==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-AUG-07 2R0P . COMPND 2 MOLECULE: REBC; . SOURCE 2 ORGANISM_SCIENTIFIC: LECHEVALIERIA AEROCOLONIGENES; . AUTHOR K.S.RYAN,C.L.DRENNAN . 512 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22459.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 357 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 15.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 48 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 4 0 1 2 2 0 0 2 0 0 0 1 0 0 0 0 0 1 0 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 2 0 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 PARALLEL BRIDGES PER LADDER . 3 4 1 3 1 1 2 0 1 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 . 2 1 1 0 0 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 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 0 160 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 94.0 31.9 19.0 8.3 2 2 A N - 0 0 104 1,-0.1 160,-0.1 3,-0.0 3,-0.1 -0.516 360.0-139.0 -80.9 143.8 28.6 17.3 8.9 3 3 A A - 0 0 78 -2,-0.2 159,-0.1 1,-0.2 -1,-0.1 -0.487 40.0 -67.0 -96.2 167.5 26.3 18.3 11.7 4 4 A P - 0 0 71 0, 0.0 2,-0.4 0, 0.0 159,-0.2 -0.240 50.0-129.0 -55.7 136.6 24.2 16.0 14.0 5 5 A I E -a 163 0A 68 157,-2.4 159,-3.8 -3,-0.1 2,-0.4 -0.718 20.4-149.2 -90.1 137.6 21.4 14.1 12.3 6 6 A E E +a 164 0A 167 -2,-0.4 2,-0.3 157,-0.2 159,-0.2 -0.907 27.5 149.0-114.5 134.7 17.9 14.3 13.9 7 7 A T E -a 165 0A 17 157,-1.7 159,-1.0 -2,-0.4 160,-0.3 -0.978 46.5-125.3-155.8 149.3 15.2 11.7 13.8 8 8 A D E S+ 0 0 52 -2,-0.3 159,-1.2 1,-0.2 158,-0.5 0.928 97.1 21.7 -66.1 -44.8 12.4 10.8 16.2 9 9 A V E -ab 167 32A 0 22,-1.6 24,-1.8 157,-0.2 2,-0.6 -0.982 63.7-160.7-131.5 126.4 13.4 7.1 16.6 10 10 A L E -ab 168 33A 2 157,-2.8 159,-2.7 -2,-0.4 2,-0.7 -0.917 13.9-154.4-103.5 120.5 16.8 5.5 15.9 11 11 A I E -ab 169 34A 0 22,-3.6 24,-2.6 -2,-0.6 2,-0.9 -0.860 2.6-152.2-100.3 116.0 16.5 1.8 15.4 12 12 A L E +ab 170 35A 20 157,-2.8 159,-2.9 -2,-0.7 24,-0.1 -0.769 67.6 29.5 -89.7 103.4 19.7 -0.1 16.3 13 13 A G - 0 0 7 22,-2.3 23,-0.2 -2,-0.9 159,-0.1 0.289 59.0-143.0 116.5 119.8 19.7 -3.3 14.2 14 14 A G + 0 0 19 4,-0.1 22,-0.1 20,-0.1 -1,-0.1 -0.101 58.9 124.3-101.1 33.8 18.3 -4.1 10.8 15 15 A G S > S- 0 0 28 156,-0.5 4,-2.5 1,-0.0 5,-0.3 -0.172 84.9 -78.4 -79.4-176.6 17.3 -7.7 11.6 16 16 A P H > S+ 0 0 27 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.919 132.6 44.6 -49.2 -51.0 13.7 -8.9 11.0 17 17 A V H > S+ 0 0 15 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.912 112.4 50.0 -63.3 -45.6 12.5 -7.3 14.2 18 18 A G H > S+ 0 0 1 153,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.888 113.2 47.8 -61.1 -36.8 14.2 -4.0 13.7 19 19 A M H X S+ 0 0 8 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.886 108.4 54.9 -71.1 -36.1 12.8 -3.9 10.2 20 20 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.917 108.4 48.8 -61.7 -43.1 9.4 -4.7 11.5 21 21 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.906 109.2 51.8 -64.0 -41.5 9.6 -1.8 13.9 22 22 A A H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.916 108.7 52.3 -61.1 -41.4 10.7 0.5 11.0 23 23 A L H X S+ 0 0 10 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.917 110.6 46.4 -61.4 -44.0 7.7 -0.7 9.0 24 24 A D H X S+ 0 0 0 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.909 112.7 50.2 -65.4 -41.1 5.3 0.1 11.8 25 25 A L H <>S+ 0 0 0 -4,-2.6 5,-2.9 2,-0.2 -2,-0.2 0.899 112.2 47.2 -65.4 -38.4 6.9 3.5 12.4 26 26 A A H ><5S+ 0 0 41 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.930 109.7 54.1 -65.3 -44.9 6.6 4.3 8.6 27 27 A H H 3<5S+ 0 0 72 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.751 113.4 42.9 -59.3 -25.8 3.0 3.1 8.7 28 28 A R T 3<5S- 0 0 22 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.312 114.8-117.2-103.2 5.7 2.4 5.6 11.6 29 29 A Q T < 5 + 0 0 158 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.866 60.9 150.3 60.1 42.8 4.4 8.4 9.9 30 30 A V < - 0 0 4 -5,-2.9 2,-0.2 -6,-0.1 -1,-0.2 -0.893 50.2-117.9-104.7 132.3 7.0 8.6 12.6 31 31 A G + 0 0 19 -2,-0.5 -22,-1.6 -21,-0.0 2,-0.3 -0.528 51.1 152.0 -70.1 133.3 10.5 9.8 11.5 32 32 A H E -b 9 0A 4 -2,-0.2 2,-0.3 -24,-0.2 -22,-0.2 -0.936 32.8-149.0-153.4 173.8 13.0 7.1 12.1 33 33 A L E -b 10 0A 12 -24,-1.8 -22,-3.6 -2,-0.3 2,-0.5 -0.986 9.8-147.8-150.9 140.6 16.3 5.7 10.9 34 34 A V E -bc 11 132A 0 97,-3.2 99,-3.7 -2,-0.3 2,-0.6 -0.961 9.3-162.3-115.5 124.7 17.7 2.1 11.0 35 35 A V E +bc 12 133A 6 -24,-2.6 -22,-2.3 -2,-0.5 2,-0.5 -0.931 9.9 179.7-110.2 122.9 21.4 1.4 11.4 36 36 A E - 0 0 29 97,-2.6 100,-2.9 -2,-0.6 99,-0.3 -0.985 20.3-153.8-123.0 125.0 22.7 -2.0 10.4 37 37 A Q S S+ 0 0 110 -2,-0.5 100,-0.2 98,-0.3 -1,-0.1 0.842 76.9 64.6 -67.7 -35.8 26.4 -2.9 10.7 38 38 A T S S- 0 0 68 98,-0.1 97,-3.0 97,-0.1 98,-0.3 -0.208 99.6-103.1 -79.4 176.8 26.5 -5.6 8.0 39 39 A D - 0 0 85 95,-0.2 95,-0.1 2,-0.1 3,-0.1 0.479 56.7-109.8 -79.5 0.6 25.8 -4.8 4.3 40 40 A G S S+ 0 0 34 1,-0.3 2,-0.3 94,-0.0 85,-0.1 0.442 76.5 133.6 87.4 0.5 22.4 -6.3 4.8 41 41 A T - 0 0 94 80,-0.0 2,-0.5 81,-0.0 -1,-0.3 -0.629 48.8-138.9 -88.0 141.9 23.2 -9.4 2.7 42 42 A I + 0 0 46 -2,-0.3 -1,-0.0 76,-0.1 76,-0.0 -0.861 27.8 166.1-104.0 133.0 22.3 -12.9 4.0 43 43 A T S S+ 0 0 120 -2,-0.5 -1,-0.1 1,-0.2 75,-0.0 0.611 79.2 26.8-113.4 -27.1 24.7 -15.8 3.5 44 44 A H S S- 0 0 13 223,-0.0 -1,-0.2 73,-0.0 73,-0.0 -0.769 84.9-131.6-143.7 94.6 23.0 -18.3 5.8 45 45 A P + 0 0 5 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.152 24.4 178.3 -47.4 126.0 19.3 -18.0 6.4 46 46 A R + 0 0 199 1,-0.1 2,-0.3 2,-0.0 -4,-0.0 0.654 67.2 34.5-103.7 -24.7 18.4 -18.1 10.1 47 47 A V + 0 0 38 1,-0.1 70,-2.5 68,-0.1 71,-0.2 -0.878 48.9 143.4-129.6 161.9 14.7 -17.6 9.8 48 48 A G + 0 0 7 1,-0.3 67,-3.5 -2,-0.3 2,-0.5 0.330 50.4 86.9-164.7 -35.5 12.0 -18.6 7.3 49 49 A T E -H 114 0B 33 65,-0.2 2,-0.6 63,-0.0 -1,-0.3 -0.703 53.8-165.6 -86.5 127.9 8.7 -19.5 8.9 50 50 A I E -H 113 0B 0 63,-3.0 63,-2.4 -2,-0.5 250,-0.1 -0.956 16.6-132.8-117.3 116.9 6.4 -16.5 9.4 51 51 A G > - 0 0 1 -2,-0.6 4,-2.0 249,-0.2 5,-0.2 -0.138 22.7-109.3 -63.1 161.8 3.4 -17.0 11.8 52 52 A P H > S+ 0 0 11 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.853 117.9 52.3 -62.2 -36.8 -0.1 -15.9 10.9 53 53 A R H > S+ 0 0 37 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.903 109.9 49.5 -67.5 -38.1 -0.2 -13.1 13.4 54 54 A S H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.894 109.2 52.5 -65.3 -38.0 3.1 -11.8 12.0 55 55 A M H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.832 105.3 55.0 -67.1 -30.9 1.5 -12.0 8.5 56 56 A E H X S+ 0 0 7 -4,-1.7 4,-2.2 54,-0.2 -1,-0.2 0.887 110.2 46.2 -68.3 -36.1 -1.4 -10.0 9.7 57 57 A L H X S+ 0 0 3 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.898 112.0 49.6 -72.7 -37.8 1.0 -7.3 10.8 58 58 A F H <>S+ 0 0 2 -4,-2.6 5,-2.6 2,-0.2 6,-1.0 0.849 108.4 55.1 -68.2 -29.0 2.9 -7.5 7.5 59 59 A R H ><5S+ 0 0 57 -4,-2.0 3,-1.4 4,-0.2 -2,-0.2 0.952 108.5 48.1 -64.4 -46.8 -0.6 -7.2 5.9 60 60 A R H 3<5S+ 0 0 37 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.908 112.4 48.1 -58.6 -44.3 -1.1 -4.0 7.9 61 61 A W T 3<5S- 0 0 21 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.361 116.9-113.8 -81.1 5.5 2.4 -2.7 6.9 62 62 A G T < 5S+ 0 0 49 -3,-1.4 -3,-0.2 -4,-0.2 4,-0.1 0.766 91.2 94.6 71.4 31.5 1.7 -3.5 3.2 63 63 A V >< + 0 0 3 -5,-2.6 4,-1.7 -8,-0.1 -4,-0.2 0.311 47.3 99.1-132.3 6.8 4.3 -6.3 2.5 64 64 A A H > S+ 0 0 5 -6,-1.0 4,-2.3 2,-0.2 5,-0.2 0.897 82.7 54.5 -62.7 -41.3 2.3 -9.5 3.1 65 65 A K H > S+ 0 0 161 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.956 109.4 45.0 -58.3 -53.5 1.8 -10.0 -0.7 66 66 A Q H 4 S+ 0 0 83 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.825 109.6 56.5 -63.8 -29.7 5.4 -9.8 -1.6 67 67 A I H >< S+ 0 0 1 -4,-1.7 3,-1.4 1,-0.2 4,-0.2 0.967 111.1 43.9 -64.3 -48.6 6.4 -12.1 1.2 68 68 A R H 3< S+ 0 0 76 -4,-2.3 3,-0.4 1,-0.3 -2,-0.2 0.783 117.7 44.5 -64.7 -30.4 3.9 -14.7 -0.1 69 69 A T T 3< S+ 0 0 110 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.062 82.6 105.9-102.7 23.4 5.0 -14.2 -3.7 70 70 A A S < S- 0 0 31 -3,-1.4 -1,-0.2 44,-0.2 -2,-0.1 0.744 104.7 -73.6 -74.1 -26.6 8.8 -14.2 -2.8 71 71 A G S S+ 0 0 12 -3,-0.4 -2,-0.1 1,-0.3 -3,-0.1 0.422 80.6 137.9 149.4 -4.4 9.4 -17.7 -4.2 72 72 A W - 0 0 24 42,-0.3 -1,-0.3 -4,-0.2 160,-0.1 -0.589 64.4-108.4 -71.2 124.0 8.1 -20.5 -2.0 73 73 A P > - 0 0 9 0, 0.0 3,-1.8 0, 0.0 26,-0.4 -0.294 17.0-142.1 -55.4 122.7 6.5 -23.0 -4.5 74 74 A G T 3 S+ 0 0 17 1,-0.3 26,-2.7 25,-0.1 27,-0.4 0.743 101.3 46.4 -58.6 -22.3 2.8 -22.9 -4.3 75 75 A D T 3 S+ 0 0 103 24,-0.2 -1,-0.3 23,-0.1 3,-0.0 0.311 81.9 116.6-104.8 9.2 2.7 -26.7 -4.7 76 76 A H S < S- 0 0 2 -3,-1.8 23,-0.5 1,-0.1 24,-0.1 -0.579 73.5-106.8 -78.5 136.7 5.5 -27.7 -2.3 77 77 A P B -I 98 0C 15 0, 0.0 21,-0.2 0, 0.0 -1,-0.1 -0.307 21.8-161.7 -61.0 147.0 4.2 -29.9 0.6 78 78 A L + 0 0 10 19,-2.3 20,-0.1 136,-0.1 136,-0.1 0.303 46.9 132.9-108.9 3.7 4.0 -28.1 4.0 79 79 A D - 0 0 19 18,-0.3 136,-2.1 134,-0.2 137,-1.8 0.009 52.7-137.6 -55.2 160.3 3.9 -31.4 5.9 80 80 A A E -Jk 94 216D 0 14,-1.6 14,-3.3 135,-0.2 2,-0.4 -0.980 27.8-172.0-118.3 129.0 6.1 -32.2 8.9 81 81 A A E -Jk 93 217D 0 135,-2.9 137,-2.7 -2,-0.5 2,-0.7 -0.982 23.6-149.6-136.7 132.1 7.5 -35.8 8.8 82 82 A W E +Jk 92 218D 1 10,-4.2 9,-3.0 -2,-0.4 10,-1.8 -0.845 35.0 171.6 -93.6 117.1 9.4 -38.0 11.2 83 83 A V E -Jk 90 219D 2 135,-1.7 137,-1.3 -2,-0.7 7,-0.2 -0.936 47.4-135.3-131.8 154.8 11.6 -40.2 9.2 84 84 A T S S- 0 0 4 5,-3.0 2,-0.2 1,-0.4 6,-0.1 0.500 99.7 -14.4 -80.5 -5.1 14.4 -42.7 9.8 85 85 A R S > S- 0 0 92 4,-0.5 3,-2.6 133,-0.1 2,-0.7 -0.714 83.6 -91.6 169.7 138.9 16.2 -41.0 6.9 86 86 A V B 3 S+p 256 0E 0 169,-2.9 171,-2.1 1,-0.3 172,-0.5 -0.547 123.5 12.9 -67.5 110.6 15.1 -38.6 4.2 87 87 A G T 3 S+ 0 0 40 -2,-0.7 -1,-0.3 1,-0.3 3,-0.1 0.255 119.8 90.0 103.6 -10.1 14.1 -41.0 1.4 88 88 A G S < S- 0 0 37 -3,-2.6 -1,-0.3 1,-0.2 2,-0.2 0.123 93.1 -30.4 -94.4-148.2 14.2 -43.9 3.9 89 89 A H - 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