==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-OCT-10 2XVE . COMPND 2 MOLECULE: FLAVIN-CONTAINING MONOOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHYLOPHAGA AMINISULFIDIVORANS; . AUTHOR H.J.CHO,B.S.KANG . 1335 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50519.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 835 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 128 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 103 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 115 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 314 23.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.3 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 6 0 0 0 0 3 0 0 0 0 10 5 3 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 3 4 11 6 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 . 17 3 6 0 0 0 3 3 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 6 3 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 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 3 A T 0 0 97 0, 0.0 30,-3.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 168.3 26.7 70.7 -29.4 2 4 A R E -a 31 0A 82 28,-0.2 152,-2.4 30,-0.0 153,-1.5 -0.964 360.0-161.9-124.8 134.0 25.2 67.5 -28.0 3 5 A I E -ab 32 155A 0 28,-3.2 30,-2.5 -2,-0.4 2,-0.6 -0.943 6.1-155.5-118.7 131.6 26.5 63.9 -28.6 4 6 A A E -ab 33 156A 0 151,-2.1 153,-2.9 -2,-0.4 2,-0.6 -0.932 8.0-164.9-103.1 119.7 24.6 60.6 -28.1 5 7 A I E -ab 34 157A 0 28,-2.7 30,-2.3 -2,-0.6 2,-1.0 -0.932 11.9-147.4-104.3 118.9 26.8 57.6 -27.4 6 8 A L E +ab 35 158A 0 151,-2.8 153,-2.1 -2,-0.6 30,-0.1 -0.738 65.9 8.6 -93.6 99.1 24.9 54.4 -27.9 7 9 A G - 0 0 9 28,-2.5 29,-0.2 -2,-1.0 28,-0.1 0.092 59.3-132.2 107.8 139.6 26.2 51.8 -25.4 8 10 A A + 0 0 0 4,-0.1 34,-2.0 32,-0.1 35,-0.2 -0.224 65.6 115.9-117.7 39.1 28.6 51.8 -22.5 9 11 A G S > S- 0 0 7 150,-0.5 4,-3.2 33,-0.2 5,-0.3 -0.186 93.6 -65.2 -84.6-169.8 30.7 48.8 -23.3 10 12 A P H > S+ 0 0 19 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.836 139.2 48.2 -48.1 -38.6 34.5 49.2 -24.2 11 13 A S H > S+ 0 0 14 2,-0.2 4,-2.1 148,-0.2 5,-0.1 0.921 113.6 44.4 -70.4 -47.2 33.6 51.2 -27.3 12 14 A G H > S+ 0 0 0 147,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.885 115.1 50.0 -62.4 -40.8 31.2 53.6 -25.6 13 15 A M H X S+ 0 0 5 -4,-3.2 4,-2.5 2,-0.2 -2,-0.2 0.859 108.9 52.8 -63.8 -38.3 33.7 53.9 -22.7 14 16 A A H X S+ 0 0 1 -4,-1.8 4,-1.7 -5,-0.3 -2,-0.2 0.894 108.7 49.6 -64.1 -41.6 36.4 54.6 -25.3 15 17 A Q H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.904 112.5 46.6 -66.1 -43.4 34.3 57.4 -26.9 16 18 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.935 111.9 51.2 -61.1 -48.2 33.6 59.0 -23.5 17 19 A R H X S+ 0 0 12 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.789 103.9 59.7 -60.1 -32.0 37.3 58.8 -22.5 18 20 A A H X S+ 0 0 0 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.942 109.3 41.7 -60.8 -49.5 38.3 60.4 -25.8 19 21 A F H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.882 112.7 53.2 -67.3 -40.4 36.3 63.6 -25.0 20 22 A Q H X S+ 0 0 22 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.826 108.0 51.3 -64.7 -34.8 37.3 63.7 -21.3 21 23 A S H X S+ 0 0 31 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.872 109.0 50.5 -69.8 -39.4 41.0 63.5 -22.3 22 24 A A H <>S+ 0 0 1 -4,-1.5 5,-2.2 2,-0.2 4,-0.3 0.885 113.1 46.4 -62.6 -41.0 40.5 66.4 -24.7 23 25 A Q H ><5S+ 0 0 81 -4,-2.1 3,-1.1 3,-0.2 -2,-0.2 0.864 108.2 56.2 -67.0 -39.8 38.8 68.4 -21.9 24 26 A E H 3<5S+ 0 0 164 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.785 104.3 54.0 -63.1 -29.8 41.7 67.4 -19.5 25 27 A K T 3<5S- 0 0 144 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.526 131.5 -92.9 -83.8 -7.9 44.1 69.0 -22.0 26 28 A G T < 5S+ 0 0 68 -3,-1.1 -3,-0.2 1,-0.3 2,-0.2 0.542 79.7 133.7 111.8 11.7 42.2 72.2 -21.9 27 29 A A < - 0 0 30 -5,-2.2 2,-0.6 -6,-0.1 -1,-0.3 -0.590 58.8-114.6 -90.9 153.5 39.7 72.0 -24.8 28 30 A E - 0 0 166 -2,-0.2 -5,-0.0 0, 0.0 -1,-0.0 -0.794 38.8-158.3 -87.0 120.9 36.0 72.9 -24.6 29 31 A I - 0 0 21 -2,-0.6 3,-0.1 1,-0.1 -9,-0.0 -0.675 14.9-108.1-104.8 153.4 34.0 69.7 -25.2 30 32 A P - 0 0 11 0, 0.0 2,-0.3 0, 0.0 -28,-0.2 -0.220 47.5 -84.3 -68.5 166.1 30.4 69.0 -26.4 31 33 A E E -a 2 0A 48 -30,-3.0 -28,-3.2 1,-0.0 2,-0.5 -0.572 49.3-151.2 -71.6 134.4 27.6 67.8 -24.1 32 34 A L E +a 3 0A 11 -2,-0.3 2,-0.4 -30,-0.2 -28,-0.2 -0.935 20.6 176.8-118.9 129.6 27.7 64.0 -23.8 33 35 A V E -a 4 0A 8 -30,-2.5 -28,-2.7 -2,-0.5 2,-0.5 -0.985 10.2-165.6-127.8 120.7 24.8 61.5 -23.1 34 36 A C E -ac 5 118A 0 83,-2.6 85,-3.5 -2,-0.4 2,-0.5 -0.926 6.5-154.7-108.2 122.9 25.5 57.8 -23.1 35 37 A F E +ac 6 119A 3 -30,-2.3 -28,-2.5 -2,-0.5 2,-0.4 -0.852 16.5 174.7 -98.8 127.4 22.6 55.4 -23.2 36 38 A E - 0 0 12 83,-2.3 86,-3.0 -2,-0.5 87,-0.1 -0.989 23.3-159.3-136.6 125.7 23.1 51.9 -21.8 37 39 A K S S+ 0 0 47 -2,-0.4 86,-0.2 84,-0.3 -1,-0.1 0.740 72.5 78.4 -77.0 -25.3 20.4 49.2 -21.4 38 40 A Q S S- 0 0 22 2,-0.2 83,-2.7 84,-0.2 84,-0.3 -0.323 91.8-111.8 -78.7 167.0 22.2 47.2 -18.8 39 41 A A S S+ 0 0 62 81,-0.2 2,-0.3 82,-0.1 81,-0.1 0.603 97.6 15.0 -74.9 -13.4 22.3 48.1 -15.1 40 42 A D S S- 0 0 46 3,-0.1 3,-0.3 6,-0.1 -2,-0.2 -0.954 86.3 -91.2-153.3 166.4 26.1 48.9 -15.3 41 43 A W S S+ 0 0 5 -2,-0.3 -32,-0.2 1,-0.2 -2,-0.1 -0.212 77.0 86.3 -75.0 170.5 28.9 49.4 -17.8 42 44 A G > - 0 0 0 -34,-2.0 3,-2.0 3,-0.1 2,-0.2 0.061 60.9-152.0 127.4 -23.6 31.1 46.8 -19.4 43 45 A G G > S+ 0 0 4 -3,-0.3 3,-1.2 1,-0.3 19,-0.2 -0.417 84.3 4.2 61.9-122.6 29.2 45.5 -22.4 44 46 A Q G 3 S+ 0 0 34 1,-0.2 20,-0.4 -2,-0.2 -1,-0.3 0.838 130.5 64.0 -57.0 -35.4 30.3 41.9 -23.0 45 47 A W G < S+ 0 0 34 -3,-2.0 2,-1.4 1,-0.1 -1,-0.2 0.611 78.2 89.0 -72.1 -14.3 32.4 42.1 -19.9 46 48 A N S < S- 0 0 42 -3,-1.2 16,-0.3 -6,-0.1 -1,-0.1 -0.689 78.0-150.5 -84.2 87.7 29.4 42.6 -17.6 47 49 A Y - 0 0 21 -2,-1.4 2,-0.3 16,-0.1 18,-0.1 -0.264 17.1-174.8 -61.7 142.2 28.7 38.9 -17.0 48 50 A T - 0 0 26 16,-0.4 -1,-0.0 2,-0.2 -2,-0.0 -0.999 34.8-144.9-138.6 145.9 25.1 37.7 -16.3 49 51 A W S S+ 0 0 23 -2,-0.3 579,-0.2 16,-0.1 -1,-0.1 0.703 78.6 102.7 -68.8 -22.0 23.5 34.4 -15.4 50 52 A R - 0 0 20 -3,-0.0 2,-0.3 2,-0.0 -2,-0.2 -0.281 51.3-174.5 -68.6 145.7 20.6 35.5 -17.6 51 53 A T + 0 0 36 2,-0.3 2,-1.2 577,-0.1 448,-0.1 -0.940 56.2 5.7-134.0 158.7 20.0 34.2 -21.1 52 54 A G S S+ 0 0 2 -2,-0.3 8,-2.6 8,-0.2 2,-0.4 -0.572 124.2 12.8 77.8 -95.2 17.6 35.2 -23.9 53 55 A L B S-G 59 0B 11 -2,-1.2 -2,-0.3 6,-0.3 5,-0.0 -0.939 77.4-133.0-120.8 143.4 15.7 38.3 -22.6 54 56 A D > - 0 0 15 4,-3.7 3,-1.6 -2,-0.4 561,-0.2 0.013 42.8 -73.8 -85.7-169.7 16.8 40.4 -19.5 55 57 A E T 3 S+ 0 0 90 1,-0.3 560,-0.3 2,-0.1 -1,-0.1 0.705 134.1 42.0 -58.6 -23.7 14.9 41.8 -16.5 56 58 A N T 3 S- 0 0 22 2,-0.2 -1,-0.3 558,-0.1 558,-0.1 0.407 121.2-101.8-103.9 -0.3 13.2 44.4 -18.8 57 59 A G S < S+ 0 0 3 -3,-1.6 -2,-0.1 1,-0.4 3,-0.1 0.532 80.1 133.7 85.6 7.8 12.5 42.1 -21.7 58 60 A E S S- 0 0 11 1,-0.1 -4,-3.7 -21,-0.1 -1,-0.4 -0.671 70.8 -88.5 -83.9 144.9 15.5 43.4 -23.7 59 61 A P B -G 53 0B 33 0, 0.0 -6,-0.3 0, 0.0 2,-0.2 -0.272 48.2-106.2 -49.6 133.1 17.7 40.9 -25.4 60 62 A V - 0 0 5 -8,-2.6 -8,-0.2 1,-0.1 -22,-0.0 -0.486 35.4-161.2 -62.4 129.3 20.5 39.7 -23.0 61 63 A H + 0 0 29 -2,-0.2 -1,-0.1 -15,-0.1 -17,-0.1 0.935 56.5 80.5 -86.0 -50.8 23.6 41.4 -24.3 62 64 A S - 0 0 0 -16,-0.3 -18,-0.1 -19,-0.2 -17,-0.1 -0.310 44.5-174.3 -66.0 140.6 26.6 39.5 -22.9 63 65 A S + 0 0 10 100,-0.1 -1,-0.1 2,-0.1 124,-0.1 0.349 49.2 120.8-106.0 -2.2 27.8 36.3 -24.5 64 66 A M - 0 0 19 -20,-0.4 -16,-0.4 -18,-0.1 2,-0.3 -0.298 44.7-160.9 -73.4 150.5 30.4 35.7 -21.8 65 67 A Y > - 0 0 7 1,-0.1 3,-1.3 -18,-0.1 124,-0.2 -0.772 29.3 -76.1-127.0 164.9 30.4 32.6 -19.6 66 68 A R T 3 S+ 0 0 44 122,-3.1 124,-0.2 -2,-0.3 -1,-0.1 -0.263 113.7 23.4 -56.9 148.2 31.7 31.4 -16.3 67 69 A Y T 3 S+ 0 0 9 1,-0.2 -1,-0.2 122,-0.1 2,-0.1 0.474 83.6 156.1 73.1 5.1 35.4 30.4 -16.3 68 70 A L < - 0 0 19 -3,-1.3 30,-2.7 29,-0.1 2,-0.3 -0.423 19.7-171.5 -63.3 131.2 36.2 32.7 -19.3 69 71 A W B -H 97 0C 7 28,-0.3 26,-0.0 -2,-0.1 367,-0.0 -0.799 41.9 -60.9-116.3 164.4 39.9 33.8 -19.4 70 72 A S - 0 0 1 26,-2.2 -1,-0.1 -2,-0.3 4,-0.1 -0.146 44.2-140.3 -41.9 130.2 41.6 36.3 -21.7 71 73 A N S S+ 0 0 60 2,-0.1 -1,-0.1 -3,-0.1 3,-0.1 0.961 81.0 5.3 -63.2 -56.3 41.3 35.2 -25.4 72 74 A G S S- 0 0 9 1,-0.2 2,-0.1 22,-0.0 323,-0.1 -0.432 113.2 -47.3-111.8-168.7 44.8 36.2 -26.4 73 75 A P > - 0 0 1 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.407 44.8-133.9 -62.1 137.1 47.8 37.5 -24.4 74 76 A K G >> S+ 0 0 12 20,-2.9 4,-1.8 1,-0.3 3,-1.2 0.807 106.6 67.5 -59.2 -29.2 46.8 40.4 -22.1 75 77 A E G 34 S+ 0 0 4 1,-0.3 342,-0.4 2,-0.2 -1,-0.3 0.734 95.5 55.5 -61.8 -25.4 49.9 42.1 -23.4 76 78 A C G <4 S+ 0 0 4 -3,-1.6 243,-0.3 1,-0.2 -1,-0.3 0.610 115.3 36.2 -84.6 -16.1 48.1 42.3 -26.8 77 79 A L T <4 S+ 0 0 19 -3,-1.2 -2,-0.2 -4,-0.5 -1,-0.2 0.546 84.3 133.4-107.6 -14.5 45.1 44.1 -25.3 78 80 A E < - 0 0 3 -4,-1.8 5,-0.1 -5,-0.1 2,-0.1 -0.065 66.1-105.6 -42.2 128.4 47.1 46.2 -22.7 79 81 A F B > -I 82 0D 0 3,-0.6 3,-0.8 1,-0.1 -1,-0.1 -0.350 15.1-138.6 -65.2 136.0 45.9 49.8 -22.9 80 82 A A T 3 S+ 0 0 19 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.564 104.8 35.1 -70.6 -8.8 48.3 52.3 -24.6 81 83 A D T 3 S+ 0 0 60 1,-0.2 2,-0.2 302,-0.0 -1,-0.2 0.286 121.3 42.5-126.4 6.4 47.5 54.9 -21.9 82 84 A Y B < S-I 79 0D 22 -3,-0.8 -3,-0.6 4,-0.0 -1,-0.2 -0.779 73.8-152.6-162.2 103.9 47.1 52.7 -18.8 83 85 A T > - 0 0 22 -2,-0.2 4,-1.7 -5,-0.1 5,-0.1 -0.313 26.3-121.8 -85.3 162.1 49.4 49.7 -18.0 84 86 A F H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 5,-0.5 0.776 116.3 58.3 -66.4 -29.6 48.9 46.5 -16.0 85 87 A D H > S+ 0 0 51 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.881 105.4 49.7 -66.5 -40.2 51.8 47.6 -13.8 86 88 A E H 4 S+ 0 0 102 2,-0.1 -2,-0.2 1,-0.1 -1,-0.2 0.925 117.0 39.9 -58.7 -49.2 49.8 50.8 -13.0 87 89 A H H < S+ 0 0 39 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.1 0.913 126.7 26.6 -75.2 -48.6 46.6 49.0 -12.1 88 90 A F H < S- 0 0 32 -4,-2.2 -3,-0.2 2,-0.2 -1,-0.2 0.666 86.6-139.7 -94.4 -19.6 47.7 45.9 -10.2 89 91 A G S < S+ 0 0 68 -4,-1.2 -4,-0.1 -5,-0.5 -3,-0.1 0.440 78.2 62.0 74.2 -0.2 51.0 47.2 -8.7 90 92 A K S S- 0 0 93 -6,-0.4 2,-0.2 0, 0.0 -2,-0.2 -0.979 93.4 -90.9-150.2 155.9 52.6 43.8 -9.5 91 93 A P - 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