==== 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 24-OCT-06 2NNZ . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR X.AI,A.SEMESIB,A.YEE,C.H.ARROWSMITH,S.S.C.LI,W.Y.CHOY,ONTARI . 131 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7579.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 76 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 29.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 2 1.5 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 . 16 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 M 0 0 220 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 54.1 -1.1 17.7 -16.6 2 2 A G + 0 0 58 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.829 360.0 126.6 94.4 38.9 -4.1 16.9 -14.4 3 3 A E + 0 0 170 2,-0.0 2,-0.2 0, 0.0 0, 0.0 0.010 69.7 36.8-114.2 25.9 -6.7 16.0 -17.1 4 4 A R - 0 0 122 1,-0.1 4,-0.0 3,-0.0 0, 0.0 -0.596 52.3-165.8-147.3-152.2 -7.6 12.7 -15.6 5 5 A G S S+ 0 0 21 -2,-0.2 2,-1.1 24,-0.0 3,-0.3 0.159 75.5 65.6-173.7 -50.2 -8.2 10.9 -12.3 6 6 A V S S+ 0 0 83 1,-0.2 18,-0.1 18,-0.1 16,-0.0 -0.339 89.9 74.3 -90.0 53.9 -8.4 7.1 -12.4 7 7 A E + 0 0 121 -2,-1.1 2,-0.7 15,-0.0 -1,-0.2 -0.170 52.9 130.9-157.8 48.8 -4.8 6.8 -13.5 8 8 A M + 0 0 27 15,-1.2 2,-0.3 -3,-0.3 28,-0.0 -0.797 27.9 170.2-112.6 90.2 -2.5 7.5 -10.5 9 9 A R - 0 0 71 -2,-0.7 2,-0.3 13,-0.2 13,-0.3 -0.779 11.5-165.9-102.4 145.1 0.1 4.7 -10.2 10 10 A L E -A 21 0A 9 11,-2.5 11,-1.7 -2,-0.3 2,-0.4 -0.811 15.1-125.7-123.3 164.2 3.0 4.7 -7.8 11 11 A R E -AB 20 129A 50 118,-2.3 118,-2.4 -2,-0.3 2,-0.3 -0.877 19.4-178.1-113.5 144.9 6.2 2.7 -7.5 12 12 A I E -AB 19 128A 15 7,-1.3 7,-1.1 -2,-0.4 2,-0.2 -0.844 8.9-175.3-145.3 102.2 7.5 0.8 -4.5 13 13 A R E -AB 18 127A 119 114,-1.1 114,-1.0 -2,-0.3 2,-0.4 -0.661 7.0-159.9 -99.8 156.2 10.8 -1.1 -4.6 14 14 A F E > -AB 17 126A 12 3,-3.1 3,-2.9 -2,-0.2 112,-0.1 -0.995 32.0-117.4-135.9 138.9 12.5 -3.3 -2.0 15 15 A E T 3 S+ 0 0 136 110,-0.6 3,-0.1 -2,-0.4 111,-0.1 0.753 121.4 24.8 -43.8 -29.1 16.1 -4.4 -1.7 16 16 A S T 3 S+ 0 0 67 1,-0.2 -1,-0.3 105,-0.1 2,-0.3 0.094 131.0 27.6-126.0 21.8 14.9 -7.9 -2.2 17 17 A A E < -A 14 0A 21 -3,-2.9 -3,-3.1 98,-0.0 2,-0.3 -0.936 55.4-156.3-176.5 153.3 11.6 -7.3 -4.2 18 18 A E E +A 13 0A 112 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.993 17.0 159.6-140.9 146.6 9.7 -5.0 -6.5 19 19 A C E -A 12 0A 4 -7,-1.1 -7,-1.3 -2,-0.3 2,-0.3 -0.970 23.5-139.4-164.2 149.0 6.1 -4.3 -7.3 20 20 A E E -A 11 0A 47 -2,-0.3 2,-0.3 92,-0.2 91,-0.3 -0.799 16.7-174.1-113.3 155.7 3.8 -1.7 -8.9 21 21 A V E -A 10 0A 13 -11,-1.7 -11,-2.5 -2,-0.3 89,-0.2 -0.994 10.1-150.0-150.8 142.1 0.4 -0.5 -7.8 22 22 A E - 0 0 52 87,-1.6 2,-0.3 -2,-0.3 -13,-0.2 -0.384 13.7-143.6-100.6-178.8 -2.3 1.9 -9.2 23 23 A L - 0 0 1 85,-0.2 -15,-1.2 -2,-0.1 2,-0.3 -0.998 4.8-155.1-150.9 149.4 -4.8 4.1 -7.3 24 24 A Y > - 0 0 96 82,-0.4 3,-1.4 -2,-0.3 4,-0.3 -0.936 31.7-118.0-126.4 148.0 -8.4 5.3 -7.8 25 25 A E T 3 S+ 0 0 93 -2,-0.3 5,-0.1 1,-0.3 7,-0.1 0.568 89.3 104.7 -58.2 -8.9 -10.3 8.3 -6.4 26 26 A E T 3 S+ 0 0 107 1,-0.2 -1,-0.3 2,-0.1 81,-0.1 0.782 85.5 44.1 -45.6 -27.7 -12.6 5.9 -4.6 27 27 A W S < S- 0 0 2 -3,-1.4 -1,-0.2 79,-0.2 -2,-0.2 0.955 132.1 -73.7 -81.6 -56.3 -10.6 6.9 -1.5 28 28 A A >> - 0 0 5 -4,-0.3 4,-2.2 2,-0.1 3,-0.7 -0.259 21.9-130.9 154.9 114.9 -10.5 10.7 -2.1 29 29 A P H 3> S+ 0 0 70 0, 0.0 4,-0.9 0, 0.0 -3,-0.1 0.815 108.5 61.8 -46.4 -35.2 -8.5 12.9 -4.5 30 30 A E H >4 S+ 0 0 130 2,-0.2 3,-0.8 1,-0.2 4,-0.5 0.951 107.6 39.5 -58.8 -53.5 -7.6 15.1 -1.5 31 31 A T H X> S+ 0 0 5 -3,-0.7 3,-2.2 1,-0.2 4,-1.1 0.928 106.1 65.4 -63.5 -45.1 -5.7 12.3 0.3 32 32 A V H 3X S+ 0 0 15 -4,-2.2 4,-2.1 1,-0.3 -1,-0.2 0.774 91.0 68.5 -47.4 -28.4 -4.2 11.0 -2.9 33 33 A R H S+ 0 0 19 -3,-2.2 4,-1.4 -4,-0.5 -1,-0.2 0.934 107.4 51.2 -65.1 -46.9 -0.3 13.4 -0.0 35 35 A I H >< S+ 0 0 22 -4,-1.1 3,-1.0 1,-0.3 -2,-0.2 0.949 112.9 45.3 -55.1 -51.3 0.8 10.1 -1.5 36 36 A A H >< S+ 0 0 29 -4,-2.1 3,-0.6 1,-0.3 -1,-0.3 0.797 108.8 58.3 -63.0 -27.8 1.9 11.9 -4.7 37 37 A D H 3< S+ 0 0 118 -4,-1.5 2,-0.5 1,-0.3 -1,-0.3 0.771 97.8 62.7 -71.9 -25.3 3.6 14.5 -2.5 38 38 A A T << S+ 0 0 9 -4,-1.4 -1,-0.3 -3,-1.0 3,-0.2 -0.314 74.4 150.5 -96.2 49.6 5.7 11.7 -0.9 39 39 A L < + 0 0 66 -3,-0.6 89,-0.2 -2,-0.5 90,-0.1 0.303 62.2 3.2 -61.9-160.2 7.5 10.7 -4.1 40 40 A P S S+ 0 0 84 0, 0.0 2,-0.3 0, 0.0 89,-0.2 0.082 89.3 145.6 -29.2 107.1 11.1 9.2 -3.9 41 41 A I E -C 128 0A 65 87,-1.1 87,-1.4 -3,-0.2 2,-0.3 -0.988 49.9-107.9-150.0 150.2 11.7 9.1 -0.1 42 42 A K E +C 127 0A 174 -2,-0.3 2,-0.3 85,-0.2 85,-0.2 -0.652 40.4 167.6 -85.8 136.6 13.5 6.7 2.3 43 43 A S E -C 126 0A 8 83,-3.2 83,-1.1 -2,-0.3 2,-0.5 -0.993 31.6-125.6-146.3 149.1 11.5 4.4 4.5 44 44 A T E -C 125 0A 106 11,-0.5 11,-0.5 -2,-0.3 2,-0.3 -0.858 25.6-136.5-101.8 125.6 12.2 1.4 6.8 45 45 A A E -C 124 0A 2 79,-2.3 79,-0.7 -2,-0.5 2,-0.5 -0.629 9.7-152.5 -83.9 136.0 10.2 -1.7 6.2 46 46 A N E -D 53 0B 72 7,-0.7 7,-1.0 -2,-0.3 2,-0.3 -0.916 15.7-133.8-108.3 125.8 8.8 -3.7 9.1 47 47 A R E +D 52 0B 131 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.649 33.7 159.6 -85.4 135.4 8.3 -7.5 8.5 48 48 A W E > -D 51 0B 112 3,-1.6 3,-4.1 -2,-0.3 -2,-0.0 -0.990 56.0 -60.0-150.9 149.0 5.0 -9.1 9.6 49 49 A G T 3 S- 0 0 25 1,-0.3 40,-0.1 -2,-0.3 3,-0.1 0.011 115.4 -35.3 -32.9 102.8 3.2 -12.4 8.8 50 50 A D T 3 S+ 0 0 69 68,-0.3 38,-0.9 1,-0.1 2,-0.3 0.778 128.0 101.8 44.2 30.9 2.6 -11.9 5.0 51 51 A E E < -DE 48 87B 5 -3,-4.1 -3,-1.6 67,-0.2 2,-0.4 -0.999 50.7-170.7-144.0 142.9 2.2 -8.2 5.8 52 52 A I E +DE 47 86B 5 34,-0.5 34,-1.1 -2,-0.3 2,-0.4 -0.976 6.6 174.2-139.9 124.8 4.4 -5.2 5.5 53 53 A Y E +DE 46 85B 71 -7,-1.0 -7,-0.7 -2,-0.4 2,-0.3 -0.992 4.3 173.4-133.8 127.8 3.9 -1.7 6.8 54 54 A F E - E 0 84B 6 30,-1.1 30,-1.1 -2,-0.4 2,-0.3 -0.978 25.4-128.8-133.6 146.5 6.4 1.2 6.7 55 55 A T - 0 0 84 -11,-0.5 -11,-0.5 -2,-0.3 28,-0.1 -0.695 14.2-173.8 -94.0 145.2 6.1 4.9 7.6 56 56 A T - 0 0 5 26,-0.5 3,-0.1 -2,-0.3 -1,-0.1 0.293 50.1-107.7-119.0 6.7 7.2 7.6 5.1 57 57 A Q S S+ 0 0 184 1,-0.3 2,-0.7 25,-0.1 -2,-0.1 0.310 80.9 128.7 83.0 -8.1 6.8 10.7 7.4 58 58 A V - 0 0 37 24,-0.2 2,-0.9 -20,-0.1 -1,-0.3 -0.714 45.2-160.0 -84.3 115.8 3.7 11.8 5.5 59 59 A A + 0 0 78 -2,-0.7 2,-0.5 -3,-0.1 23,-0.1 -0.779 26.2 153.8-101.3 94.6 0.9 12.4 7.9 60 60 A V + 0 0 22 -2,-0.9 2,-0.4 19,-0.1 22,-0.1 -0.934 10.6 160.0-123.2 106.6 -2.4 12.3 6.1 61 61 A E + 0 0 110 -2,-0.5 2,-0.3 20,-0.1 18,-0.0 -0.991 2.5 143.9-132.4 136.4 -5.5 11.3 8.2 62 62 A K - 0 0 89 -2,-0.4 2,-1.0 2,-0.1 -2,-0.0 -0.979 50.6-101.8-160.3 161.7 -9.2 11.8 7.6 63 63 A E S S+ 0 0 189 -2,-0.3 2,-0.3 2,-0.1 -2,-0.0 -0.765 74.6 100.4 -96.3 96.3 -12.5 10.1 8.1 64 64 A E S S- 0 0 90 -2,-1.0 2,-2.2 -36,-0.0 -2,-0.1 -0.942 79.1 -6.1-170.4 149.9 -13.6 8.6 4.8 65 65 A N + 0 0 60 -2,-0.3 39,-0.1 1,-0.2 -38,-0.1 -0.382 66.5 163.0 63.3 -81.7 -13.6 5.3 2.9 66 66 A S - 0 0 37 -2,-2.2 39,-0.3 37,-0.2 2,-0.2 0.845 19.2-170.9 30.0 83.8 -11.7 3.4 5.6 67 67 A K B -F 104 0B 27 37,-2.2 37,-3.2 36,-0.1 36,-0.1 -0.653 23.3-167.8 -99.5 157.1 -12.5 -0.3 4.6 68 68 A D + 0 0 86 -2,-0.2 33,-0.4 35,-0.2 2,-0.4 0.425 67.2 63.7-121.0 -4.2 -11.7 -3.4 6.6 69 69 A V + 0 0 105 35,-0.1 2,-0.3 30,-0.1 -1,-0.1 -0.971 54.1 154.4-127.6 141.2 -12.3 -6.2 4.1 70 70 A V - 0 0 26 28,-0.4 2,-0.3 -2,-0.4 28,-0.2 -0.990 35.5-110.9-158.8 157.5 -10.6 -7.0 0.7 71 71 A E > - 0 0 147 -2,-0.3 3,-2.0 1,-0.1 -2,-0.0 -0.655 51.0 -78.7 -95.6 150.8 -9.9 -9.8 -1.7 72 72 A L T 3 S+ 0 0 128 -2,-0.3 -1,-0.1 1,-0.2 16,-0.1 -0.143 116.1 31.2 -44.8 126.5 -6.5 -11.4 -2.4 73 73 A G T 3 S+ 0 0 18 14,-0.5 37,-1.5 1,-0.4 -1,-0.2 0.063 89.5 112.3 112.4 -27.0 -4.5 -9.2 -4.8 74 74 A D E < -G 109 0B 10 -3,-2.0 -1,-0.4 35,-0.2 2,-0.3 -0.454 55.0-139.5 -82.5 156.2 -5.8 -5.7 -3.8 75 75 A V E -G 108 0B 6 33,-2.9 33,-0.7 -2,-0.1 2,-0.3 -0.835 20.3-180.0-113.5 151.6 -3.7 -3.1 -2.1 76 76 A A E - H 0 85B 0 9,-1.1 9,-1.5 -2,-0.3 2,-0.5 -0.997 24.1-126.9-152.1 153.3 -4.7 -0.6 0.7 77 77 A Y E -GH 105 84B 8 28,-2.1 28,-2.0 -2,-0.3 2,-0.8 -0.864 28.1-122.2-104.0 131.7 -3.3 2.2 2.8 78 78 A W E > -GH 104 83B 69 5,-2.7 5,-1.5 -2,-0.5 4,-0.3 -0.602 25.4-172.4 -74.4 109.1 -3.5 2.1 6.6 79 79 A I T > 5S+ 0 0 8 -2,-0.8 3,-3.2 24,-0.7 2,-2.2 1.000 74.3 63.0 -65.3 -69.2 -5.4 5.2 7.7 80 80 A P T 3 5S+ 0 0 60 0, 0.0 -1,-0.2 0, 0.0 22,-0.1 -0.307 122.4 19.2 -58.8 80.4 -5.0 4.9 11.5 81 81 A G T 3 5S- 0 0 32 -2,-2.2 -2,-0.2 -21,-0.1 3,-0.1 0.245 102.3-115.5 139.5 -9.3 -1.3 5.3 11.4 82 82 A K T < 5S+ 0 0 61 -3,-3.2 -26,-0.5 -4,-0.3 2,-0.4 0.864 71.7 138.5 50.1 39.6 -0.6 6.8 7.9 83 83 A A E < - H 0 78B 8 -5,-1.5 -5,-2.7 -28,-0.1 2,-0.2 -0.951 49.5-135.9-120.0 136.4 1.2 3.6 6.9 84 84 A I E -EH 54 77B 18 -30,-1.1 -30,-1.1 -2,-0.4 2,-0.3 -0.608 22.7-169.5 -87.5 147.0 1.0 1.7 3.6 85 85 A C E -EH 53 76B 7 -9,-1.5 -9,-1.1 -2,-0.2 -32,-0.2 -0.993 14.2-139.5-143.1 135.9 0.6 -2.1 3.6 86 86 A L E -E 52 0B 20 -34,-1.1 -34,-0.5 -2,-0.3 2,-0.4 -0.460 15.5-145.5 -86.1 160.8 0.9 -4.9 1.0 87 87 A F E +E 51 0B 8 -2,-0.1 -14,-0.5 -36,-0.1 -36,-0.1 -0.934 44.9 128.6-136.3 114.7 -1.5 -7.9 0.8 88 88 A F S S- 0 0 58 -38,-0.9 2,-0.3 -2,-0.4 -1,-0.1 -0.033 79.5 -22.5-150.2 31.9 -0.5 -11.3 -0.3 89 89 A G S S+ 0 0 16 1,-0.2 -16,-0.1 -39,-0.2 -39,-0.0 -0.992 100.6 1.1 159.5-153.1 -1.7 -13.5 2.5 90 90 A K - 0 0 64 -2,-0.3 -2,-0.3 1,-0.1 -1,-0.2 0.259 55.2-162.9 -52.6-173.6 -2.6 -13.5 6.2 91 91 A T > - 0 0 0 6,-0.2 3,-1.1 -4,-0.1 4,-0.1 -0.886 50.0 -53.3-159.3-175.8 -2.5 -10.5 8.4 92 92 A P T 3 S+ 0 0 54 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.743 139.5 26.7 -42.6 -25.2 -2.5 -9.4 12.2 93 93 A I T 3 S+ 0 0 76 6,-0.7 6,-0.4 1,-0.1 4,-0.3 -0.519 71.5 153.1-142.0 72.1 -5.6 -11.7 12.4 94 94 A S X + 0 0 41 -3,-1.1 3,-1.4 1,-0.2 2,-1.4 0.997 21.9 132.8 -60.6 -75.3 -5.6 -14.4 9.8 95 95 A D T 3 S- 0 0 144 1,-0.3 -1,-0.2 -4,-0.1 3,-0.1 -0.407 95.0 -22.1 61.3 -91.1 -7.7 -17.1 11.5 96 96 A D T 3 S+ 0 0 125 -2,-1.4 -1,-0.3 -3,-0.3 2,-0.2 0.627 135.8 17.4-119.5 -30.7 -10.1 -17.9 8.7 97 97 A K S < S- 0 0 141 -3,-1.4 2,-0.6 -4,-0.3 -6,-0.2 -0.453 89.5 -83.5-125.6-161.9 -9.9 -14.8 6.5 98 98 A I - 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