==== 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/DNA 29-JUN-09 3I2O . COMPND 2 MOLECULE: ALPHA-KETOGLUTARATE-DEPENDENT DIOXYGENASE ALKB; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR B.YU,J.F.HUNT . 199 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 29.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 15 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 4 1 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 15 A L 0 0 146 0, 0.0 2,-0.3 0, 0.0 151,-0.0 0.000 360.0 360.0 360.0 -67.6 54.5 23.7 0.0 2 16 A A > - 0 0 14 3,-0.2 3,-1.9 169,-0.0 2,-0.2 -0.822 360.0-136.3-144.5 97.6 50.8 24.5 0.6 3 17 A A T 3 S+ 0 0 53 -2,-0.3 165,-2.3 1,-0.3 164,-0.2 -0.354 89.0 10.7 -59.3 119.4 50.1 27.8 2.5 4 18 A G T 3 S+ 0 0 37 1,-0.3 161,-0.9 163,-0.2 2,-0.4 0.232 97.1 124.1 96.3 -13.1 47.3 27.3 5.0 5 19 A A E < -A 164 0A 22 -3,-1.9 2,-0.6 159,-0.2 -1,-0.3 -0.679 44.1-162.3 -85.9 130.8 47.3 23.5 4.8 6 20 A V E -A 163 0A 48 157,-2.0 157,-2.5 -2,-0.4 2,-0.6 -0.964 10.0-159.4-113.8 108.1 47.8 21.5 7.9 7 21 A I E -A 162 0A 42 -2,-0.6 2,-0.6 155,-0.2 155,-0.2 -0.842 11.3-177.2 -95.0 119.5 48.7 17.9 7.0 8 22 A L E > -A 161 0A 38 153,-3.3 153,-2.2 -2,-0.6 3,-1.4 -0.804 16.3-155.2-117.6 84.8 48.1 15.3 9.7 9 23 A R T 3 S- 0 0 140 -2,-0.6 151,-0.2 1,-0.2 150,-0.1 -0.401 74.4 -0.6 -67.5 131.3 49.4 12.0 8.3 10 24 A R T > S+ 0 0 141 147,-0.2 3,-1.5 -2,-0.1 4,-0.3 0.559 87.9 134.2 64.7 18.1 47.8 8.8 9.8 11 25 A F T < S+ 0 0 54 -3,-1.4 3,-0.4 1,-0.3 4,-0.2 0.830 72.2 46.6 -63.3 -35.5 45.7 11.0 12.2 12 26 A A T 3> S+ 0 0 0 147,-3.0 4,-1.5 -4,-0.3 -1,-0.3 0.218 79.0 108.4 -94.6 15.1 42.5 8.9 11.4 13 27 A F T <4 S+ 0 0 97 -3,-1.5 4,-0.4 146,-0.3 3,-0.2 0.895 80.7 45.9 -56.9 -47.4 44.2 5.5 11.8 14 28 A N T 4 S+ 0 0 149 -3,-0.4 4,-0.3 -4,-0.3 3,-0.2 0.821 117.4 43.3 -68.1 -31.7 42.5 4.7 15.1 15 29 A A T >> S+ 0 0 25 -4,-0.2 4,-2.5 1,-0.2 3,-0.5 0.634 88.5 97.4 -88.9 -13.9 39.1 5.8 13.8 16 30 A A H 3X S+ 0 0 1 -4,-1.5 4,-2.2 1,-0.2 5,-0.2 0.791 80.0 48.4 -43.3 -52.3 39.5 4.0 10.4 17 31 A E H 3> S+ 0 0 115 -4,-0.4 4,-1.7 -3,-0.2 -1,-0.2 0.890 116.2 43.9 -61.4 -41.1 37.6 0.8 11.1 18 32 A Q H <> S+ 0 0 76 -3,-0.5 4,-2.2 -4,-0.3 -1,-0.2 0.864 111.1 54.5 -73.0 -35.8 34.6 2.6 12.6 19 33 A L H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.894 109.5 48.3 -64.6 -37.2 34.6 5.2 9.8 20 34 A I H X S+ 0 0 14 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.880 109.7 51.4 -71.2 -36.9 34.4 2.4 7.2 21 35 A R H X S+ 0 0 133 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.904 112.6 47.4 -66.0 -37.6 31.5 0.7 9.1 22 36 A D H X S+ 0 0 26 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.775 106.2 56.3 -75.4 -26.7 29.8 4.1 9.1 23 37 A I H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.926 108.9 48.6 -68.0 -42.6 30.5 4.7 5.3 24 38 A N H X S+ 0 0 88 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.888 111.5 49.5 -63.1 -37.7 28.7 1.3 4.7 25 39 A D H X S+ 0 0 99 -4,-1.6 4,-0.5 2,-0.2 -1,-0.2 0.871 112.5 46.8 -69.2 -39.9 25.8 2.4 6.9 26 40 A V H >X S+ 0 0 2 -4,-2.1 4,-2.8 1,-0.2 3,-1.3 0.931 110.6 53.8 -67.0 -43.2 25.5 5.8 5.1 27 41 A A H 3< S+ 0 0 21 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.695 98.2 63.6 -66.0 -21.1 25.7 3.9 1.7 28 42 A S H 3< S+ 0 0 91 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.738 115.2 31.4 -76.3 -21.5 22.8 1.7 2.7 29 43 A Q H << S+ 0 0 79 -3,-1.3 -2,-0.2 -4,-0.5 -1,-0.1 0.817 136.0 24.4 -99.9 -48.0 20.5 4.7 2.8 30 44 A S S < S- 0 0 0 -4,-2.8 -1,-0.3 -5,-0.1 -2,-0.1 -0.900 91.0-144.2-121.6 97.7 22.1 6.9 0.1 31 45 A P - 0 0 50 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.127 23.5 -97.0 -61.1 154.7 24.0 4.6 -2.3 32 46 A F + 0 0 28 -5,-0.1 2,-0.3 16,-0.1 16,-0.2 -0.548 51.9 178.5 -70.1 131.7 27.3 5.5 -4.0 33 47 A R B -B 47 0A 23 14,-2.2 14,-3.1 -2,-0.2 2,-1.0 -0.983 36.3-119.1-137.1 151.2 26.5 6.8 -7.4 34 48 A Q - 0 0 103 -2,-0.3 12,-0.2 12,-0.2 10,-0.1 -0.829 41.6-138.4 -92.8 101.1 28.6 8.1 -10.3 35 49 A M - 0 0 10 -2,-1.0 8,-2.8 10,-0.4 2,-0.6 -0.304 6.0-125.6 -62.5 145.6 27.3 11.6 -10.7 36 50 A V B -H 42 0B 73 6,-0.2 6,-0.2 21,-0.1 -1,-0.1 -0.863 21.3-133.7 -97.8 120.2 26.7 13.2 -14.1 37 51 A T > - 0 0 33 4,-2.8 3,-3.1 -2,-0.6 4,-0.4 -0.321 33.9 -98.9 -67.7 151.1 28.4 16.5 -14.7 38 52 A P T 3 S+ 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.697 123.2 61.7 -46.7 -20.8 26.2 19.4 -16.2 39 53 A G T 3 S- 0 0 63 2,-0.1 20,-0.1 1,-0.0 -2,-0.0 0.501 124.0-100.0 -84.2 -7.3 27.7 18.5 -19.6 40 54 A G S < S+ 0 0 52 -3,-3.1 2,-0.5 1,-0.3 19,-0.0 0.592 78.2 131.1 99.8 15.8 26.3 15.0 -19.6 41 55 A Y - 0 0 181 -4,-0.4 -4,-2.8 0, 0.0 2,-0.3 -0.881 53.5-129.0-110.1 131.5 29.4 13.0 -18.5 42 56 A T B -H 36 0B 91 -2,-0.5 -6,-0.2 -6,-0.2 -7,-0.1 -0.564 26.1-125.8 -76.8 129.2 29.5 10.4 -15.7 43 57 A M - 0 0 28 -8,-2.8 71,-0.1 -2,-0.3 -1,-0.1 -0.416 5.1-138.3 -72.2 148.1 32.3 10.9 -13.1 44 58 A S S S+ 0 0 47 69,-0.4 65,-0.4 -2,-0.1 2,-0.3 0.777 86.0 80.9 -77.8 -27.8 34.7 8.0 -12.5 45 59 A V S S- 0 0 0 68,-0.5 -10,-0.4 63,-0.1 2,-0.4 -0.618 80.0-137.5 -79.6 134.4 34.6 8.7 -8.7 46 60 A A E - C 0 107A 4 61,-2.4 61,-3.2 -2,-0.3 2,-0.3 -0.788 29.0-168.5 -92.8 136.7 31.5 7.3 -7.0 47 61 A M E +BC 33 106A 5 -14,-3.1 -14,-2.2 -2,-0.4 2,-0.3 -0.878 23.8 156.2-131.0 160.5 29.9 9.7 -4.5 48 62 A T E - C 0 105A 0 57,-1.4 57,-3.2 -2,-0.3 2,-0.3 -0.907 23.4-140.1-162.1 172.8 27.4 10.0 -1.7 49 63 A N E - C 0 104A 0 -2,-0.3 2,-0.3 55,-0.2 55,-0.2 -0.949 8.4-163.4-141.8 164.3 26.9 12.4 1.3 50 64 A C E + C 0 103A 0 53,-1.6 53,-1.5 -2,-0.3 27,-0.2 -0.966 52.3 52.1-144.9 151.7 25.9 12.5 4.9 51 65 A G S S- 0 0 8 25,-3.1 24,-0.2 -2,-0.3 51,-0.2 -0.610 102.9 -52.7 114.1-173.9 24.9 15.4 7.1 52 66 A H S S+ 0 0 159 49,-0.4 2,-0.3 -2,-0.2 23,-0.2 0.849 122.9 33.6 -68.5 -36.9 22.3 18.2 6.6 53 67 A L B -d 102 0A 32 48,-2.6 50,-0.6 -3,-0.2 2,-0.4 -0.858 69.1-159.3-121.3 155.6 23.5 19.2 3.2 54 68 A G E -I 65 0C 0 11,-1.6 11,-2.2 -2,-0.3 2,-0.3 -0.997 22.0-117.9-140.9 137.1 25.1 17.3 0.4 55 69 A W E +I 64 0C 23 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.528 45.2 165.8 -72.3 128.7 27.3 18.1 -2.6 56 70 A T E -I 63 0C 3 7,-2.5 7,-2.2 -2,-0.3 2,-0.3 -0.930 36.7-120.2-140.9 163.1 25.5 17.3 -5.9 57 71 A T E -I 62 0C 24 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.749 34.9-179.1-100.7 149.4 25.7 17.9 -9.7 58 72 A H E > -I 61 0C 74 3,-3.2 3,-0.6 -2,-0.3 0, 0.0 -0.850 43.2 -96.5-140.0 175.4 22.7 19.6 -11.3 59 73 A R T 3 S+ 0 0 207 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.869 124.7 40.3 -65.0 -37.6 21.7 20.7 -14.8 60 74 A Q T 3 S- 0 0 198 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.366 129.4 -78.3 -94.4 3.1 22.8 24.3 -14.2 61 75 A G E < S-I 58 0C 18 -3,-0.6 -3,-3.2 2,-0.0 2,-0.4 -0.990 72.9 -24.8 145.2-138.5 26.0 23.4 -12.3 62 76 A Y E +I 57 0C 107 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.936 58.5 156.4-119.5 143.9 27.0 22.2 -8.8 63 77 A L E -I 56 0C 72 -7,-2.2 -7,-2.5 -2,-0.4 2,-0.4 -0.983 40.7-107.5-159.2 165.1 25.1 22.8 -5.6 64 78 A Y E -I 55 0C 32 -2,-0.3 -9,-0.2 -9,-0.2 -11,-0.0 -0.837 37.3-176.3 -98.0 134.6 24.4 21.7 -2.0 65 79 A S E -I 54 0C 29 -11,-2.2 -11,-1.6 -2,-0.4 10,-0.1 -0.990 32.7-145.7-134.2 142.1 21.0 20.1 -1.4 66 80 A P S S+ 0 0 74 0, 0.0 9,-0.9 0, 0.0 2,-0.4 0.573 89.6 66.5 -79.4 -7.2 19.3 18.8 1.7 67 81 A I B S-J 74 0D 65 7,-0.2 -13,-0.1 -13,-0.1 -15,-0.0 -0.930 86.6-122.9-118.7 138.3 17.8 16.1 -0.4 68 82 A D > - 0 0 0 5,-3.0 4,-2.5 -2,-0.4 5,-0.3 -0.689 19.2-148.2 -76.4 116.9 19.5 13.2 -2.3 69 83 A P T 4 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -13,-0.0 0.698 94.0 46.8 -63.8 -17.9 18.5 13.6 -6.0 70 84 A Q T 4 S+ 0 0 106 3,-0.1 -40,-0.0 -39,-0.1 -2,-0.0 0.926 124.3 26.7 -87.4 -53.0 18.6 9.8 -6.5 71 85 A T T 4 S- 0 0 40 2,-0.2 -1,-0.1 -40,-0.1 -41,-0.0 0.654 92.0-140.0 -82.6 -19.8 16.6 8.5 -3.5 72 86 A N S < S+ 0 0 121 -4,-2.5 3,-0.1 1,-0.3 -1,-0.0 0.581 70.6 107.4 64.3 18.2 14.6 11.8 -3.2 73 87 A K S S- 0 0 110 -5,-0.3 -5,-3.0 1,-0.2 -1,-0.3 -0.659 83.3 -82.8-114.3 164.4 15.0 11.3 0.6 74 88 A P B -J 67 0D 77 0, 0.0 -7,-0.2 0, 0.0 -1,-0.2 -0.281 52.4 -97.6 -67.1 162.4 17.3 13.4 2.9 75 89 A W - 0 0 10 -9,-0.9 -25,-0.2 -23,-0.2 3,-0.1 -0.432 53.1 -88.5 -72.8 154.3 21.0 12.4 3.1 76 90 A P - 0 0 5 0, 0.0 -25,-3.1 0, 0.0 -1,-0.1 -0.246 53.4 -91.2 -61.9 156.9 21.8 10.2 6.1 77 91 A A - 0 0 82 -27,-0.2 -25,-0.0 1,-0.1 0, 0.0 -0.276 48.5 -91.0 -66.4 155.5 22.7 12.0 9.4 78 92 A M - 0 0 37 -28,-0.2 -1,-0.1 -3,-0.1 -26,-0.0 -0.603 50.2-121.1 -67.8 117.4 26.4 12.8 10.0 79 93 A P > - 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