==== 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 BIOSYNTHETIC PROTEIN 10-JAN-07 2OHD . COMPND 2 MOLECULE: PROBABLE MOLYBDENUM COFACTOR BIOSYNTHESIS PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS TOKODAII STR. 7; . AUTHOR H.YOSHIDA,M.YAMADA,S.KURAMITSU,S.KAMITORI . 846 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29157.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 621 73.4 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 . 221 26.1 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 . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 64 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 236 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 5 0 0 0 5 1 0 0 0 0 0 0 0 0 5 6 0 0 0 1 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 . 2 8 4 2 2 1 0 2 3 1 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 3 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 5 A K 0 0 78 0, 0.0 2,-0.9 0, 0.0 215,-0.2 0.000 360.0 360.0 360.0 166.4 16.1 18.6 15.2 2 6 A I B -A 215 0A 2 213,-2.8 213,-1.2 61,-0.1 3,-0.1 -0.857 360.0-117.8 -97.0 104.6 17.1 15.7 13.0 3 7 A V - 0 0 40 -2,-0.9 2,-0.6 59,-0.2 -1,-0.0 0.022 28.9-103.7 -42.7 142.4 17.8 17.3 9.6 4 8 A D + 0 0 55 1,-0.2 210,-0.2 210,-0.1 -1,-0.1 -0.616 40.5 171.3 -76.8 115.6 15.7 16.2 6.7 5 9 A I > + 0 0 6 208,-1.7 3,-1.2 -2,-0.6 -1,-0.2 0.303 42.7 116.9-104.5 6.9 17.6 13.8 4.5 6 10 A S T 3 S+ 0 0 11 207,-0.3 2,-1.3 1,-0.3 -1,-0.1 0.883 78.3 40.8 -36.6 -66.7 14.4 13.0 2.4 7 11 A S T 3 S+ 0 0 116 -3,-0.1 2,-0.3 2,-0.0 -1,-0.3 -0.322 92.3 113.3 -87.2 53.5 15.7 14.3 -0.9 8 12 A K < - 0 0 117 -2,-1.3 2,-0.2 -3,-1.2 85,-0.1 -0.916 68.7-112.2-119.2 148.0 19.2 12.9 -0.4 9 13 A D - 0 0 128 -2,-0.3 2,-0.9 84,-0.1 83,-0.1 -0.512 23.5-113.2 -85.5 151.9 20.5 10.2 -2.7 10 14 A I + 0 0 107 -2,-0.2 2,-0.3 83,-0.1 83,-0.2 -0.738 58.1 149.2 -82.7 108.9 21.3 6.7 -1.6 11 15 A V E -K 92 0B 55 81,-1.8 81,-1.8 -2,-0.9 2,-0.2 -0.897 52.7 -73.6-139.7 168.4 25.1 6.4 -1.9 12 16 A L E -K 91 0B 66 -2,-0.3 2,-0.4 79,-0.3 79,-0.2 -0.437 45.4-174.1 -65.5 126.3 28.1 4.6 -0.5 13 17 A R E +K 90 0B 20 77,-3.1 77,-2.4 -2,-0.2 2,-0.3 -0.995 10.8 162.6-125.0 127.6 29.1 6.1 2.9 14 18 A E E +K 89 0B 53 -2,-0.4 126,-1.4 75,-0.2 2,-0.3 -0.996 9.1 179.0-147.8 142.0 32.2 5.0 4.6 15 19 A A E -KL 88 139B 1 73,-2.0 73,-2.0 -2,-0.3 2,-0.5 -0.999 14.8-156.4-148.2 143.7 34.4 6.3 7.5 16 20 A V E -KL 87 138B 27 122,-3.5 121,-2.0 -2,-0.3 122,-1.4 -0.975 15.3-177.6-122.2 121.8 37.5 5.4 9.4 17 21 A V E -KL 86 136B 0 69,-2.6 69,-2.8 -2,-0.5 2,-0.4 -0.953 5.4-165.1-120.5 136.8 38.1 6.8 12.9 18 22 A E E +KL 85 135B 35 117,-2.1 117,-2.1 -2,-0.4 2,-0.3 -0.930 9.8 174.1-121.3 147.4 41.2 6.2 15.0 19 23 A G E -K 84 0B 0 65,-3.0 65,-3.1 -2,-0.4 2,-0.3 -0.944 14.2-146.2-143.5 166.1 41.6 6.8 18.7 20 24 A Y E -K 83 0B 21 -2,-0.3 112,-1.9 63,-0.2 2,-0.5 -0.991 4.6-162.1-141.1 143.7 44.2 6.2 21.4 21 25 A I E -KM 82 131B 0 61,-2.1 61,-1.8 -2,-0.3 2,-0.5 -0.984 20.3-136.4-128.0 121.7 44.3 5.3 25.1 22 26 A K E +KM 81 130B 53 108,-3.5 108,-1.2 -2,-0.5 2,-0.3 -0.639 32.3 174.5 -76.9 122.5 47.4 5.9 27.2 23 27 A L - 0 0 1 57,-1.4 96,-0.0 -2,-0.5 106,-0.0 -0.923 34.7 -96.6-129.7 155.0 48.1 2.9 29.5 24 28 A R > - 0 0 52 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.250 33.5-118.5 -65.1 157.3 50.9 1.9 31.9 25 29 A K H > S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.906 116.5 52.5 -64.2 -42.2 53.5 -0.5 30.6 26 30 A E H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.816 110.0 49.7 -63.6 -30.4 52.6 -3.1 33.2 27 31 A T H >> S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 3,-0.6 0.966 109.5 50.1 -69.3 -52.6 49.0 -2.8 32.0 28 32 A I H 3X S+ 0 0 8 -4,-2.7 4,-2.0 1,-0.3 -2,-0.2 0.870 109.8 52.9 -49.8 -41.5 50.1 -3.2 28.4 29 33 A E H 3X S+ 0 0 116 -4,-2.5 4,-2.0 1,-0.2 -1,-0.3 0.859 107.1 50.9 -65.0 -37.6 52.0 -6.3 29.6 30 34 A K H <<>S+ 0 0 64 -4,-1.5 5,-3.0 -3,-0.6 6,-0.4 0.896 109.0 51.2 -67.7 -40.3 48.9 -7.7 31.3 31 35 A I H ><5S+ 0 0 9 -4,-2.3 3,-1.0 3,-0.2 -2,-0.2 0.903 110.1 49.5 -63.8 -43.2 46.9 -7.3 28.1 32 36 A K H 3<5S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.946 111.3 46.6 -63.3 -49.5 49.5 -9.1 26.0 33 37 A N T 3<5S- 0 0 83 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.353 111.3-120.3 -76.6 9.2 49.8 -12.1 28.2 34 38 A K T < 5S+ 0 0 137 -3,-1.0 -3,-0.2 1,-0.1 -2,-0.1 0.920 74.2 131.3 52.3 46.5 46.1 -12.3 28.5 35 39 A E < + 0 0 117 -5,-3.0 2,-0.5 -6,-0.1 -4,-0.2 0.105 21.2 126.9-116.0 22.5 46.3 -11.9 32.2 36 40 A V > - 0 0 11 -6,-0.4 3,-1.6 3,-0.3 79,-0.1 -0.717 56.2-140.4 -83.7 122.8 43.7 -9.2 32.7 37 41 A E T 3 S+ 0 0 87 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.892 96.2 53.2 -46.6 -58.2 41.2 -10.3 35.4 38 42 A K T 3 S- 0 0 16 76,-0.5 389,-1.9 1,-0.2 2,-0.3 0.548 118.0-100.3 -62.8 -6.3 38.0 -9.0 33.8 39 43 A G < - 0 0 16 -3,-1.6 2,-1.2 387,-0.3 -3,-0.3 -0.831 67.8 -6.7 129.2-166.2 38.8 -10.9 30.6 40 44 A D > - 0 0 22 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 -0.620 55.4-164.4 -76.3 97.6 40.1 -10.6 27.1 41 45 A V H > S+ 0 0 3 -2,-1.2 4,-2.6 1,-0.2 5,-0.2 0.907 81.8 47.6 -49.3 -55.8 40.6 -6.8 26.7 42 46 A I H > S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.934 117.4 39.6 -56.3 -52.8 40.9 -6.7 22.9 43 47 A T H > S+ 0 0 4 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.926 116.6 48.5 -66.7 -45.0 38.0 -8.9 22.1 44 48 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.942 114.1 48.5 -59.0 -45.9 35.6 -7.5 24.7 45 49 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.879 111.9 48.4 -61.1 -41.5 36.5 -4.0 23.6 46 50 A K H X S+ 0 0 33 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.921 111.2 50.2 -66.0 -43.8 36.0 -4.8 19.9 47 51 A T H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.920 111.6 48.3 -60.6 -44.6 32.6 -6.4 20.7 48 52 A A H X S+ 0 0 1 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.891 111.7 50.2 -63.7 -39.8 31.5 -3.3 22.7 49 53 A G H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.852 109.7 50.0 -67.2 -35.9 32.7 -1.0 19.9 50 54 A I H X S+ 0 0 0 -4,-2.3 4,-1.0 2,-0.2 -2,-0.2 0.934 113.7 45.1 -68.1 -45.2 30.8 -3.0 17.2 51 55 A L H >X S+ 0 0 12 -4,-2.3 4,-1.3 1,-0.2 3,-0.6 0.906 108.4 57.7 -63.9 -42.4 27.6 -2.9 19.3 52 56 A A H 3X S+ 0 0 2 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.858 96.9 63.1 -57.7 -36.3 28.1 0.8 20.1 53 57 A A H >< S+ 0 0 1 -4,-1.5 3,-0.6 1,-0.3 -1,-0.2 0.923 106.9 43.2 -54.3 -44.3 28.1 1.6 16.3 54 58 A K H << S+ 0 0 30 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.753 111.0 56.6 -72.9 -24.0 24.5 0.3 16.2 55 59 A K H >X S+ 0 0 11 -4,-1.3 3,-1.6 1,-0.2 4,-1.3 0.622 77.7 100.0 -82.1 -14.9 23.7 2.2 19.4 56 60 A T H XX S+ 0 0 0 -4,-1.3 4,-2.8 -3,-0.6 3,-0.8 0.845 79.2 50.2 -38.3 -56.0 24.8 5.5 17.9 57 61 A P H 34 S+ 0 0 21 0, 0.0 -1,-0.3 0, 0.0 6,-0.3 0.803 110.3 52.0 -59.1 -26.8 21.3 6.8 17.1 58 62 A E H <4 S+ 0 0 23 -3,-1.6 -2,-0.2 -4,-0.2 -3,-0.1 0.762 116.9 38.9 -78.8 -26.0 20.1 6.0 20.6 59 63 A L H << S+ 0 0 8 -4,-1.3 419,-0.2 -3,-0.8 -3,-0.1 0.784 109.7 58.6 -94.2 -34.8 23.1 7.9 22.2 60 64 A I S >< S- 0 0 0 -4,-2.8 3,-2.2 -5,-0.2 -1,-0.2 -0.879 74.8-147.5-105.9 107.9 23.3 11.0 19.9 61 65 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -59,-0.0 0.781 92.6 39.9 -37.4 -53.4 20.0 13.0 19.8 62 66 A M T 3 S+ 0 0 4 474,-0.1 2,-0.3 -61,-0.0 -59,-0.2 0.207 88.8 114.5 -93.0 19.2 20.2 14.3 16.2 63 67 A C < - 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