==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-OCT-06 2IJY . COMPND 2 MOLECULE: THIOL:DISULFIDE INTERCHANGE PROTEIN DSBA; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE; . AUTHOR J.H.HORNE,T.VELKOV,M.J.SCANLON . 181 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9356.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 6.6 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 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 . 8 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 42.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.3 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 0 1 0 1 0 1 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 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 PARALLEL BRIDGES PER LADDER . 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 A 0 0 104 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 85.7 1.4 4.2 -3.0 2 2 A Q + 0 0 119 6,-0.0 2,-0.5 1,-0.0 171,-0.0 0.805 360.0 66.0 -59.0 -32.6 3.1 0.8 -3.7 3 3 A F + 0 0 14 5,-0.1 2,-0.3 4,-0.1 -1,-0.0 -0.826 62.6 168.6-100.7 132.8 6.6 2.5 -3.5 4 4 A K >>> - 0 0 108 -2,-0.5 4,-2.4 5,-0.0 3,-1.7 -0.983 41.1 -97.7-138.0 152.1 7.9 3.9 -0.2 5 5 A E B 345S+a 9 0A 104 -2,-0.3 5,-0.2 1,-0.2 152,-0.0 -0.437 111.8 28.8 -67.5 135.4 11.3 5.2 1.0 6 6 A G T 345S+ 0 0 52 3,-4.4 -1,-0.2 -2,-0.1 4,-0.2 0.312 127.5 45.8 96.3 -9.5 13.1 2.5 3.0 7 7 A E T <45S+ 0 0 107 -3,-1.7 156,-0.3 2,-0.5 155,-0.2 0.614 124.7 19.8-128.6 -54.1 11.4 -0.3 1.0 8 8 A H T <5S- 0 0 23 -4,-2.4 152,-1.7 1,-0.2 153,-1.6 0.721 137.2 -5.9 -93.9 -19.7 11.4 0.5 -2.7 9 9 A Y E < -aB 5 159A 17 -5,-1.1 -3,-4.4 150,-0.2 -2,-0.5 -0.981 63.2-131.3-158.4 172.8 14.3 3.0 -2.4 10 10 A Q E - B 0 158A 109 148,-1.5 148,-2.7 -2,-0.3 2,-0.6 -0.901 24.0-118.1-128.8 158.3 16.5 4.8 0.1 11 11 A V E - B 0 157A 39 -2,-0.3 146,-0.2 146,-0.2 145,-0.0 -0.847 16.8-171.7-102.0 123.2 17.5 8.5 0.3 12 12 A L - 0 0 45 144,-2.8 145,-0.1 -2,-0.6 -1,-0.1 0.616 30.7-138.3 -77.6 -19.1 21.1 9.4 -0.0 13 13 A K + 0 0 154 143,-0.7 3,-0.1 1,-0.2 143,-0.1 0.690 52.5 153.5 62.6 14.7 20.4 13.0 1.0 14 14 A T - 0 0 15 142,-0.4 2,-1.0 1,-0.2 -1,-0.2 -0.220 64.9 -68.3 -67.8 165.8 22.8 13.8 -1.8 15 15 A P - 0 0 98 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.335 62.5-148.7 -56.0 93.7 22.6 17.1 -3.7 16 16 A A - 0 0 36 -2,-1.0 139,-0.2 -3,-0.1 2,-0.2 -0.296 16.1-110.1 -66.7 153.7 19.3 16.5 -5.5 17 17 A S - 0 0 30 137,-1.1 4,-0.1 2,-0.2 -1,-0.1 -0.564 14.4-126.8 -85.3 151.0 18.8 18.0 -8.9 18 18 A S S S+ 0 0 115 -2,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.851 96.2 36.0 -65.3 -29.6 16.4 20.9 -9.5 19 19 A S S S- 0 0 41 1,-0.0 2,-0.5 -3,-0.0 -2,-0.2 -0.668 106.5 -77.0-116.8 174.3 14.7 18.9 -12.3 20 20 A P + 0 0 38 0, 0.0 32,-2.8 0, 0.0 2,-0.4 -0.567 58.1 159.9 -71.7 122.4 14.1 15.2 -12.9 21 21 A V E -c 52 0A 28 -2,-0.5 133,-2.3 30,-0.2 134,-0.6 -0.995 23.1-160.7-144.5 138.3 17.2 13.4 -13.9 22 22 A V E -cD 53 153A 0 30,-2.2 32,-3.6 -2,-0.4 2,-0.4 -0.957 8.8-170.7-119.8 126.6 18.1 9.7 -13.8 23 23 A S E -cD 54 152A 5 129,-2.2 129,-2.4 -2,-0.5 2,-0.5 -0.939 9.8-150.4-117.9 136.9 21.7 8.4 -13.9 24 24 A E E -cD 55 151A 0 30,-1.6 32,-2.6 -2,-0.4 2,-0.5 -0.882 5.7-154.8-105.6 129.7 22.8 4.7 -14.3 25 25 A F E +cD 56 150A 0 125,-2.7 125,-1.5 -2,-0.5 2,-0.3 -0.864 28.8 154.2-103.0 124.5 26.1 3.6 -12.8 26 26 A F E -c 57 0A 2 30,-1.8 32,-2.2 -2,-0.5 2,-0.4 -0.954 32.7-139.4-144.1 165.5 27.6 0.5 -14.5 27 27 A S > - 0 0 1 -2,-0.3 3,-1.6 30,-0.2 7,-0.2 -0.987 14.2-142.1-132.2 132.5 31.0 -1.2 -15.1 28 28 A F T 3 S+ 0 0 1 -2,-0.4 66,-0.1 1,-0.3 -1,-0.1 0.600 98.9 68.6 -60.9 -13.9 32.2 -2.9 -18.4 29 29 A Y T 3 S+ 0 0 52 1,-0.1 -1,-0.3 64,-0.1 61,-0.0 0.333 83.6 76.6 -96.2 11.8 33.8 -5.5 -16.2 30 30 A C <> - 0 0 20 -3,-1.6 4,-3.8 1,-0.2 5,-0.2 -0.901 54.5-168.9-126.7 108.2 30.6 -7.2 -14.9 31 31 A P H > S+ 0 0 55 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.933 94.6 46.2 -58.6 -45.2 28.7 -9.5 -17.2 32 32 A H H > S+ 0 0 122 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.964 115.6 46.2 -65.0 -44.5 25.7 -9.6 -14.9 33 33 A C H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.951 110.8 53.1 -60.7 -46.5 25.8 -5.8 -14.5 34 34 A N H < S+ 0 0 3 -4,-3.8 -1,-0.2 1,-0.2 -2,-0.2 0.905 105.5 55.1 -58.4 -37.0 26.2 -5.3 -18.2 35 35 A T H X S+ 0 0 62 -4,-2.2 4,-0.8 -5,-0.2 -1,-0.2 0.927 106.7 50.3 -62.7 -41.6 23.1 -7.5 -18.8 36 36 A F H >X S+ 0 0 54 -4,-1.8 4,-1.9 1,-0.2 3,-0.6 0.887 94.6 73.7 -63.4 -38.9 21.0 -5.2 -16.5 37 37 A E H 3X S+ 0 0 17 -4,-2.0 4,-2.1 1,-0.3 3,-0.5 0.927 91.5 56.1 -41.2 -56.5 22.2 -2.1 -18.4 38 38 A P H 3> S+ 0 0 71 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.902 103.4 54.8 -41.9 -50.6 19.9 -3.0 -21.3 39 39 A I H - 0 0 59 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 -0.357 25.4-122.7 -65.3 143.3 8.5 10.3 -19.1 49 49 A E T 3 S+ 0 0 197 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.885 113.6 60.3 -56.1 -34.7 9.7 12.9 -21.7 50 50 A G T 3 S+ 0 0 55 2,-0.1 -1,-0.3 -31,-0.0 2,-0.2 0.895 93.1 78.3 -60.8 -39.2 9.7 15.5 -18.8 51 51 A A S < S- 0 0 15 -3,-0.8 2,-0.3 -32,-0.1 -30,-0.2 -0.505 75.8-143.0 -73.2 141.7 12.3 13.4 -16.9 52 52 A K E -c 21 0A 108 -32,-2.8 -30,-2.2 -2,-0.2 2,-0.3 -0.692 12.3-148.6 -97.8 154.7 15.9 13.7 -18.1 53 53 A F E -c 22 0A 47 -2,-0.3 2,-0.3 -32,-0.3 -30,-0.2 -0.831 12.5-173.4-123.2 160.1 18.3 10.7 -18.1 54 54 A Q E -c 23 0A 66 -32,-3.6 -30,-1.6 -2,-0.3 2,-0.4 -0.970 14.5-135.9-146.8 161.1 22.1 10.4 -17.6 55 55 A K E -c 24 0A 61 -2,-0.3 2,-0.4 -32,-0.2 -30,-0.2 -0.952 16.0-175.4-125.3 143.4 24.8 7.8 -17.8 56 56 A N E -c 25 0A 0 -32,-2.6 -30,-1.8 -2,-0.4 2,-0.5 -0.991 9.3-159.0-137.0 135.4 27.7 7.0 -15.4 57 57 A H E -c 26 0A 1 -2,-0.4 2,-0.4 -32,-0.2 -30,-0.2 -0.919 14.4-145.9-115.0 132.2 30.6 4.6 -15.7 58 58 A V - 0 0 3 -32,-2.2 4,-0.4 -2,-0.5 -30,-0.2 -0.787 12.3-165.3 -98.5 140.2 32.5 3.5 -12.5 59 59 A S S > S+ 0 0 22 -2,-0.4 4,-1.7 2,-0.2 7,-0.2 0.623 83.3 72.0 -93.1 -15.6 36.2 2.7 -12.4 60 60 A F T 4 S+ 0 0 85 1,-0.2 -1,-0.1 2,-0.2 6,-0.1 0.912 95.2 53.4 -72.4 -30.7 36.1 0.9 -9.0 61 61 A M T 4 S+ 0 0 42 1,-0.2 -1,-0.2 -35,-0.1 -2,-0.2 0.897 106.0 55.0 -64.1 -38.1 34.4 -2.0 -10.6 62 62 A G T >4 S- 0 0 12 -4,-0.4 3,-0.5 1,-0.2 2,-0.4 0.929 92.3-163.8 -63.0 -44.9 37.2 -2.2 -13.2 63 63 A G G >< + 0 0 45 -4,-1.7 3,-2.1 1,-0.2 4,-0.5 -0.775 66.3 2.5 95.9-137.1 39.9 -2.5 -10.5 64 64 A N G 3 S+ 0 0 147 -2,-0.4 3,-0.3 1,-0.3 -1,-0.2 0.856 145.2 39.6 -55.4 -33.9 43.5 -1.8 -11.6 65 65 A M G <> S+ 0 0 13 -3,-0.5 4,-2.1 1,-0.2 -1,-0.3 0.268 83.6 106.6 -99.9 12.6 42.2 -1.0 -15.2 66 66 A G H <> S+ 0 0 0 -3,-2.1 4,-2.2 1,-0.2 5,-0.2 0.925 77.4 55.3 -58.0 -41.3 39.1 0.9 -14.0 67 67 A Q H > S+ 0 0 128 -4,-0.5 4,-2.1 -3,-0.3 -1,-0.2 0.915 106.8 50.9 -59.8 -39.5 40.7 4.2 -15.0 68 68 A A H > S+ 0 0 7 -4,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.943 108.3 50.7 -64.3 -46.8 41.2 2.9 -18.5 69 69 A M H X S+ 0 0 2 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.936 109.4 51.1 -60.3 -42.7 37.6 1.8 -18.9 70 70 A S H X S+ 0 0 2 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.969 111.4 47.1 -60.6 -48.2 36.3 5.2 -17.8 71 71 A K H X S+ 0 0 50 -4,-2.1 4,-3.0 -5,-0.2 -1,-0.2 0.856 106.7 60.5 -59.8 -34.3 38.5 7.0 -20.3 72 72 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.971 103.8 47.2 -63.8 -47.4 37.4 4.6 -23.0 73 73 A Y H X S+ 0 0 19 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.957 113.9 48.9 -58.2 -44.1 33.7 5.5 -22.7 74 74 A A H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.934 106.8 56.4 -61.8 -39.6 34.8 9.2 -22.8 75 75 A T H X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.3 -1,-0.2 0.951 102.1 55.8 -58.0 -42.9 36.9 8.4 -25.8 76 76 A M H <>S+ 0 0 0 -4,-2.6 5,-2.7 1,-0.2 6,-0.5 0.919 103.6 55.7 -53.4 -42.7 33.8 7.1 -27.5 77 77 A I H ><5S+ 0 0 56 -4,-1.6 3,-1.6 1,-0.2 -1,-0.2 0.954 104.0 52.1 -60.8 -43.5 32.2 10.5 -26.9 78 78 A A H 3<5S+ 0 0 61 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.879 115.3 42.5 -57.1 -38.0 35.0 12.3 -28.7 79 79 A L T 3<5S- 0 0 20 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.359 109.1-122.6 -91.5 5.5 34.4 9.9 -31.7 80 80 A E T < 5S+ 0 0 173 -3,-1.6 -3,-0.2 -4,-0.4 4,-0.1 0.878 83.8 114.9 57.8 30.5 30.6 10.2 -31.5 81 81 A V >X + 0 0 19 -5,-2.7 4,-2.7 -6,-0.2 5,-0.6 0.114 26.5 113.6-118.2 20.6 30.7 6.4 -31.1 82 82 A E H >5S+ 0 0 44 -6,-0.5 4,-2.8 1,-0.2 -1,-0.1 0.980 78.4 49.4 -58.4 -56.4 29.3 5.9 -27.6 83 83 A D H 45S+ 0 0 128 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.888 118.8 40.1 -50.1 -43.2 26.1 4.2 -28.7 84 84 A K H >5S+ 0 0 104 2,-0.1 4,-0.8 1,-0.1 -2,-0.2 0.965 124.8 31.7 -74.3 -57.8 28.1 1.8 -30.9 85 85 A M H X5S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.825 104.4 74.7 -73.9 -31.7 31.2 0.9 -28.8 86 86 A V H X S+ 0 0 61 0, 0.0 4,-3.7 0, 0.0 -1,-0.3 0.793 107.5 67.1 -64.5 -24.7 27.7 -2.1 -26.0 88 88 A V H X S+ 0 0 12 -4,-0.8 4,-3.0 2,-0.2 5,-0.3 0.949 100.2 49.0 -62.8 -41.8 30.9 -3.4 -27.6 89 89 A M H X S+ 0 0 0 -4,-2.4 4,-1.8 -3,-0.5 5,-0.2 0.945 115.2 43.6 -62.5 -43.8 32.6 -3.2 -24.2 90 90 A F H X>S+ 0 0 16 -4,-1.5 4,-4.4 -5,-0.3 5,-0.5 0.949 115.3 49.4 -69.7 -40.5 29.7 -5.0 -22.5 91 91 A N H X>S+ 0 0 67 -4,-3.7 4,-3.2 2,-0.2 5,-1.5 0.985 109.3 50.1 -57.7 -59.3 29.5 -7.6 -25.4 92 92 A R H <5S+ 0 0 37 -4,-3.0 6,-2.7 -5,-0.3 5,-0.4 0.898 123.7 34.0 -51.5 -35.4 33.2 -8.3 -25.2 93 93 A I H <5S+ 0 0 8 -4,-1.8 -2,-0.2 -5,-0.3 -1,-0.2 0.960 127.5 33.9 -81.2 -63.7 32.8 -8.8 -21.5 94 94 A H H <5S+ 0 0 80 -4,-4.4 -3,-0.2 -5,-0.2 -2,-0.2 0.654 138.9 17.2 -70.4 -16.1 29.3 -10.3 -21.1 95 95 A T T < S- 0 0 73 1,-0.1 4,-2.2 -34,-0.0 5,-0.2 -0.940 84.5 -95.7-142.8 171.6 45.7 -3.3 -21.1 103 103 A E H > S+ 0 0 104 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.827 122.0 61.8 -57.2 -29.4 45.2 -0.0 -23.0 104 104 A Q H > S+ 0 0 141 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.985 105.3 41.0 -67.1 -52.2 46.7 -1.9 -26.0 105 105 A E H > S+ 0 0 42 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.920 113.0 58.2 -60.4 -37.1 44.0 -4.6 -26.2 106 106 A L H X S+ 0 0 1 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.937 103.8 51.1 -59.4 -42.7 41.5 -1.8 -25.5 107 107 A R H X S+ 0 0 101 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.943 107.6 52.7 -61.1 -44.6 42.7 0.1 -28.6 108 108 A Q H X S+ 0 0 104 -4,-2.0 4,-3.1 1,-0.2 5,-0.3 0.913 102.7 59.4 -59.1 -40.3 42.3 -3.0 -30.8 109 109 A I H X S+ 0 0 4 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.963 107.2 45.3 -55.1 -50.6 38.7 -3.4 -29.6 110 110 A F H <>S+ 0 0 0 -4,-1.6 5,-1.8 1,-0.2 3,-0.3 0.938 114.2 48.2 -58.9 -47.7 37.7 0.0 -30.9 111 111 A L H ><5S+ 0 0 49 -4,-2.1 3,-2.0 1,-0.2 -2,-0.2 0.932 107.1 56.5 -65.2 -37.2 39.5 -0.5 -34.2 112 112 A D H 3<5S+ 0 0 98 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.880 100.6 59.6 -57.2 -38.1 37.9 -3.9 -34.7 113 113 A E T 3<5S- 0 0 63 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.467 132.5 -90.8 -76.6 6.7 34.5 -2.2 -34.3 114 114 A G T < 5S+ 0 0 64 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.593 87.8 129.3 98.9 11.5 35.2 -0.0 -37.4 115 115 A I < - 0 0 11 -5,-1.8 2,-0.4 -6,-0.2 -1,-0.3 -0.601 58.1-113.0 -99.9 158.5 36.8 2.9 -35.5 116 116 A D > - 0 0 106 -2,-0.2 4,-2.4 1,-0.1 5,-0.3 -0.746 4.8-141.9 -93.3 141.7 40.2 4.4 -36.3 117 117 A A H > S+ 0 0 26 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.875 103.6 58.6 -64.7 -32.7 43.3 4.2 -34.0 118 118 A A H > S+ 0 0 72 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.957 112.4 35.5 -62.5 -51.8 44.1 7.8 -35.1 119 119 A K H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.929 116.6 53.8 -74.3 -37.9 40.8 9.3 -33.9 120 120 A F H X S+ 0 0 3 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.934 108.0 51.7 -60.1 -40.9 40.5 7.0 -30.8 121 121 A D H X S+ 0 0 53 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.943 107.2 52.5 -62.6 -41.9 44.0 8.1 -29.8 122 122 A A H < S+ 0 0 58 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.850 114.2 44.4 -60.3 -33.6 42.9 11.7 -30.1 123 123 A A H >< S+ 0 0 2 -4,-1.8 3,-1.6 2,-0.2 6,-0.3 0.923 109.0 52.4 -80.6 -45.5 40.0 11.0 -27.8 124 124 A Y H 3< S+ 0 0 53 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.848 117.6 40.6 -59.6 -31.9 41.7 8.9 -25.2 125 125 A N T 3< S+ 0 0 110 -4,-1.7 2,-0.3 -5,-0.3 -1,-0.3 0.341 89.3 119.8 -99.2 8.5 44.3 11.7 -24.7 126 126 A G <> - 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