==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-NOV-07 3BII . COMPND 2 MOLECULE: MOLYBDOPTERIN-CONVERTING FACTOR SUBUNIT 1; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.N.DANIELS,H.SCHINDELIN . 223 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11248.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 146 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 21.5 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 . 2 0.9 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 . 8 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 25.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 2 2 1 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 1 1 1 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 D M 0 0 109 0, 0.0 68,-2.4 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 176.3 24.0 26.3 -9.4 2 2 D I E -A 21 0A 5 19,-1.9 19,-2.4 66,-0.2 2,-0.4 -0.999 360.0-145.8-109.4 130.0 22.8 27.8 -6.2 3 3 D K E -Ab 20 71A 87 67,-2.1 69,-3.3 -2,-0.5 2,-0.5 -0.820 13.0-162.0 -95.2 131.8 20.8 25.2 -4.3 4 4 D V E -Ab 19 72A 0 15,-3.3 15,-1.6 -2,-0.4 2,-0.3 -0.956 5.8-170.5-123.7 126.4 17.8 26.4 -2.1 5 5 D L E -Ab 18 73A 24 67,-2.7 69,-2.5 -2,-0.5 2,-0.3 -0.791 3.9-161.5-111.0 153.8 16.0 24.6 0.6 6 6 D F E - b 0 74A 2 11,-1.7 2,-0.3 -2,-0.3 69,-0.2 -0.971 5.8-165.7-137.1 147.9 12.8 25.5 2.5 7 7 D F >> - 0 0 21 67,-1.2 3,-1.3 -2,-0.3 4,-0.7 -0.951 45.9 -19.1-139.0 153.6 11.3 24.4 5.8 8 8 D A H 3> S- 0 0 0 -2,-0.3 4,-2.0 1,-0.3 3,-0.2 -0.217 126.6 -1.0 57.5-134.9 8.1 24.4 7.8 9 9 D Q H 3> S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.815 136.2 53.9 -51.9 -39.8 5.6 27.1 6.7 10 10 D V H <> S+ 0 0 8 -3,-1.3 4,-3.0 2,-0.2 5,-0.3 0.918 108.2 48.4 -67.6 -43.7 7.9 28.4 4.0 11 11 D R H X S+ 0 0 53 -4,-0.7 4,-1.6 2,-0.2 5,-0.4 0.881 112.8 50.4 -61.6 -39.9 8.3 24.9 2.4 12 12 D E H < S+ 0 0 93 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.937 114.8 41.6 -62.1 -48.2 4.5 24.5 2.5 13 13 D L H < S+ 0 0 49 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.881 113.7 48.9 -73.8 -42.1 3.8 27.8 0.8 14 14 D V H < S- 0 0 10 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.850 102.0-139.8 -70.6 -26.8 6.5 27.7 -1.8 15 15 D G < + 0 0 58 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.1 0.555 68.8 79.5 86.6 7.8 5.3 24.2 -2.6 16 16 D T - 0 0 56 -5,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.971 67.4-142.5-138.3 155.3 8.7 22.6 -3.1 17 17 D D S S+ 0 0 104 -2,-0.3 -11,-1.7 1,-0.2 2,-0.3 0.753 84.9 0.1 -84.6 -29.9 11.4 21.3 -0.7 18 18 D A E +A 5 0A 31 -13,-0.2 2,-0.3 -7,-0.1 -1,-0.2 -0.984 59.6 175.8-156.8 161.9 14.3 22.5 -2.9 19 19 D T E -A 4 0A 49 -15,-1.6 -15,-3.3 -2,-0.3 2,-0.3 -0.968 23.3-124.3-162.1 162.2 15.2 24.2 -6.1 20 20 D E E -A 3 0A 116 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.897 23.2-170.5-115.5 147.4 18.2 25.5 -8.1 21 21 D V E -A 2 0A 16 -19,-2.4 -19,-1.9 -2,-0.3 -2,-0.0 -0.999 38.3 -86.1-137.5 140.7 18.9 29.0 -9.3 22 22 D A - 0 0 47 -2,-0.3 2,-4.1 -21,-0.2 3,-0.1 -0.195 42.7-124.7 -30.2 109.5 21.4 30.7 -11.6 23 23 D A S S+ 0 0 38 1,-0.2 45,-0.3 3,-0.0 -1,-0.2 -0.112 78.5 118.6 -60.3 50.0 24.4 31.6 -9.3 24 24 D D + 0 0 134 -2,-4.1 -1,-0.2 43,-0.1 -2,-0.1 0.057 39.3 102.5-113.6 21.2 23.9 35.2 -10.5 25 25 D F - 0 0 44 1,-0.1 41,-0.5 -3,-0.1 6,-0.1 -0.933 57.3-151.4-122.4 126.7 23.1 37.0 -7.3 26 26 D P S S+ 0 0 93 0, 0.0 40,-1.3 0, 0.0 2,-0.3 0.845 78.2 10.8 -62.5 -34.2 25.5 39.1 -5.3 27 27 D T B > S-E 65 0B 38 38,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.903 73.5-105.8-143.6 165.8 23.8 38.4 -1.9 28 28 D V H > S+ 0 0 0 36,-2.5 4,-3.3 -2,-0.3 35,-0.2 0.953 122.1 53.5 -54.6 -55.4 21.2 36.3 -0.0 29 29 D E H > S+ 0 0 44 33,-3.5 4,-2.9 1,-0.2 -1,-0.2 0.852 107.2 52.2 -43.8 -42.9 18.9 39.3 0.0 30 30 D A H > S+ 0 0 23 32,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.911 111.4 45.9 -64.8 -43.6 19.2 39.5 -3.8 31 31 D L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.928 111.9 52.5 -63.5 -45.8 18.3 35.9 -4.2 32 32 D R H X S+ 0 0 35 -4,-3.3 4,-2.5 1,-0.2 5,-0.2 0.951 109.3 47.7 -54.8 -54.0 15.4 36.4 -1.8 33 33 D Q H X S+ 0 0 116 -4,-2.9 4,-1.2 1,-0.2 -1,-0.2 0.893 113.0 51.4 -55.2 -41.6 14.0 39.3 -3.8 34 34 D H H < S+ 0 0 68 -4,-1.9 3,-0.4 1,-0.2 -1,-0.2 0.933 111.2 44.2 -62.5 -47.3 14.4 37.3 -7.0 35 35 D M H >< S+ 0 0 5 -4,-2.7 3,-1.3 1,-0.2 4,-0.4 0.837 109.7 56.7 -71.1 -34.9 12.6 34.2 -5.7 36 36 D A H >< S+ 0 0 3 -4,-2.5 3,-0.6 1,-0.3 7,-0.4 0.768 100.1 59.1 -62.0 -33.3 9.8 36.3 -4.2 37 37 D A T 3< S+ 0 0 82 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.396 84.6 83.6 -79.0 1.3 9.0 37.9 -7.5 38 38 D Q T < S- 0 0 108 -3,-1.3 2,-0.3 1,-0.3 -1,-0.2 0.849 108.8 -26.4 -75.7 -34.4 8.4 34.5 -9.1 39 39 D S <> - 0 0 52 -3,-0.6 4,-2.0 -4,-0.4 -1,-0.3 -0.968 64.3 -94.4-167.2 174.5 4.8 34.4 -7.8 40 40 D D H > S+ 0 0 149 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.837 121.7 50.6 -66.2 -39.9 2.3 35.6 -5.2 41 41 D R H > S+ 0 0 146 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.908 111.4 48.2 -64.8 -43.0 2.8 32.5 -3.0 42 42 D W H > S+ 0 0 45 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.886 111.6 49.9 -65.3 -38.7 6.6 32.8 -3.1 43 43 D A H X S+ 0 0 19 -4,-2.0 4,-0.6 -7,-0.4 -1,-0.2 0.875 113.2 46.0 -66.6 -40.1 6.4 36.5 -2.3 44 44 D L H < S+ 0 0 126 -4,-2.0 4,-0.5 2,-0.2 3,-0.4 0.899 117.0 45.2 -67.0 -43.0 4.1 35.7 0.7 45 45 D A H < S+ 0 0 7 -4,-3.0 3,-0.3 1,-0.2 -2,-0.2 0.891 122.1 36.5 -62.7 -40.7 6.5 32.8 1.7 46 46 D L H < S+ 0 0 0 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.253 102.3 69.2-109.0 12.9 9.6 34.9 1.3 47 47 D E < + 0 0 104 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.1 0.633 60.1 121.1-107.5 -12.7 8.8 38.4 2.4 48 48 D D > - 0 0 94 -4,-0.5 3,-1.0 -3,-0.3 -3,-0.0 -0.146 62.8-134.2 -48.4 136.8 8.2 38.1 6.2 49 49 D G T 3 S+ 0 0 83 1,-0.2 -1,-0.1 3,-0.0 -3,-0.0 0.818 106.8 55.0 -57.7 -31.1 10.6 40.4 8.3 50 50 D K T 3 S+ 0 0 137 2,-0.0 -1,-0.2 27,-0.0 -2,-0.1 0.506 77.0 129.7 -86.5 -3.1 11.3 37.4 10.6 51 51 D L < - 0 0 8 -3,-1.0 2,-0.2 25,-0.1 -5,-0.0 -0.251 48.5-146.9 -53.0 130.3 12.4 35.1 7.7 52 52 D L E -C 75 0A 45 23,-3.0 23,-1.6 9,-0.0 2,-0.3 -0.655 10.6-159.4 -99.2 157.9 15.7 33.5 8.6 53 53 D A E -C 74 0A 2 7,-0.5 7,-1.3 -2,-0.2 2,-0.3 -0.957 6.6-171.2-133.4 154.4 18.5 32.5 6.1 54 54 D A E -CD 73 59A 0 19,-1.6 19,-1.9 -2,-0.3 2,-0.5 -0.997 8.1-159.1-144.4 145.8 21.4 30.1 6.2 55 55 D V E > S-CD 72 58A 7 3,-2.4 3,-1.6 -2,-0.3 17,-0.2 -0.996 82.1 -11.6-126.5 128.0 24.3 29.7 3.8 56 56 D N T 3 S- 0 0 61 15,-3.1 -1,-0.2 -2,-0.5 16,-0.1 0.934 131.8 -52.4 41.5 57.1 26.2 26.3 3.9 57 57 D Q T 3 S+ 0 0 38 14,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.627 115.5 111.8 59.4 21.2 24.4 25.4 7.1 58 58 D T E < S-D 55 0A 44 -3,-1.6 -3,-2.4 82,-0.0 2,-0.3 -0.982 71.9-115.9-121.5 139.1 25.3 28.6 8.9 59 59 D L E +D 54 0A 57 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.553 45.6 172.7 -67.8 130.5 22.9 31.3 10.0 60 60 D V - 0 0 26 -7,-1.3 -7,-0.5 -2,-0.3 2,-0.1 -0.864 35.5-101.7-136.3 159.9 23.8 34.5 8.2 61 61 D S > - 0 0 72 -2,-0.3 3,-1.4 1,-0.1 -33,-0.2 -0.389 41.7-108.6 -74.1 165.4 22.5 38.0 7.7 62 62 D F T 3 S+ 0 0 45 1,-0.2 -33,-3.5 -34,-0.1 -32,-0.3 0.737 116.6 66.3 -70.8 -19.5 20.7 38.7 4.4 63 63 D D T 3 S+ 0 0 123 -35,-0.2 -1,-0.2 -36,-0.1 -33,-0.0 0.623 73.4 124.3 -70.0 -15.8 23.6 40.9 3.2 64 64 D H < - 0 0 75 -3,-1.4 -36,-2.5 -37,-0.1 -35,-0.2 -0.215 65.8-117.5 -53.9 129.6 25.8 37.7 3.1 65 65 D P B -E 27 0B 77 0, 0.0 -38,-0.3 0, 0.0 2,-0.2 -0.355 23.0-135.3 -70.6 151.0 27.3 37.2 -0.3 66 66 D L - 0 0 22 -40,-1.3 2,-0.3 -41,-0.5 -64,-0.0 -0.603 16.4-167.8 -99.4 161.1 26.6 34.2 -2.5 67 67 D T > - 0 0 91 -2,-0.2 3,-1.9 -66,-0.1 -43,-0.1 -0.965 37.9 -88.5-150.3 136.0 29.0 32.0 -4.5 68 68 D D T 3 S+ 0 0 113 -2,-0.3 -66,-0.2 -45,-0.3 -46,-0.1 -0.155 115.6 29.9 -36.6 121.4 28.5 29.3 -7.2 69 69 D G T 3 S+ 0 0 62 -68,-2.4 -1,-0.3 1,-0.3 -67,-0.2 0.389 88.4 138.9 104.4 0.3 28.0 26.0 -5.3 70 70 D D < - 0 0 21 -3,-1.9 -67,-2.1 -69,-0.2 2,-0.6 -0.314 50.0-132.8 -75.1 156.6 26.5 27.3 -2.2 71 71 D E E -b 3 0A 56 -69,-0.2 -15,-3.1 -2,-0.1 2,-0.4 -0.965 26.3-173.2-106.6 117.9 23.6 25.8 -0.2 72 72 D V E -bC 4 55A 0 -69,-3.3 -67,-2.7 -2,-0.6 2,-0.4 -0.912 2.1-173.8-110.6 138.0 21.0 28.5 0.8 73 73 D A E -bC 5 54A 0 -19,-1.9 -19,-1.6 -2,-0.4 2,-0.4 -1.000 8.1-163.3-132.7 133.0 18.0 27.7 3.1 74 74 D F E +bC 6 53A 0 -69,-2.5 -67,-1.2 -2,-0.4 -21,-0.2 -0.944 23.9 149.8-111.6 141.4 15.0 29.9 4.0 75 75 D F E - 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