==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 22-SEP-06 2IG8 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PA3499; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR R.ZHANG,X.XU,J.GU,A.SAVCHENKO,A.EDWARDS,A.JOACHIMIAK,MIDWEST . 427 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16619.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 303 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 19.0 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 . 4 0.9 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 . 30 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 21.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 3 0 0 0 3 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 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 . 6 1 6 3 0 0 3 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 0 0 3 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 0 197 0, 0.0 2,-0.3 0, 0.0 278,-0.2 0.000 360.0 360.0 360.0 129.1 16.2 -19.7 10.7 2 2 A T - 0 0 30 276,-2.7 278,-0.3 274,-0.0 2,-0.2 -0.776 360.0-128.7-118.0 136.1 16.2 -16.0 11.6 3 3 A A - 0 0 76 -2,-0.3 24,-2.4 276,-0.1 2,-0.4 -0.547 19.9-168.0 -79.8 140.3 13.8 -13.7 13.4 4 4 A V E -A 26 0A 23 22,-0.2 2,-0.4 -2,-0.2 22,-0.2 -0.998 4.0-174.6-126.9 137.8 12.8 -10.4 11.8 5 5 A R E -A 25 0A 140 20,-2.2 20,-3.2 -2,-0.4 2,-0.4 -0.999 27.1-122.9-130.9 131.7 10.9 -7.7 13.7 6 6 A R E -A 24 0A 37 -2,-0.4 2,-0.6 18,-0.2 18,-0.2 -0.591 28.7-153.1 -65.5 124.0 9.5 -4.4 12.4 7 7 A I - 0 0 5 16,-2.5 16,-0.5 -2,-0.4 2,-0.5 -0.917 12.8-174.1-107.7 120.4 11.0 -1.6 14.5 8 8 A R - 0 0 112 -2,-0.6 2,-0.4 62,-0.2 3,-0.0 -0.945 14.5-146.8-116.3 127.7 9.0 1.6 14.8 9 9 A A B > -H 12 0B 5 3,-0.5 3,-1.2 -2,-0.5 58,-0.1 -0.811 13.5-138.5 -89.8 133.4 10.2 4.7 16.6 10 10 A A T 3 S+ 0 0 108 -2,-0.4 -1,-0.1 1,-0.3 57,-0.0 0.859 105.6 51.3 -52.8 -43.8 7.5 6.8 18.3 11 11 A A T 3 S+ 0 0 82 1,-0.2 -1,-0.3 52,-0.1 52,-0.0 0.687 113.5 46.6 -68.5 -19.0 9.0 10.0 17.1 12 12 A L B < S-H 9 0B 27 -3,-1.2 -3,-0.5 51,-0.1 -1,-0.2 -0.673 78.8-161.4-130.0 68.4 9.1 8.7 13.4 13 13 A P - 0 0 95 0, 0.0 2,-0.5 0, 0.0 -3,-0.1 -0.302 19.2-127.5 -60.1 134.8 5.8 7.1 12.5 14 14 A D - 0 0 20 -5,-0.1 7,-0.1 2,-0.0 -6,-0.0 -0.743 25.6-130.9 -80.2 129.2 6.0 4.9 9.5 15 15 A L > - 0 0 114 -2,-0.5 3,-1.6 1,-0.1 -1,-0.0 -0.681 9.0-128.1 -86.8 139.9 3.3 6.0 7.1 16 16 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.609 104.7 56.0 -63.3 -18.5 1.0 3.2 5.7 17 17 A D T 3 S+ 0 0 118 2,-0.0 2,-0.1 0, 0.0 225,-0.1 0.522 81.4 109.6 -89.4 -8.1 1.6 4.2 2.0 18 18 A A < - 0 0 12 -3,-1.6 233,-0.1 1,-0.1 -4,-0.0 -0.395 60.9-148.4 -71.2 143.1 5.4 3.9 2.1 19 19 A S S S+ 0 0 3 -2,-0.1 2,-0.3 231,-0.1 -1,-0.1 -0.210 79.0 61.4-103.5 38.1 7.0 1.0 0.2 20 20 A W S S- 0 0 99 231,-0.1 2,-0.4 234,-0.0 233,-0.2 -0.969 76.7-127.7-152.8 155.7 9.8 0.8 2.7 21 21 A S - 0 0 0 231,-0.9 233,-0.4 230,-0.3 3,-0.2 -0.915 14.3-140.6-101.4 131.9 10.2 0.1 6.5 22 22 A N S S+ 0 0 17 -2,-0.4 11,-2.5 1,-0.2 2,-0.3 0.893 85.3 1.1 -55.1 -42.9 12.2 2.6 8.6 23 23 A A E - B 0 32A 0 -16,-0.5 -16,-2.5 9,-0.2 2,-0.4 -0.983 56.7-175.2-154.9 141.7 13.8 -0.2 10.5 24 24 A L E -AB 6 31A 0 7,-2.5 7,-3.0 -2,-0.3 2,-0.7 -0.998 21.1-142.1-133.2 127.3 13.8 -4.0 10.6 25 25 A L E -AB 5 30A 15 -20,-3.2 -20,-2.2 -2,-0.4 2,-0.7 -0.861 21.1-174.5 -93.4 113.6 15.7 -6.0 13.3 26 26 A V E > -AB 4 29A 8 3,-3.2 3,-2.2 -2,-0.7 2,-0.4 -0.916 64.1 -53.7-116.6 96.6 17.0 -9.0 11.4 27 27 A G T 3 S- 0 0 29 -24,-2.4 -22,-0.1 -2,-0.7 -25,-0.0 -0.556 121.8 -24.5 62.8-122.0 18.6 -11.2 14.0 28 28 A E T 3 S+ 0 0 106 -2,-0.4 106,-2.9 -3,-0.1 2,-0.5 0.497 119.9 100.8 -96.1 -1.7 21.0 -8.9 15.7 29 29 A E E < -BC 26 133A 38 -3,-2.2 -3,-3.2 104,-0.2 2,-0.9 -0.695 62.3-150.1 -85.5 127.2 21.3 -6.5 12.7 30 30 A L E -BC 25 132A 0 102,-2.4 102,-1.0 -2,-0.5 2,-0.5 -0.859 15.8-160.6 -96.9 103.7 19.2 -3.3 12.8 31 31 A V E -BC 24 131A 0 -7,-3.0 -7,-2.5 -2,-0.9 2,-0.3 -0.768 13.4-170.7 -86.9 122.2 18.5 -2.6 9.1 32 32 A M E -B 23 0A 0 98,-0.7 -9,-0.2 -2,-0.5 2,-0.1 -0.888 21.7-126.9-120.1 145.5 17.5 1.0 8.6 33 33 A S - 0 0 2 -11,-2.5 97,-0.4 -2,-0.3 222,-0.2 -0.457 52.8 -79.4 -74.8 159.3 16.2 3.1 5.7 34 34 A G - 0 0 11 220,-2.0 2,-0.4 95,-0.1 95,-0.2 -0.409 51.4-141.3 -60.2 135.7 18.1 6.2 4.7 35 35 A M B +D 128 0A 13 93,-2.4 93,-2.1 -2,-0.1 2,-0.3 -0.846 21.7 178.6-108.5 142.5 17.2 9.0 7.1 36 36 A T - 0 0 18 -2,-0.4 91,-0.1 2,-0.2 27,-0.1 -0.824 41.2-111.6-131.1 169.0 16.7 12.7 6.2 37 37 A A > + 0 0 0 89,-0.5 4,-2.2 -2,-0.3 3,-0.2 0.220 66.2 153.0 -89.2 15.2 15.9 16.0 8.0 38 38 A H T 4 + 0 0 38 1,-0.3 -2,-0.2 2,-0.2 83,-0.0 -0.748 55.8 20.7 -86.4 140.4 12.5 16.2 6.3 39 39 A P T >> S+ 0 0 83 0, 0.0 4,-2.0 0, 0.0 3,-0.5 -0.982 120.8 58.8 -92.2 2.2 9.9 17.5 7.2 40 40 A A H 3> S+ 0 0 38 1,-0.2 4,-2.3 -3,-0.2 -2,-0.2 0.879 106.0 55.6 -50.0 -40.4 11.8 19.7 9.7 41 41 A T H 3X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.854 105.4 50.3 -62.8 -36.8 13.7 21.1 6.6 42 42 A R H <> S+ 0 0 78 -3,-0.5 4,-2.8 2,-0.2 -2,-0.2 0.932 112.1 46.1 -68.1 -46.2 10.5 22.0 4.8 43 43 A Q H X S+ 0 0 121 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.922 114.1 49.4 -60.8 -44.9 9.1 23.9 7.7 44 44 A A H <>S+ 0 0 14 -4,-2.3 5,-2.7 -5,-0.2 4,-0.4 0.937 112.7 46.2 -61.4 -49.6 12.4 25.7 8.3 45 45 A A H ><5S+ 0 0 38 -4,-2.5 3,-1.6 1,-0.2 5,-0.2 0.936 112.2 51.6 -58.5 -46.9 12.8 26.7 4.6 46 46 A E H 3<5S+ 0 0 150 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.820 108.2 51.1 -61.8 -33.4 9.2 27.9 4.6 47 47 A R T 3<5S- 0 0 214 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.429 123.1-104.9 -85.8 1.4 9.7 30.1 7.7 48 48 A G T < 5S+ 0 0 70 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.738 97.6 91.2 87.3 26.8 12.8 31.6 6.0 49 49 A A < - 0 0 68 -5,-2.7 -4,-0.2 -6,-0.1 -3,-0.1 -0.466 59.9-164.8-149.7 66.7 15.5 29.9 8.0 50 50 A A - 0 0 72 -5,-0.2 2,-0.3 1,-0.1 -9,-0.1 -0.195 29.0-104.2 -61.5 145.7 16.6 26.7 6.2 51 51 A L - 0 0 41 -10,-0.2 -1,-0.1 72,-0.1 -14,-0.1 -0.545 33.6-136.7 -70.6 128.2 18.6 24.1 8.1 52 52 A D > - 0 0 96 -2,-0.3 4,-2.8 -3,-0.1 5,-0.2 -0.248 33.7 -93.2 -75.4 175.1 22.3 24.1 7.1 53 53 A A H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.851 126.2 53.9 -65.5 -32.7 24.2 20.8 6.6 54 54 A H H > S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.949 112.0 43.3 -61.2 -51.7 25.3 20.7 10.2 55 55 A A H > S+ 0 0 30 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.918 115.2 49.5 -61.8 -44.2 21.8 21.1 11.5 56 56 A Q H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.894 108.4 53.4 -63.0 -40.4 20.4 18.6 9.0 57 57 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 -1,-0.2 0.895 109.5 48.2 -63.3 -41.5 23.1 16.0 9.9 58 58 A L H X S+ 0 0 56 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.900 111.4 50.2 -63.4 -42.7 22.3 16.3 13.6 59 59 A V H X S+ 0 0 47 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.947 112.9 48.0 -58.4 -46.9 18.5 15.8 12.8 60 60 A V H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 3,-0.3 0.931 111.8 46.7 -59.7 -51.4 19.4 12.8 10.7 61 61 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.851 108.3 58.6 -62.5 -32.6 21.6 11.2 13.3 62 62 A G H X S+ 0 0 34 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.871 105.8 48.6 -61.6 -37.6 18.9 11.9 15.9 63 63 A K H X S+ 0 0 32 -4,-1.6 4,-2.2 -3,-0.3 -2,-0.2 0.896 109.2 51.7 -69.1 -41.0 16.5 9.8 13.8 64 64 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.953 110.8 49.7 -59.7 -46.1 19.0 7.0 13.6 65 65 A K H X S+ 0 0 78 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.894 107.4 54.2 -57.7 -43.1 19.3 7.1 17.4 66 66 A A H X S+ 0 0 21 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.923 109.9 46.9 -60.2 -43.7 15.5 7.0 17.8 67 67 A L H X S+ 0 0 0 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.916 111.9 50.4 -63.6 -44.0 15.4 3.8 15.7 68 68 A L H ><>S+ 0 0 0 -4,-2.4 5,-3.2 1,-0.2 3,-0.7 0.940 112.5 46.7 -58.2 -49.0 18.2 2.2 17.6 69 69 A E H ><5S+ 0 0 100 -4,-2.7 3,-1.6 1,-0.3 -1,-0.2 0.854 105.5 58.5 -63.7 -35.2 16.6 3.0 20.9 70 70 A A H 3<5S+ 0 0 46 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.793 107.4 49.5 -65.7 -25.7 13.2 1.7 19.7 71 71 A A T <<5S- 0 0 10 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.416 126.9-102.9 -88.8 -0.0 15.1 -1.6 19.1 72 72 A G T < 5S+ 0 0 71 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.544 87.4 116.5 86.0 11.6 16.5 -1.5 22.6 73 73 A G < - 0 0 13 -5,-3.2 2,-0.3 -6,-0.2 -1,-0.2 -0.085 50.4-144.1 -98.7-163.8 19.9 -0.4 21.2 74 74 A H > - 0 0 81 -3,-0.1 3,-2.2 -6,-0.1 4,-0.2 -0.932 39.1 -84.6-159.0 172.7 22.1 2.7 21.5 75 75 A V G > S+ 0 0 25 1,-0.3 3,-1.4 -2,-0.3 63,-0.1 0.731 117.2 69.3 -64.7 -28.0 24.6 4.7 19.4 76 76 A G G 3 S+ 0 0 2 1,-0.2 62,-2.5 61,-0.1 -1,-0.3 0.590 85.3 70.5 -61.1 -16.6 27.5 2.4 20.1 77 77 A N G < S+ 0 0 1 -3,-2.2 56,-2.4 60,-0.2 2,-0.3 0.609 75.4 104.3 -76.0 -16.5 25.7 -0.3 17.9 78 78 A L E < +E 132 0A 0 -3,-1.4 54,-0.3 54,-0.2 60,-0.2 -0.513 35.3 163.7 -69.9 131.4 26.5 1.7 14.8 79 79 A Y E + 0 0 14 52,-2.7 31,-2.7 1,-0.3 2,-0.3 0.568 63.3 27.6-121.0 -19.0 29.4 0.3 12.7 80 80 A K E -Ef 131 110A 0 51,-1.7 51,-3.0 29,-0.3 2,-0.4 -0.992 52.9-168.0-149.0 138.9 28.9 2.1 9.3 81 81 A L E -Ef 130 111A 2 29,-2.3 31,-1.8 -2,-0.3 2,-0.7 -0.977 6.4-162.9-123.3 115.8 27.5 5.3 8.0 82 82 A N E -Ef 129 112A 5 47,-3.1 47,-3.0 -2,-0.4 2,-0.5 -0.897 17.7-164.7 -94.0 115.0 26.9 5.9 4.3 83 83 A V E -Ef 128 113A 1 29,-3.5 31,-2.1 -2,-0.7 2,-0.5 -0.903 10.8-169.1-109.3 127.2 26.5 9.7 3.8 84 84 A Y E -Ef 127 114A 5 43,-2.8 43,-1.8 -2,-0.5 2,-0.3 -0.971 12.3-178.3-116.0 121.3 25.0 11.2 0.6 85 85 A V E -Ef 126 115A 0 29,-2.6 31,-2.7 -2,-0.5 41,-0.2 -0.812 31.0-146.6-119.2 155.5 25.4 15.0 0.3 86 86 A T S S+ 0 0 39 39,-1.6 2,-0.4 -2,-0.3 40,-0.1 0.607 95.8 38.8 -92.7 -16.8 24.2 17.4 -2.4 87 87 A R > - 0 0 116 38,-0.5 3,-2.4 1,-0.1 -1,-0.3 -0.937 67.7-155.9-135.4 113.7 27.3 19.6 -1.9 88 88 A I G > S+ 0 0 37 -2,-0.4 3,-2.2 1,-0.3 4,-0.2 0.802 91.5 72.5 -60.3 -27.4 30.7 18.1 -1.2 89 89 A A G > S+ 0 0 83 1,-0.3 3,-0.6 2,-0.1 4,-0.3 0.674 86.8 67.1 -57.8 -18.3 31.7 21.3 0.5 90 90 A D G <> + 0 0 20 -3,-2.4 4,-2.2 1,-0.2 -1,-0.3 0.482 68.7 99.6 -81.5 -2.9 29.4 20.3 3.4 91 91 A K H <> S+ 0 0 53 -3,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.820 82.5 49.6 -54.2 -34.9 31.6 17.3 4.3 92 92 A D H <> S+ 0 0 96 -3,-0.6 4,-2.8 2,-0.2 -1,-0.2 0.897 107.6 53.0 -74.0 -43.2 33.2 19.2 7.2 93 93 A A H > S+ 0 0 10 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.898 110.2 49.3 -49.3 -45.7 29.8 20.3 8.6 94 94 A I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.906 109.8 51.7 -65.0 -42.0 28.8 16.6 8.6 95 95 A G H X S+ 0 0 6 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.929 107.3 51.5 -58.7 -47.9 32.1 15.8 10.4 96 96 A R H X S+ 0 0 130 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.915 110.0 51.2 -52.9 -46.5 31.4 18.5 13.1 97 97 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.896 109.9 48.5 -58.8 -43.2 28.0 16.9 13.5 98 98 A R H X S+ 0 0 6 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.889 107.1 55.5 -66.7 -41.4 29.5 13.4 13.9 99 99 A Q H < S+ 0 0 89 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.903 113.8 42.2 -56.6 -42.2 32.0 14.6 16.5 100 100 A E H >< S+ 0 0 103 -4,-1.9 3,-1.5 -5,-0.2 -2,-0.2 0.935 114.3 49.2 -67.0 -50.2 29.2 16.0 18.5 101 101 A F H 3< S+ 0 0 40 -4,-2.7 3,-0.4 1,-0.3 -2,-0.2 0.860 118.4 39.3 -61.6 -38.5 26.9 13.0 18.1 102 102 A F T >< S+ 0 0 3 -4,-2.7 3,-1.1 1,-0.2 -1,-0.3 0.108 73.8 128.6-100.6 20.1 29.6 10.5 19.1 103 103 A A T < S+ 0 0 76 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.793 72.1 58.0 -46.2 -37.7 31.1 12.8 21.8 104 104 A G T 3 S+ 0 0 83 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.917 95.1 77.4 -19.9 -82.0 30.7 9.6 24.0 105 105 A Q < - 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