==== 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 OXIDOREDUCTASE 06-APR-07 2PG0 . COMPND 2 MOLECULE: ACYL-COA DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS KAUSTOPHILUS; . AUTHOR L.CHEN,L-Q.CHEN,A.EBIHARA,A.SHINKAI,S.KURAMITSU,S.YOKOYAMA,M . 757 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31796.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 601 79.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 10.3 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 . 6 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 . 41 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 103 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 320 42.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.1 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 0 0 4 4 2 0 2 0 2 2 0 0 2 0 0 0 0 0 0 0 2 0 0 0 2 2 RESIDUES PER ALPHA HELIX . 2 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 2 0 2 0 2 2 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 . 2 0 0 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 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 T 0 0 197 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.5 -40.8 75.8 12.7 2 7 A A > - 0 0 19 1,-0.1 3,-1.2 3,-0.0 300,-0.0 -0.905 360.0-136.5-106.5 134.6 -39.3 77.1 16.0 3 8 A R T 3 S+ 0 0 216 -2,-0.4 -1,-0.1 1,-0.3 299,-0.0 0.442 88.6 76.8 -73.8 -6.6 -40.7 80.3 17.4 4 9 A Y T 3 S+ 0 0 12 297,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.641 81.9 77.0 -83.4 -12.4 -37.4 82.0 18.4 5 10 A L < + 0 0 35 -3,-1.2 2,-0.2 4,-0.1 -1,-0.0 -0.864 57.6 177.6-101.1 125.5 -36.4 83.0 14.9 6 11 A R >> - 0 0 128 -2,-0.5 4,-1.7 1,-0.0 3,-1.2 -0.634 50.8 -83.9-111.0 178.2 -38.1 86.0 13.2 7 12 A E H 3> S+ 0 0 126 1,-0.3 4,-2.5 -2,-0.2 5,-0.3 0.859 126.8 58.5 -49.5 -42.4 -37.5 87.5 9.8 8 13 A E H 3> S+ 0 0 87 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.840 106.6 48.1 -57.1 -36.3 -34.6 89.6 11.1 9 14 A H H <> S+ 0 0 0 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.838 109.8 53.4 -72.8 -34.3 -32.8 86.4 12.2 10 15 A H H X S+ 0 0 83 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.898 111.4 43.8 -68.2 -42.1 -33.4 84.9 8.8 11 16 A M H X S+ 0 0 113 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.881 113.2 53.6 -68.9 -37.0 -31.9 87.8 7.0 12 17 A F H X S+ 0 0 35 -4,-1.9 4,-2.9 -5,-0.3 5,-0.2 0.904 105.7 52.8 -60.2 -45.0 -29.0 87.8 9.5 13 18 A R H X S+ 0 0 33 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.907 110.0 48.1 -57.1 -44.5 -28.3 84.1 8.8 14 19 A A H X S+ 0 0 62 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.902 113.2 47.6 -63.8 -42.1 -28.1 84.8 5.1 15 20 A A H X S+ 0 0 56 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.906 114.0 46.7 -64.9 -44.1 -25.7 87.8 5.7 16 21 A F H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.906 110.6 52.3 -66.9 -41.6 -23.5 85.8 8.1 17 22 A R H X S+ 0 0 70 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.882 106.7 54.4 -60.5 -37.7 -23.4 82.8 5.7 18 23 A K H X S+ 0 0 160 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.912 108.1 49.2 -62.3 -42.7 -22.3 85.2 2.9 19 24 A F H >X S+ 0 0 21 -4,-1.8 4,-2.8 1,-0.2 3,-0.7 0.939 113.6 46.1 -57.6 -49.4 -19.4 86.3 5.1 20 25 A L H 3X>S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-2.3 0.823 101.7 64.4 -67.4 -33.9 -18.4 82.7 5.9 21 26 A E H 3<5S+ 0 0 112 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.820 117.0 29.8 -59.6 -30.5 -18.7 81.6 2.2 22 27 A K H <<5S+ 0 0 141 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.2 0.865 131.6 31.8 -89.7 -45.9 -15.8 84.0 1.5 23 28 A E H <5S+ 0 0 26 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.644 129.5 17.7 -94.5 -19.0 -13.8 84.1 4.8 24 29 A A T >X5S+ 0 0 0 -4,-2.4 4,-1.6 -5,-0.2 3,-0.7 0.769 109.8 58.4-122.7 -57.1 -14.2 80.6 6.3 25 30 A Y T 34 S+ 0 0 73 -3,-0.7 4,-1.9 1,-0.1 3,-0.5 0.532 85.9 92.5 -95.7 -15.6 -9.9 78.6 4.2 28 33 A Y H X S+ 0 0 3 -4,-1.6 4,-1.9 -3,-0.4 5,-0.1 0.872 83.4 50.9 -56.4 -45.4 -10.9 76.0 6.7 29 34 A N H > S+ 0 0 102 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.859 110.2 50.8 -61.7 -37.6 -8.6 73.1 5.4 30 35 A D H > S+ 0 0 91 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.867 107.1 54.2 -64.8 -39.2 -5.6 75.5 5.5 31 36 A W H X>S+ 0 0 15 -4,-1.9 4,-1.9 2,-0.2 5,-1.1 0.900 106.9 51.1 -62.6 -41.5 -6.4 76.4 9.1 32 37 A E H <5S+ 0 0 27 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.904 108.6 51.8 -62.0 -41.9 -6.5 72.8 10.1 33 38 A K H <5S+ 0 0 170 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.883 113.4 43.7 -59.6 -42.7 -3.1 72.3 8.5 34 39 A R H <5S- 0 0 193 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.749 106.4-129.9 -75.5 -26.8 -1.6 75.2 10.5 35 40 A G T <5S+ 0 0 12 -4,-1.9 2,-0.3 -5,-0.2 -3,-0.2 0.509 78.2 64.7 89.2 7.7 -3.3 74.1 13.7 36 41 A I S > - 0 0 49 0, 0.0 3,-1.5 0, 0.0 4,-0.9 -0.199 14.2-125.5 -62.7 144.9 -5.6 83.3 12.3 39 44 A R H 3> S+ 0 0 83 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.785 108.8 69.6 -49.5 -35.4 -6.2 86.4 14.5 40 45 A S H 3> S+ 0 0 65 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.822 93.3 56.6 -58.8 -32.1 -7.2 88.3 11.4 41 46 A F H <> S+ 0 0 3 -3,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.918 107.0 47.4 -64.8 -46.1 -10.3 86.1 11.1 42 47 A W H X S+ 0 0 7 -4,-0.9 4,-2.6 2,-0.2 -2,-0.2 0.878 110.0 54.0 -58.6 -40.8 -11.4 87.2 14.6 43 48 A A H X S+ 0 0 45 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.890 109.4 47.6 -61.5 -41.8 -10.7 90.8 13.7 44 49 A K H X S+ 0 0 63 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.898 111.0 51.5 -65.9 -41.8 -13.0 90.4 10.6 45 50 A M H <>S+ 0 0 0 -4,-2.4 5,-2.6 1,-0.2 6,-0.5 0.923 112.1 47.4 -58.0 -44.6 -15.7 88.8 12.8 46 51 A G H ><5S+ 0 0 8 -4,-2.6 3,-1.2 69,-0.4 5,-0.3 0.906 110.1 49.9 -65.9 -43.6 -15.4 91.7 15.3 47 52 A E H 3<5S+ 0 0 144 -4,-2.3 -1,-0.2 68,-0.3 -2,-0.2 0.764 110.1 51.9 -70.1 -23.8 -15.6 94.5 12.7 48 53 A N T 3<5S- 0 0 82 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.415 118.6-110.3 -92.3 -0.2 -18.6 92.9 11.1 49 54 A G T < 5S+ 0 0 18 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.635 82.7 123.0 84.2 18.0 -20.5 92.7 14.4 50 55 A F < + 0 0 17 -5,-2.6 2,-0.4 -6,-0.2 -4,-0.2 0.367 52.5 83.1 -95.7 4.8 -20.4 88.9 14.8 51 56 A L S S- 0 0 1 -6,-0.5 36,-0.1 63,-0.4 35,-0.0 -0.933 111.4 -19.0-109.4 134.4 -18.6 88.9 18.2 52 57 A C S > S+ 0 0 0 -2,-0.4 3,-1.9 1,-0.1 10,-0.3 0.839 73.2 169.9 42.1 51.3 -20.5 89.4 21.5 53 58 A P T 3 + 0 0 5 0, 0.0 11,-2.4 0, 0.0 9,-1.4 0.726 69.2 64.9 -67.7 -18.1 -23.5 90.9 19.6 54 59 A W T 3 S+ 0 0 57 9,-0.3 3,-0.1 8,-0.2 -2,-0.1 0.607 77.8 111.1 -75.2 -16.4 -25.6 90.7 22.9 55 60 A V S < S- 0 0 1 -3,-1.9 8,-2.5 1,-0.1 9,-0.3 -0.274 82.3 -92.3 -60.9 145.7 -23.3 93.2 24.6 56 61 A D > > - 0 0 61 6,-0.2 5,-2.0 5,-0.1 3,-1.9 -0.255 29.3-116.8 -62.2 149.0 -24.9 96.6 25.3 57 62 A E G > 5S+ 0 0 148 1,-0.3 3,-1.3 3,-0.2 -1,-0.1 0.775 110.5 69.7 -55.4 -29.5 -24.5 99.4 22.7 58 63 A K G 3 5S+ 0 0 135 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.680 103.3 42.3 -68.4 -17.8 -22.5 101.5 25.2 59 64 A Y G < 5S- 0 0 19 -3,-1.9 -1,-0.3 51,-0.1 55,-0.2 0.363 132.7 -91.6-102.6 0.2 -19.6 99.0 24.9 60 65 A G T < 5S+ 0 0 50 -3,-1.3 -3,-0.2 -4,-0.4 -2,-0.1 0.426 87.1 125.8 106.2 2.6 -20.0 98.8 21.2 61 66 A G < - 0 0 7 -5,-2.0 -1,-0.2 -7,-0.1 -5,-0.1 0.024 63.9-122.2 -81.2-168.7 -22.4 95.8 21.0 62 67 A L - 0 0 114 -9,-1.4 -6,-0.2 -10,-0.3 -8,-0.2 0.333 33.7-122.7-120.8 4.5 -25.7 95.4 19.3 63 68 A N + 0 0 80 -8,-2.5 -9,-0.3 1,-0.2 -7,-0.1 0.780 51.9 174.5 52.6 31.6 -28.0 94.4 22.2 64 69 A A - 0 0 17 -11,-2.4 -1,-0.2 -9,-0.3 2,-0.1 -0.321 28.1-121.6 -69.6 146.0 -28.8 91.3 20.3 65 70 A D >> - 0 0 48 -3,-0.1 3,-1.3 1,-0.1 4,-0.7 -0.300 34.6 -94.6 -78.9 172.5 -31.0 88.5 21.7 66 71 A F H 3> S+ 0 0 27 1,-0.3 4,-2.0 2,-0.2 3,-0.2 0.718 117.0 73.0 -63.3 -24.0 -29.8 84.9 22.1 67 72 A A H 3> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.855 92.5 57.0 -60.8 -33.7 -31.4 83.8 18.8 68 73 A Y H <> S+ 0 0 40 -3,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.894 106.3 49.5 -61.1 -39.9 -28.5 85.8 17.1 69 74 A S H X S+ 0 0 1 -4,-0.7 4,-2.7 -3,-0.2 5,-0.2 0.878 107.6 53.8 -67.0 -38.4 -26.0 83.6 19.0 70 75 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.947 110.6 47.1 -57.5 -48.9 -27.9 80.4 17.9 71 76 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.932 112.5 49.2 -58.5 -49.0 -27.6 81.5 14.3 72 77 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.948 113.9 44.6 -57.3 -51.5 -23.9 82.4 14.6 73 78 A N H X S+ 0 0 11 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.873 113.8 49.6 -66.7 -35.9 -23.0 79.1 16.3 74 79 A E H X S+ 0 0 10 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.948 112.8 46.8 -64.2 -49.4 -25.0 77.0 13.9 75 80 A E H X S+ 0 0 0 -4,-2.7 4,-0.9 1,-0.2 -2,-0.2 0.862 111.6 51.1 -64.0 -35.9 -23.5 78.7 10.8 76 81 A L H X S+ 0 0 4 -4,-2.4 4,-2.7 -5,-0.2 3,-0.5 0.888 108.7 51.3 -67.7 -39.5 -20.0 78.3 12.2 77 82 A E H < S+ 0 0 9 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.869 100.2 63.5 -64.8 -35.3 -20.5 74.6 12.8 78 83 A K H < S+ 0 0 48 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.830 109.1 41.7 -57.2 -31.7 -21.7 74.3 9.2 79 84 A V H < S- 0 0 3 -4,-0.9 2,-0.3 -3,-0.5 -2,-0.2 0.960 133.6 -61.5 -73.6 -62.3 -18.1 75.3 8.4 80 85 A G >< - 0 0 0 -4,-2.7 3,-1.8 -5,-0.1 -1,-0.2 -0.907 33.6-102.4 177.0 159.3 -16.5 73.1 11.1 81 86 A S G > S+ 0 0 7 1,-0.3 3,-1.8 -2,-0.3 4,-0.1 0.657 106.1 77.0 -66.0 -18.9 -16.1 72.3 14.7 82 87 A S G > S+ 0 0 0 1,-0.3 3,-0.6 2,-0.1 -1,-0.3 0.664 84.1 68.3 -66.0 -12.6 -12.7 74.0 15.0 83 88 A L G X> + 0 0 3 -3,-1.8 3,-1.9 -7,-0.2 4,-0.7 0.376 65.6 104.3 -85.6 5.1 -14.7 77.3 15.0 84 89 A V H <> + 0 0 36 -3,-1.8 4,-2.2 1,-0.3 -1,-0.2 0.699 63.7 75.2 -59.3 -22.3 -16.1 76.5 18.5 85 90 A G H <> S+ 0 0 1 -3,-0.6 4,-2.2 1,-0.2 -1,-0.3 0.770 91.7 54.9 -61.9 -27.6 -13.7 79.0 20.0 86 91 A I H <> S+ 0 0 2 -3,-1.9 4,-3.3 2,-0.2 5,-0.2 0.951 108.7 45.2 -70.5 -51.0 -16.0 81.8 18.7 87 92 A G H X>S+ 0 0 4 -4,-0.7 4,-2.9 2,-0.2 5,-0.6 0.849 112.7 54.1 -57.9 -36.5 -19.1 80.5 20.4 88 93 A L H X>S+ 0 0 19 -4,-2.2 5,-3.0 3,-0.2 4,-1.7 0.957 112.8 41.7 -61.8 -51.1 -17.0 80.0 23.5 89 94 A H H <>S+ 0 0 0 -4,-2.2 5,-1.7 3,-0.2 -2,-0.2 0.958 123.3 39.5 -57.4 -53.5 -15.9 83.7 23.4 90 95 A N H <5S+ 0 0 0 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.907 132.9 15.2 -63.7 -49.0 -19.4 85.0 22.5 91 96 A D H <5S+ 0 0 2 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.484 128.9 36.1-119.9 -7.9 -21.6 82.8 24.6 92 97 A I T <>> S+ 0 0 12 0, 0.0 4,-2.7 0, 0.0 -1,-0.3 0.801 94.0 60.5 -52.4 -27.8 -21.1 86.5 29.7 96 101 A Y H <> S+ 0 0 0 -3,-2.3 4,-2.6 -4,-0.3 5,-0.4 0.923 105.6 46.8 -62.5 -44.0 -19.1 86.0 33.0 97 102 A I H - 0 0 66 -2,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.382 35.9-101.9 -72.7 164.6 -17.8 95.6 38.1 103 108 A E H > S+ 0 0 99 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.907 126.4 52.1 -54.4 -42.5 -18.6 98.7 35.9 104 109 A E H > S+ 0 0 123 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.912 111.0 46.5 -60.1 -45.2 -14.8 99.3 35.7 105 110 A Q H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.903 113.2 48.3 -65.8 -43.1 -14.1 95.7 34.6 106 111 A K H X S+ 0 0 36 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.925 112.9 48.4 -63.2 -45.0 -16.9 95.8 32.0 107 112 A Q H < S+ 0 0 112 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.887 114.6 46.7 -61.5 -40.6 -15.7 99.1 30.6 108 113 A K H < S+ 0 0 93 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.839 127.9 20.3 -70.1 -36.1 -12.1 97.9 30.5 109 114 A W H X S+ 0 0 3 -4,-2.1 4,-1.5 -5,-0.1 3,-0.4 0.844 106.7 67.0-108.8 -42.8 -12.8 94.5 28.8 110 115 A L H X S+ 0 0 4 -4,-2.0 4,-1.9 -5,-0.3 3,-0.2 0.863 95.1 56.8 -58.5 -44.5 -16.1 94.3 27.0 111 116 A P H > S+ 0 0 39 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.916 111.0 44.8 -54.2 -42.0 -15.4 96.8 24.1 112 117 A K H >>S+ 0 0 87 -3,-0.4 6,-1.8 1,-0.2 4,-1.4 0.765 107.7 58.0 -75.1 -24.9 -12.4 94.8 23.0 113 118 A C H <5S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-0.2 -3,-0.1 0.852 106.9 50.0 -66.9 -34.8 -14.3 91.5 23.3 114 119 A V H <5S+ 0 0 15 -4,-1.9 -63,-0.4 -55,-0.2 -2,-0.2 0.874 115.8 40.6 -69.3 -39.1 -16.8 92.9 20.8 115 120 A T H <5S- 0 0 62 -4,-1.5 -69,-0.4 -5,-0.2 -68,-0.3 0.677 110.5-119.0 -83.4 -18.6 -14.0 94.0 18.4 116 121 A G T <5S+ 0 0 4 -4,-1.4 -3,-0.2 2,-0.3 -73,-0.1 0.530 80.6 122.3 87.9 7.7 -11.9 90.8 18.9 117 122 A E S -H 129 0B 7 3,-3.2 3,-0.8 27,-0.3 27,-0.2 -0.835 42.3-101.6-126.4 161.9 -6.7 70.5 35.6 127 132 A P T 3 S+ 0 0 46 0, 0.0 3,-0.1 0, 0.0 26,-0.1 0.892 124.5 39.5 -49.5 -39.6 -4.5 67.4 35.0 128 133 A G T 3 S+ 0 0 47 1,-0.2 2,-0.3 2,-0.1 521,-0.1 0.574 123.0 31.4 -87.9 -13.0 -5.9 65.9 38.2 129 134 A A B < +H 126 0B 3 -3,-0.8 -3,-3.2 1,-0.1 -1,-0.2 -0.962 47.3 135.4-155.2 128.3 -9.6 67.0 37.9 130 135 A G S S+ 0 0 26 -2,-0.3 3,-0.3 -5,-0.2 6,-0.1 0.435 90.8 28.0-127.8 -73.6 -12.1 67.7 35.2 131 136 A S S S+ 0 0 57 1,-0.3 2,-1.6 2,-0.1 3,-0.2 0.893 119.8 60.1 -56.6 -42.2 -15.5 66.1 36.1 132 137 A D > + 0 0 24 1,-0.2 3,-1.9 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17.0 709 335 B R H X S+ 0 0 99 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.896 110.0 51.6 -64.9 -42.4 -18.1 49.8 20.1 710 336 B V H X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.920 108.6 51.9 -56.2 -47.6 -15.1 49.0 22.3 711 337 B A H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.898 109.1 49.3 -56.3 -45.1 -13.3 51.9 20.7 712 338 B A H X S+ 0 0 36 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.905 113.6 46.2 -64.8 -43.3 -16.2 54.3 21.4 713 339 B E H X S+ 0 0 52 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.925 111.1 54.1 -60.2 -45.2 -16.4 53.2 25.0 714 340 B A H X S+ 0 0 0 -4,-3.0 4,-1.0 2,-0.2 -2,-0.2 0.920 108.6 46.6 -59.5 -48.5 -12.6 53.5 25.4 715 341 B M H >< S+ 0 0 4 -4,-2.5 3,-1.0 1,-0.2 4,-0.4 0.966 114.6 48.3 -58.6 -50.9 -12.4 57.1 24.2 716 342 B Q H >< S+ 0 0 8 -4,-1.9 3,-1.4 1,-0.3 -2,-0.2 0.892 108.9 52.1 -56.0 -45.3 -15.3 58.1 26.4 717 343 B L H 3< S+ 0 0 16 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.631 104.6 56.6 -72.8 -14.2 -13.9 56.4 29.5 718 344 B H T X< S- 0 0 10 -3,-1.0 3,-1.1 -4,-1.0 -1,-0.3 0.508 95.3-155.6 -85.9 -8.2 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360.0 64.6 360.0 -32.1 30.6 2.1