==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-FEB-06 2G1E . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TA0895; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; . AUTHOR I.Y.YEO,E.HONG,J.JUNG,W.LEE,A.YEE,C.H.ARROWSMITH . 90 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6016.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 59 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 15.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.1 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 1.1 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 . 9 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 21.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.1 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 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 153 0, 0.0 2,-0.4 0, 0.0 21,-0.2 0.000 360.0 360.0 360.0 152.8 2.1 -0.0 -1.2 2 2 A V E -A 21 0A 6 19,-2.4 19,-1.7 78,-0.0 2,-0.4 -0.960 360.0-140.0-119.9 130.7 1.0 -1.2 -4.7 3 3 A T E -Ab 20 80A 43 76,-2.3 78,-2.7 -2,-0.4 2,-0.4 -0.723 18.2-167.7 -90.4 133.9 2.9 -3.8 -6.7 4 4 A V E -Ab 19 81A 2 15,-2.9 15,-1.7 -2,-0.4 2,-0.4 -0.972 5.0-156.2-125.0 136.0 3.2 -3.3 -10.5 5 5 A R E -Ab 18 82A 78 76,-2.7 78,-2.1 -2,-0.4 2,-0.4 -0.873 4.6-154.6-112.1 143.3 4.4 -5.8 -13.1 6 6 A Y E + b 0 83A 6 11,-1.5 78,-0.1 -2,-0.4 76,-0.0 -0.955 30.5 146.3-120.1 134.5 5.8 -5.0 -16.5 7 7 A Y + 0 0 93 76,-1.5 77,-0.2 -2,-0.4 -1,-0.1 0.576 57.1 71.3-130.6 -39.1 5.8 -7.3 -19.6 8 8 A A S > S- 0 0 6 75,-1.0 3,-1.7 1,-0.1 38,-0.1 0.306 116.6 -59.4 -64.4-159.2 5.5 -5.0 -22.6 9 9 A T T 3> S+ 0 0 50 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.626 126.4 81.3 -63.2 -11.4 8.3 -2.8 -23.9 10 10 A L H 3> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 3,-0.4 0.851 81.2 63.6 -63.0 -35.1 8.2 -1.2 -20.4 11 11 A R H X>>S+ 0 0 130 -3,-1.7 4,-2.0 1,-0.3 5,-1.2 0.971 109.3 36.0 -52.4 -62.3 10.3 -4.0 -19.1 12 12 A P H 345S+ 0 0 95 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.565 113.9 63.1 -69.8 -7.9 13.4 -3.2 -21.2 13 13 A I H 3<5S+ 0 0 41 -4,-0.7 -2,-0.2 -3,-0.4 -3,-0.2 0.808 118.0 22.8 -85.8 -33.6 12.5 0.4 -20.7 14 14 A T H <<5S- 0 0 36 -4,-2.0 -3,-0.2 -3,-0.7 3,-0.1 0.518 99.9-128.5-107.9 -11.7 13.0 0.5 -17.0 15 15 A K T <5S+ 0 0 184 -4,-2.0 2,-0.3 -5,-0.3 -4,-0.1 0.885 72.7 103.3 64.3 39.8 15.2 -2.6 -16.8 16 16 A K < - 0 0 104 -5,-1.2 -1,-0.3 -6,-0.2 -2,-0.2 -0.876 57.6-156.6-142.4 173.9 13.0 -4.2 -14.1 17 17 A K S S+ 0 0 161 1,-0.4 -11,-1.5 -2,-0.3 2,-0.3 0.620 80.0 9.5-123.4 -35.0 10.4 -6.9 -13.7 18 18 A E E +A 5 0A 75 -13,-0.2 -1,-0.4 -7,-0.1 2,-0.3 -0.992 62.6 162.0-152.2 143.1 8.5 -5.8 -10.6 19 19 A E E -A 4 0A 86 -15,-1.7 -15,-2.9 -2,-0.3 2,-0.2 -0.979 29.4-116.0-155.9 163.4 8.3 -2.7 -8.3 20 20 A T E -A 3 0A 75 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.677 25.2-168.0-104.4 159.5 6.2 -1.0 -5.7 21 21 A F E -A 2 0A 15 -19,-1.7 -19,-2.4 -2,-0.2 2,-0.3 -0.940 7.2-156.1-142.6 163.4 4.4 2.3 -5.8 22 22 A N S S+ 0 0 110 -2,-0.3 3,-0.1 -21,-0.2 -2,-0.0 -0.997 70.2 33.6-145.7 138.2 2.6 4.8 -3.5 23 23 A G S S+ 0 0 73 -2,-0.3 2,-0.5 1,-0.3 -1,-0.0 0.137 85.7 109.8 107.1 -19.1 0.0 7.5 -4.1 24 24 A I + 0 0 17 1,-0.1 -1,-0.3 -22,-0.0 -3,-0.1 -0.809 23.0 152.2 -95.8 125.6 -1.8 5.7 -6.9 25 25 A S + 0 0 62 -2,-0.5 50,-1.0 1,-0.1 2,-0.3 0.286 62.5 52.6-130.2 3.2 -5.2 4.4 -6.2 26 26 A K B > S-E 74 0B 62 48,-0.2 4,-1.4 1,-0.1 48,-0.2 -0.967 73.5-127.9-140.9 156.1 -6.8 4.5 -9.6 27 27 A I H > S+ 0 0 0 46,-2.3 4,-3.3 -2,-0.3 5,-0.3 0.912 107.6 57.6 -68.7 -43.8 -5.9 3.3 -13.1 28 28 A S H > S+ 0 0 52 43,-1.5 4,-1.8 45,-0.4 -1,-0.2 0.939 113.6 38.0 -51.8 -53.6 -6.4 6.7 -14.7 29 29 A E H > S+ 0 0 58 42,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.796 114.9 57.7 -69.2 -28.8 -3.8 8.3 -12.4 30 30 A L H X S+ 0 0 3 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.951 106.9 45.4 -66.6 -50.9 -1.6 5.1 -12.7 31 31 A L H >X S+ 0 0 28 -4,-3.3 4,-1.8 1,-0.2 3,-0.5 0.946 113.4 49.2 -58.0 -51.5 -1.3 5.2 -16.5 32 32 A E H 3X S+ 0 0 112 -4,-1.8 4,-1.5 -5,-0.3 -1,-0.2 0.808 108.2 56.8 -58.8 -30.0 -0.5 9.0 -16.5 33 33 A R H 3X S+ 0 0 99 -4,-1.3 4,-3.3 2,-0.2 5,-0.3 0.864 103.8 52.2 -69.9 -37.0 2.1 8.2 -13.8 34 34 A L H > - 0 0 26 -4,-0.5 4,-1.0 -5,-0.4 3,-0.6 -0.365 42.8 -45.7 83.1-165.4 8.9 9.8 -19.6 40 40 A S H 3> S+ 0 0 87 1,-0.2 4,-3.4 2,-0.2 5,-0.4 0.804 126.1 75.6 -73.6 -30.1 8.1 10.1 -23.3 41 41 A E H 3> S+ 0 0 117 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.837 100.2 44.7 -49.6 -35.6 10.5 7.2 -24.1 42 42 A F H <> S+ 0 0 15 -3,-0.6 4,-1.4 -4,-0.3 5,-0.2 0.936 112.7 48.2 -75.4 -49.4 7.8 4.9 -22.7 43 43 A T H X S+ 0 0 29 -4,-1.0 4,-2.3 -8,-0.2 -2,-0.2 0.884 118.6 41.9 -58.7 -40.4 4.8 6.5 -24.5 44 44 A K H < S+ 0 0 148 -4,-3.4 -1,-0.2 2,-0.2 -2,-0.2 0.921 111.3 53.6 -73.3 -46.0 6.7 6.4 -27.8 45 45 A Q H < S+ 0 0 106 -4,-2.0 -1,-0.2 -5,-0.4 -2,-0.2 0.723 119.5 37.6 -61.5 -20.6 8.2 2.9 -27.3 46 46 A M H < S+ 0 0 6 -4,-1.4 2,-0.7 -5,-0.1 -2,-0.2 0.757 96.1 90.0 -99.4 -33.8 4.7 1.8 -26.7 47 47 A Y < + 0 0 106 -4,-2.3 2,-0.6 -5,-0.2 5,-0.1 -0.547 52.6 176.9 -70.3 109.8 2.9 4.0 -29.3 48 48 A D - 0 0 100 -2,-0.7 2,-0.6 3,-0.4 3,-0.2 -0.808 65.7 -23.3-119.3 89.7 2.9 2.0 -32.5 49 49 A G S S- 0 0 72 -2,-0.6 3,-0.1 1,-0.2 -2,-0.1 -0.773 122.2 -32.5 118.1 -87.9 1.0 3.9 -35.2 50 50 A N S S+ 0 0 142 -2,-0.6 2,-0.3 1,-0.5 -1,-0.2 0.527 119.2 20.6-133.3 -62.9 -1.4 6.4 -33.7 51 51 A N + 0 0 92 -3,-0.2 -1,-0.5 1,-0.1 -3,-0.4 -0.749 44.2 165.4-114.9 163.0 -2.9 5.3 -30.4 52 52 A L S >> S+ 0 0 6 -2,-0.3 3,-2.7 -5,-0.1 4,-2.0 0.488 74.0 59.8-139.3 -52.3 -1.9 2.7 -27.8 53 53 A F T 34 S+ 0 0 84 1,-0.3 -2,-0.0 2,-0.2 -22,-0.0 0.805 97.2 67.5 -55.1 -29.9 -3.8 3.2 -24.5 54 54 A K T 34 S+ 0 0 143 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.688 116.6 25.4 -64.8 -17.2 -6.9 2.6 -26.6 55 55 A N T <4 S+ 0 0 65 -3,-2.7 32,-0.3 31,-0.0 -2,-0.2 0.495 94.2 123.4-120.5 -14.4 -5.7 -1.0 -27.0 56 56 A V < - 0 0 19 -4,-2.0 2,-0.5 30,-0.1 -3,-0.0 -0.138 52.4-143.6 -50.7 143.5 -3.5 -1.2 -23.9 57 57 A I E +C 84 0A 80 27,-1.1 27,-1.9 8,-0.0 2,-0.4 -0.941 22.6 173.9-119.5 112.4 -4.4 -4.1 -21.5 58 58 A I E -C 83 0A 5 -2,-0.5 7,-1.0 25,-0.2 2,-0.6 -0.967 18.0-151.0-121.3 130.3 -4.1 -3.6 -17.8 59 59 A L E -CD 82 64A 51 23,-1.4 23,-1.5 -2,-0.4 2,-0.6 -0.873 8.3-152.6-102.9 122.8 -5.2 -6.1 -15.1 60 60 A V E S-C 81 0A 11 3,-2.7 21,-0.2 -2,-0.6 14,-0.1 -0.837 77.1 -25.1 -97.8 118.6 -6.4 -4.7 -11.8 61 61 A N S S- 0 0 48 19,-3.3 -1,-0.2 -2,-0.6 20,-0.1 0.804 133.5 -44.0 51.2 30.5 -5.9 -7.0 -8.8 62 62 A G S S+ 0 0 53 18,-0.4 2,-0.2 -3,-0.2 -1,-0.2 0.969 119.8 93.2 79.9 60.3 -6.1 -9.8 -11.3 63 63 A N S S- 0 0 80 0, 0.0 -3,-2.7 0, 0.0 -1,-0.2 -0.811 75.8-101.9-179.4 136.7 -9.0 -8.8 -13.6 64 64 A N B > -D 59 0A 66 -2,-0.2 3,-0.5 -5,-0.2 -5,-0.2 -0.412 20.1-149.1 -66.9 136.9 -9.6 -6.9 -16.8 65 65 A I G >> S+ 0 0 15 -7,-1.0 3,-1.8 1,-0.2 4,-0.7 0.808 92.1 72.7 -75.7 -30.8 -10.9 -3.3 -16.3 66 66 A T G 34 S+ 0 0 125 1,-0.3 -1,-0.2 -8,-0.2 4,-0.1 0.774 92.5 58.7 -54.4 -26.4 -12.8 -3.5 -19.6 67 67 A S G <4 S+ 0 0 89 -3,-0.5 -1,-0.3 2,-0.1 -2,-0.1 -0.051 128.6 5.3 -94.7 31.7 -15.2 -5.8 -17.7 68 68 A M T <4 S+ 0 0 140 -3,-1.8 2,-0.3 1,-0.2 -2,-0.2 -0.080 124.8 1.0-166.9 -81.4 -15.9 -3.1 -15.1 69 69 A K < - 0 0 111 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.1 -0.894 46.7-152.1-128.8 158.9 -14.5 0.4 -15.4 70 70 A G S S- 0 0 38 -2,-0.3 3,-0.3 -4,-0.1 -1,-0.2 0.860 84.4 -15.8 -91.9 -87.3 -12.4 2.2 -18.0 71 71 A L S S+ 0 0 100 1,-0.2 -43,-1.5 -44,-0.1 -42,-0.2 0.631 133.7 63.0 -95.3 -18.0 -10.3 5.1 -16.6 72 72 A D S S+ 0 0 120 -45,-0.1 -1,-0.2 -44,-0.1 2,-0.0 0.277 75.8 136.4 -88.9 10.5 -12.2 5.3 -13.3 73 73 A T - 0 0 7 -3,-0.3 -46,-2.3 -47,-0.1 -45,-0.4 -0.307 39.6-155.2 -60.6 139.4 -11.1 1.7 -12.5 74 74 A E B -E 26 0B 119 -48,-0.2 2,-0.3 -47,-0.1 -48,-0.2 -0.758 8.5-122.6-116.2 163.3 -10.0 1.3 -8.9 75 75 A I - 0 0 20 -50,-1.0 2,-0.1 -2,-0.3 6,-0.1 -0.741 22.4-121.9-105.6 154.0 -7.7 -1.2 -7.2 76 76 A K > - 0 0 141 -2,-0.3 3,-1.4 4,-0.2 -15,-0.1 -0.287 40.6 -88.8 -85.4 174.3 -8.4 -3.6 -4.3 77 77 A D T 3 S+ 0 0 153 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.792 125.2 67.9 -52.9 -28.8 -6.7 -3.8 -0.9 78 78 A D T 3 S- 0 0 109 2,-0.1 -75,-0.3 -17,-0.1 -1,-0.3 0.903 91.1-153.6 -58.9 -43.3 -4.3 -6.2 -2.6 79 79 A D < + 0 0 46 -3,-1.4 -76,-2.3 1,-0.2 2,-0.3 0.991 32.6 150.3 63.9 81.2 -2.9 -3.4 -4.8 80 80 A K E -b 3 0A 49 -78,-0.2 -19,-3.3 -4,-0.1 2,-0.4 -0.943 19.9-178.9-148.4 122.4 -1.6 -5.2 -7.9 81 81 A I E -bC 4 60A 0 -78,-2.7 -76,-2.7 -2,-0.3 2,-0.4 -0.962 7.4-162.2-124.8 140.0 -1.4 -3.9 -11.4 82 82 A D E -bC 5 59A 13 -23,-1.5 -23,-1.4 -2,-0.4 2,-0.6 -0.975 3.6-157.8-124.2 133.0 -0.1 -5.6 -14.6 83 83 A L E +bC 6 58A 1 -78,-2.1 -76,-1.5 -2,-0.4 -75,-1.0 -0.934 15.8 177.9-113.5 117.2 0.9 -4.0 -17.8 84 84 A F E - C 0 57A 78 -27,-1.9 -27,-1.1 -2,-0.6 -2,-0.0 -0.889 35.7-100.8-119.2 149.0 0.9 -6.0 -21.0 85 85 A P - 0 0 59 0, 0.0 -39,-0.0 0, 0.0 -29,-0.0 -0.493 40.1-128.5 -69.8 124.5 1.7 -5.1 -24.6 86 86 A P > - 0 0 5 0, 0.0 3,-1.1 0, 0.0 -30,-0.1 -0.239 24.5-104.9 -69.7 160.0 -1.5 -4.4 -26.7 87 87 A V T 3 S+ 0 0 136 -32,-0.3 -31,-0.1 1,-0.3 -32,-0.0 0.806 124.6 54.4 -54.7 -30.3 -2.1 -6.1 -30.1 88 88 A A T 3 S+ 0 0 26 -36,-0.2 2,-0.6 2,-0.1 -1,-0.3 0.782 96.3 77.5 -75.0 -28.0 -1.2 -2.7 -31.7 89 89 A G < 0 0 16 -3,-1.1 -42,-0.1 1,-0.2 -43,-0.1 -0.754 360.0 360.0 -89.6 118.7 2.1 -2.6 -29.8 90 90 A G 0 0 113 -2,-0.6 -1,-0.2 -44,-0.1 -2,-0.1 0.737 360.0 360.0 92.4 360.0 4.8 -4.9 -31.3