 -54.9 17.9 75.7 -30.8 27 27 A V H >< S+ 0 0 19 -4,-1.8 3,-1.1 1,-0.3 -1,-0.2 0.758 99.5 67.9 -62.3 -26.7 20.0 75.1 -27.7 28 28 A A H 3< S+ 0 0 68 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.724 92.8 64.0 -65.9 -21.6 20.1 78.8 -26.6 29 29 A L T << S+ 0 0 25 -3,-1.4 80,-2.3 -4,-0.5 -1,-0.3 0.728 90.3 80.4 -72.6 -29.2 16.3 78.4 -25.9 30 30 A F E < S-a 109 0A 7 -3,-1.1 2,-0.2 -4,-0.4 80,-0.2 -0.465 81.3-117.1 -87.4 151.4 16.8 75.8 -23.2 31 31 A A E > - 0 0 2 78,-3.0 3,-2.0 -2,-0.2 16,-0.2 -0.574 35.4-111.7 -76.7 153.2 17.7 76.4 -19.5 32 32 A D E 3 S+ 0 0 106 1,-0.3 16,-1.2 -2,-0.2 17,-0.2 0.834 119.3 43.0 -59.8 -28.1 21.0 74.7 -18.6 33 33 A D E 3 S+ 0 0 122 14,-0.2 -1,-0.3 13,-0.1 77,-0.1 0.305 91.0 132.4-100.1 10.3 19.2 72.2 -16.4 34 34 A A E < - 0 0 0 -3,-2.0 13,-2.9 75,-0.2 2,-0.3 -0.007 44.3-142.8 -61.4 160.3 16.4 71.6 -18.9 35 35 A T E -aB 111 46A 47 75,-1.6 77,-1.3 11,-0.2 2,-0.4 -0.905 5.8-157.3-124.7 158.6 15.2 68.1 -20.0 36 36 A V E -aB 112 45A 0 9,-2.2 9,-2.9 -2,-0.3 2,-0.5 -0.998 4.4-172.3-135.1 126.8 13.9 66.8 -23.4 37 37 A E E -a 113 0A 36 75,-1.9 77,-2.2 -2,-0.4 3,-0.2 -0.891 16.7-171.3-123.3 94.9 11.7 63.7 -23.6 38 38 A N S S+ 0 0 35 -2,-0.5 2,-0.1 1,-0.4 77,-0.1 -0.951 74.5 17.6-136.1 109.4 11.5 63.0 -27.3 39 39 A P S > S- 0 0 49 0, 0.0 3,-2.0 0, 0.0 -1,-0.4 0.659 101.4-110.5 -88.3 170.1 9.5 60.9 -27.8 40 40 A V T 3 S+ 0 0 2 74,-2.3 76,-0.2 1,-0.3 163,-0.1 -0.373 107.1 40.2 -57.3 127.0 7.2 60.8 -24.8 41 41 A G T 3 S+ 0 0 56 1,-0.5 -1,-0.3 -2,-0.1 2,-0.1 0.252 95.5 99.9 113.6 -12.5 8.0 57.4 -23.1 42 42 A S S < S- 0 0 31 -3,-2.0 -1,-0.5 1,-0.1 0, 0.0 -0.454 87.6 -74.6 -97.9 174.7 11.8 57.5 -23.6 43 43 A E - 0 0 131 -2,-0.1 -5,-0.3 -3,-0.1 -1,-0.1 -0.546 56.0-114.2 -72.6 127.1 14.6 58.3 -21.2 44 44 A P - 0 0 74 0, 0.0 2,-0.5 0, 0.0 -7,-0.2 -0.315 18.2-133.7 -62.3 141.2 14.8 62.1 -20.7 45 45 A R E -B 36 0A 63 -9,-2.9 -9,-2.2 5,-0.0 2,-0.4 -0.846 28.1-163.0 -92.9 133.8 17.9 63.9 -22.0 46 46 A S E +B 35 0A 81 -2,-0.5 4,-0.4 -11,-0.2 -11,-0.2 -0.984 41.0 16.0-127.6 129.6 19.0 66.3 -19.2 47 47 A G S >> S- 0 0 17 -13,-2.9 4,-1.9 -2,-0.4 3,-0.6 0.173 87.6 -76.0 94.7 150.3 21.4 69.2 -19.5 48 48 A T H 3> S+ 0 0 54 -16,-1.2 4,-2.5 1,-0.2 5,-0.2 0.812 125.1 53.1 -47.9 -46.4 22.8 71.4 -22.3 49 49 A A H 3> S+ 0 0 83 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.873 112.9 43.7 -62.5 -39.7 25.4 68.8 -23.5 50 50 A A H <> S+ 0 0 31 -3,-0.6 4,-1.7 -4,-0.4 -1,-0.2 0.771 112.7 52.3 -76.3 -30.7 22.7 66.1 -23.9 51 51 A I H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.931 110.7 47.5 -70.7 -44.3 20.2 68.4 -25.5 52 52 A R H X S+ 0 0 110 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.946 111.7 50.3 -61.3 -48.0 22.8 69.5 -28.1 53 53 A E H X S+ 0 0 108 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.914 111.2 49.9 -57.9 -42.7 23.8 65.9 -28.9 54 54 A F H X S+ 0 0 23 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.935 114.1 42.9 -64.2 -47.1 20.2 65.0 -29.3 55 55 A Y H X S+ 0 0 4 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.837 108.8 58.6 -71.0 -27.3 19.4 67.8 -31.7 56 56 A A H < S+ 0 0 41 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.907 108.3 46.8 -65.4 -40.7 22.7 67.3 -33.6 57 57 A N H >< S+ 0 0 72 -4,-2.0 3,-1.0 -5,-0.2 4,-0.2 0.824 110.4 53.3 -66.4 -37.6 21.5 63.8 -34.4 58 58 A S H >< S+ 0 0 42 -4,-1.5 3,-1.0 1,-0.2 -2,-0.2 0.878 104.2 54.5 -66.6 -38.8 18.1 65.0 -35.4 59 59 A L T 3< S+ 0 0 37 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.297 76.1 100.8 -80.7 11.5 19.5 67.5 -37.8 60 60 A K T < S+ 0 0 150 -3,-1.0 -1,-0.2 -5,-0.1 -2,-0.1 0.883 87.6 45.0 -58.7 -40.4 21.5 64.7 -39.6 61 61 A L S < S- 0 0 50 -3,-1.0 2,-0.3 -4,-0.2 27,-0.1 -0.813 104.9-104.0-104.6 142.7 18.6 64.8 -42.1 62 62 A P - 0 0 113 0, 0.0 2,-0.4 0, 0.0 25,-0.4 -0.536 43.6-154.8 -68.5 131.5 17.4 68.2 -43.5 63 63 A L - 0 0 31 -45,-0.4 2,-0.5 -2,-0.3 23,-0.2 -0.868 19.6-161.8-115.4 145.3 14.1 68.9 -41.8 64 64 A A E +F 85 0B 53 21,-2.2 21,-3.1 -2,-0.4 2,-0.4 -0.985 23.7 175.7-121.3 107.6 11.1 71.0 -42.9 65 65 A V E +F 84 0B 4 -2,-0.5 2,-0.3 -50,-0.3 19,-0.2 -0.948 4.1 176.4-118.4 140.5 9.0 71.8 -39.9 66 66 A E E -F 83 0B 104 17,-1.7 17,-1.8 -2,-0.4 2,-0.2 -0.998 33.0-117.1-145.1 141.6 6.0 74.1 -39.8 67 67 A L E -F 82 0B 50 -2,-0.3 15,-0.3 15,-0.2 3,-0.1 -0.529 24.8-169.8 -70.6 140.7 3.4 75.1 -37.2 68 68 A T + 0 0 52 13,-2.3 2,-0.3 1,-0.2 14,-0.2 0.514 64.1 16.3-112.0 -6.0 -0.0 73.9 -38.3 69 69 A Q S S- 0 0 43 12,-0.8 12,-0.2 1,-0.0 -1,-0.2 -0.940 97.7 -64.5-154.1 169.8 -2.3 75.7 -35.8 70 70 A E - 0 0 75 -2,-0.3 11,-0.3 1,-0.1 2,-0.3 -0.161 57.4-105.9 -58.5 150.7 -2.2 78.5 -33.3 71 71 A V - 0 0 15 9,-0.1 2,-0.7 -4,-0.1 9,-0.2 -0.630 25.9-138.5 -80.1 137.4 0.2 78.1 -30.3 72 72 A R E +C 79 0A 2 7,-2.7 7,-2.3 -2,-0.3 2,-0.4 -0.911 30.3 175.2 -97.9 116.2 -1.6 77.4 -27.0 73 73 A A E +C 78 0A 6 -2,-0.7 172,-0.3 5,-0.2 2,-0.3 -0.985 10.2 138.1-129.5 129.9 0.1 79.4 -24.3 74 74 A V E > -C 77 0A 22 3,-2.6 3,-1.6 -2,-0.4 169,-0.1 -0.937 61.7 -1.7-167.5 143.1 -0.9 79.7 -20.7 75 75 A A T 3 S- 0 0 40 -2,-0.3 3,-0.1 1,-0.3 -72,-0.1 0.830 126.9 -47.1 39.1 59.0 0.6 79.8 -17.1 76 76 A N T 3 S+ 0 0 77 -74,-0.3 27,-2.9 1,-0.2 2,-0.3 0.704 121.5 101.2 62.8 20.6 4.3 79.3 -18.1 77 77 A E E < -CD 74 102A 12 -3,-1.6 -3,-2.6 25,-0.2 2,-0.3 -0.942 47.5-172.9-134.4 151.8 3.4 76.4 -20.5 78 78 A A E -CD 73 101A 0 23,-2.1 23,-3.2 -2,-0.3 2,-0.3 -0.987 2.3-173.8-144.0 142.7 3.0 76.2 -24.2 79 79 A A E +CD 72 100A 4 -7,-2.3 -7,-2.7 -2,-0.3 2,-0.3 -0.992 10.7 177.5-136.6 142.0 1.7 73.4 -26.5 80 80 A F E - D 0 99A 0 19,-2.0 19,-2.2 -2,-0.3 2,-0.4 -0.987 24.1-137.3-147.7 154.2 1.7 73.4 -30.3 81 81 A A E + D 0 98A 0 -2,-0.3 -13,-2.3 -11,-0.3 -12,-0.8 -0.904 40.2 142.8-110.4 137.1 0.9 71.1 -33.2 82 82 A F E -F 67 0B 6 15,-1.6 2,-0.3 -2,-0.4 -15,-0.2 -0.934 40.1-115.9-160.0 175.9 3.3 71.0 -36.1 83 83 A I E -F 66 0B 27 -17,-1.8 -17,-1.7 -2,-0.3 2,-0.5 -0.957 9.1-157.8-126.7 150.8 4.8 68.7 -38.7 84 84 A V E -FG 65 95B 26 11,-2.0 11,-2.5 -2,-0.3 2,-0.4 -0.991 20.2-171.7-124.5 112.9 8.4 67.6 -39.3 85 85 A S E +FG 64 94B 22 -21,-3.1 -21,-2.2 -2,-0.5 2,-0.3 -0.881 15.3 147.7-109.6 146.7 9.0 66.4 -42.9 86 86 A F E - G 0 93B 47 7,-2.0 7,-2.2 -2,-0.4 2,-0.5 -0.955 38.4-121.8-163.7 168.6 12.1 64.8 -44.2 87 87 A E E - G 0 92B 116 -25,-0.4 2,-0.8 -2,-0.3 5,-0.3 -0.992 11.1-161.5-124.6 125.1 13.1 62.2 -46.8 88 88 A Y S S- 0 0 127 3,-2.7 3,-0.1 -2,-0.5 -2,-0.0 -0.867 84.7 -22.3-107.9 94.4 15.1 59.1 -45.9 89 89 A Q S S- 0 0 143 -2,-0.8 -1,-0.2 1,-0.2 3,-0.1 0.996 128.5 -43.5 69.4 67.7 16.5 58.0 -49.2 90 90 A G S S+ 0 0 71 -3,-0.2 2,-0.6 1,-0.2 -1,-0.2 0.462 116.5 114.7 61.4 1.9 14.2 59.6 -51.7 91 91 A R - 0 0 99 -3,-0.1 -3,-2.7 32,-0.0 -1,-0.2 -0.914 59.2-144.7-107.1 114.1 11.3 58.5 -49.5 92 92 A K E -G 87 0B 72 -2,-0.6 32,-3.6 -5,-0.3 2,-0.3 -0.454 19.1-179.9 -78.0 151.5 9.3 61.4 -47.8 93 93 A T E -GH 86 123B 10 -7,-2.2 -7,-2.0 30,-0.3 2,-0.4 -0.988 13.2-158.0-152.3 141.2 7.8 61.0 -44.4 94 94 A V E -GH 85 122B 14 28,-3.0 28,-3.1 -2,-0.3 2,-0.5 -0.981 4.6-165.6-127.7 118.2 5.8 63.4 -42.2 95 95 A V E -GH 84 121B 16 -11,-2.5 -11,-2.0 -2,-0.4 26,-0.2 -0.894 4.7-160.8-105.1 131.1 5.6 63.1 -38.4 96 96 A A + 0 0 2 24,-2.8 21,-0.2 -2,-0.5 -13,-0.2 -0.849 22.9 162.2-114.2 93.8 2.8 65.1 -36.7 97 97 A P - 0 0 4 0, 0.0 -15,-1.6 0, 0.0 2,-0.5 -0.544 35.7-134.6-104.5 172.8 3.5 65.6 -33.0 98 98 A I E -DE 81 115A 5 17,-1.8 17,-2.9 -17,-0.2 2,-0.4 -0.998 26.7-154.3-122.6 122.5 2.2 67.9 -30.4 99 99 A D E -DE 80 114A 1 -19,-2.2 -19,-2.0 -2,-0.5 2,-0.5 -0.836 4.6-153.9-101.0 150.1 5.0 69.4 -28.3 100 100 A H E -DE 79 113A 22 13,-2.4 13,-1.9 -2,-0.4 2,-0.3 -0.984 11.4-171.4-125.1 119.0 4.7 70.7 -24.7 101 101 A F E -DE 78 112A 1 -23,-3.2 -23,-2.1 -2,-0.5 2,-0.4 -0.830 6.7-162.6-106.9 151.1 7.1 73.3 -23.4 102 102 A R E -DE 77 111A 96 9,-1.7 8,-2.9 -2,-0.3 9,-1.4 -1.000 13.8-156.2-135.8 125.5 7.3 74.5 -19.8 103 103 A F E - E 0 109A 9 -27,-2.9 6,-0.2 -2,-0.4 2,-0.2 -0.620 1.4-143.7-103.0 165.1 9.1 77.8 -19.1 104 104 A N > - 0 0 44 4,-2.0 3,-2.5 -2,-0.2 -28,-0.0 -0.641 41.8 -82.0-117.0 179.3 10.8 79.2 -16.1 105 105 A G T 3 S+ 0 0 68 1,-0.3 -29,-0.0 -2,-0.2 -2,-0.0 0.828 126.8 56.4 -50.5 -38.5 11.1 82.6 -14.5 106 106 A A T 3 S- 0 0 79 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.551 117.3-111.4 -73.6 -6.0 13.9 83.6 -16.9 107 107 A G S < S+ 0 0 5 -3,-2.5 2,-0.2 1,-0.3 -2,-0.1 0.545 76.7 128.1 87.2 5.9 11.7 82.8 -19.9 108 108 A K - 0 0 67 1,-0.1 -4,-2.0 -78,-0.0 2,-0.4 -0.615 67.4-102.9 -95.6 157.0 13.8 79.8 -21.0 109 109 A V E +aE 30 103A 0 -80,-2.3 -78,-3.0 -6,-0.2 -6,-0.3 -0.632 36.2 173.2 -78.4 124.7 12.4 76.3 -21.6 110 110 A V E + 0 0 33 -8,-2.9 -75,-1.6 -2,-0.4 2,-0.3 0.594 69.9 24.0-106.9 -13.0 13.1 74.0 -18.7 111 111 A S E +aE 35 102A 22 -9,-1.4 -9,-1.7 -77,-0.2 2,-0.4 -0.973 57.8 177.6-155.3 131.3 11.1 71.0 -20.1 112 112 A M E -aE 36 101A 1 -77,-1.3 -75,-1.9 -2,-0.3 2,-0.4 -0.999 4.3-174.2-136.2 137.8 9.9 69.8 -23.5 113 113 A R E -aE 37 100A 30 -13,-1.9 -13,-2.4 -2,-0.4 2,-0.6 -0.993 12.6-151.5-133.9 127.8 8.0 66.7 -24.3 114 114 A A E - 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