==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-SEP-07 2VBV . COMPND 2 MOLECULE: RIBOFLAVIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCOCCUS JANNASCHII; . AUTHOR M.D.HARTMANN,M.AMMELBURG,S.DJURANOVIC,J.MARTIN,A.N.LUPAS, . 270 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15556.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 66.7 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 . 88 32.6 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 . 4 1.5 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 . 34 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 2 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 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 . 0 4 5 3 1 0 2 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 51 0, 0.0 141,-0.2 0, 0.0 131,-0.0 0.000 360.0 360.0 360.0 30.0 -24.7 10.2 -22.1 2 2 A V E -A 141 0A 86 139,-0.8 139,-2.3 130,-0.1 2,-0.4 -0.313 360.0-151.4 -57.7 137.1 -22.5 10.4 -19.0 3 3 A K E +A 140 0A 65 137,-0.2 129,-1.7 130,-0.1 2,-0.4 -0.912 19.7 177.6-123.0 140.0 -23.6 8.1 -16.3 4 4 A L E -AB 139 131A 39 135,-2.2 135,-3.1 -2,-0.4 2,-0.4 -0.990 4.6-175.4-138.1 130.2 -23.5 8.1 -12.5 5 5 A M E -AB 138 130A 20 125,-1.6 125,-2.6 -2,-0.4 2,-0.5 -0.994 6.6-170.2-116.0 134.0 -24.8 5.6 -10.1 6 6 A I E -AB 137 129A 40 131,-2.6 131,-2.0 -2,-0.4 2,-0.5 -0.975 8.1-175.1-126.3 117.8 -24.5 6.5 -6.4 7 7 A I E - B 0 128A 1 121,-2.2 121,-2.3 -2,-0.5 2,-0.4 -0.956 17.8-148.7-124.5 115.8 -25.4 3.7 -4.0 8 8 A E E + B 0 127A 107 -2,-0.5 41,-0.8 119,-0.2 2,-0.3 -0.662 25.5 178.9 -69.3 133.2 -25.6 3.8 -0.2 9 9 A G E -CB 48 126A 3 117,-3.0 117,-2.2 -2,-0.4 2,-0.4 -0.987 27.1-119.6-139.3 149.9 -24.6 0.5 1.3 10 10 A E E -CB 47 125A 78 37,-2.7 37,-3.4 -2,-0.3 115,-0.2 -0.739 29.3-116.6 -93.5 130.3 -24.4 -0.6 5.0 11 11 A V E +C 46 0A 0 113,-3.4 112,-2.7 -2,-0.4 2,-0.3 -0.438 46.1 172.2 -63.0 130.1 -21.0 -1.8 6.3 12 12 A V E -C 45 0A 23 33,-1.8 33,-0.6 110,-0.2 2,-0.4 -0.955 30.6-128.6-144.2 157.7 -21.4 -5.4 7.3 13 13 A S - 0 0 74 -2,-0.3 2,-0.1 31,-0.1 31,-0.1 -0.866 29.2-176.7-106.3 143.2 -19.2 -8.4 8.5 14 14 A G - 0 0 41 -2,-0.4 -1,-0.0 87,-0.0 0, 0.0 -0.244 46.4 -55.1-119.8-150.7 -19.4 -11.8 6.8 15 15 A L S S- 0 0 118 -2,-0.1 -2,-0.0 1,-0.1 0, 0.0 0.231 71.9-105.4 -84.4 17.2 -18.0 -15.3 7.1 16 16 A G S S+ 0 0 63 1,-0.1 3,-0.4 3,-0.0 4,-0.4 0.498 85.4 121.7 77.9 5.7 -14.3 -14.4 7.0 17 17 A E > + 0 0 108 1,-0.2 4,-0.8 2,-0.1 3,-0.3 0.680 48.7 76.1 -83.6 -15.0 -13.9 -15.7 3.4 18 18 A G H >> S+ 0 0 15 1,-0.2 4,-1.6 25,-0.2 3,-0.6 0.903 88.6 58.6 -59.1 -42.2 -12.6 -12.5 1.6 19 19 A R H 3> S+ 0 0 134 -3,-0.4 4,-1.5 1,-0.3 -1,-0.2 0.823 95.1 57.3 -72.2 -38.5 -9.1 -12.6 2.8 20 20 A Y H 3> S+ 0 0 91 -4,-0.4 4,-1.2 -3,-0.3 -1,-0.3 0.915 111.8 46.1 -59.4 -34.2 -7.9 -16.0 1.7 21 21 A F H << S+ 0 0 87 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.862 112.6 47.3 -80.7 -33.1 -8.7 -15.0 -1.9 22 22 A L H < S+ 0 0 6 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.664 110.3 54.4 -83.5 -9.0 -7.1 -11.6 -1.8 23 23 A S H < S+ 0 0 24 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.772 79.5 106.3 -88.0 -31.5 -4.0 -13.0 -0.2 24 24 A L S >X S- 0 0 24 -4,-1.2 4,-2.0 -5,-0.2 3,-1.4 -0.276 77.7-130.6 -49.2 113.6 -3.5 -15.6 -3.1 25 25 A P H 3> S+ 0 0 81 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.802 101.5 54.3 -50.6 -43.0 -0.6 -14.1 -5.0 26 26 A P H 3> S+ 0 0 32 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.863 112.1 47.0 -55.3 -38.8 -2.0 -14.3 -8.6 27 27 A Y H <> S+ 0 0 9 -3,-1.4 4,-2.3 2,-0.2 5,-0.3 0.941 108.0 54.8 -64.8 -47.7 -5.0 -12.4 -7.3 28 28 A K H X S+ 0 0 30 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.943 115.7 41.0 -44.1 -56.3 -2.7 -9.9 -5.5 29 29 A E H X S+ 0 0 132 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.869 109.4 53.9 -61.7 -52.5 -1.0 -9.4 -9.0 30 30 A I H X S+ 0 0 29 -4,-2.6 4,-3.5 1,-0.2 5,-0.2 0.927 112.0 47.2 -54.6 -41.2 -4.0 -9.3 -11.3 31 31 A F H X S+ 0 0 6 -4,-2.3 4,-1.8 2,-0.2 6,-0.7 0.843 109.4 53.1 -70.9 -32.7 -5.6 -6.5 -9.1 32 32 A K H X S+ 0 0 124 -4,-1.4 4,-1.9 -5,-0.3 -1,-0.2 0.934 117.4 39.8 -57.9 -47.3 -2.3 -4.5 -9.1 33 33 A K H < S+ 0 0 108 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.945 119.9 42.8 -68.8 -51.5 -2.4 -4.8 -12.9 34 34 A I H < S+ 0 0 43 -4,-3.5 -1,-0.2 -5,-0.2 -3,-0.2 0.707 133.3 17.8 -71.1 -26.0 -6.1 -4.2 -13.4 35 35 A L H < S- 0 0 36 -4,-1.8 -3,-0.2 2,-0.2 -2,-0.2 0.547 96.4-116.9-125.7 -17.2 -6.4 -1.3 -10.9 36 36 A G S < S+ 0 0 58 -4,-1.9 2,-0.3 -5,-0.5 -4,-0.2 0.881 85.2 78.5 72.8 35.3 -2.9 0.0 -10.1 37 37 A F S S- 0 0 34 -6,-0.7 -2,-0.2 -5,-0.1 -1,-0.2 -0.910 78.6-119.6-162.3 152.4 -3.0 -0.9 -6.5 38 38 A E - 0 0 120 -2,-0.3 -10,-0.1 -6,-0.1 -9,-0.1 -0.825 41.4-127.1 -85.7 114.5 -2.5 -3.9 -4.3 39 39 A P - 0 0 2 0, 0.0 73,-0.1 0, 0.0 74,-0.1 -0.387 22.7-106.8 -62.6 140.5 -5.7 -4.4 -2.4 40 40 A Y - 0 0 95 70,-3.3 2,-2.0 72,-0.2 70,-0.4 -0.458 53.1 -95.5 -50.0 148.5 -5.5 -4.7 1.3 41 41 A E S S+ 0 0 69 70,-0.1 2,-0.3 68,-0.1 -18,-0.1 -0.437 95.4 57.0 -84.9 70.3 -6.2 -8.4 1.8 42 42 A G S S- 0 0 14 -2,-2.0 2,-0.4 68,-0.2 68,-0.3 -0.934 74.9-114.8-168.9 176.6 -9.9 -8.4 2.5 43 43 A T - 0 0 22 -2,-0.3 2,-0.9 66,-0.1 66,-0.2 -0.973 19.4-138.2-129.5 122.2 -13.2 -7.4 1.0 44 44 A L E - D 0 108A 17 64,-2.4 64,-2.6 -2,-0.4 2,-0.3 -0.641 24.5-148.8 -73.0 103.4 -15.4 -4.7 2.7 45 45 A N E -CD 12 107A 15 -2,-0.9 -33,-1.8 -33,-0.6 2,-0.4 -0.589 12.8-167.9 -76.6 137.0 -18.9 -6.1 2.3 46 46 A L E -CD 11 106A 0 60,-2.4 60,-2.1 -2,-0.3 2,-0.5 -0.997 16.0-136.2-125.6 133.2 -21.6 -3.5 2.0 47 47 A K E -CD 10 105A 92 -37,-3.4 -37,-2.7 -2,-0.4 2,-0.3 -0.768 30.0-138.7 -93.5 129.6 -25.3 -4.5 2.3 48 48 A L E -C 9 0A 13 56,-2.8 -39,-0.2 -2,-0.5 56,-0.1 -0.614 23.4-126.8-105.8 147.2 -27.5 -3.0 -0.3 49 49 A D S S- 0 0 79 -41,-0.8 2,-0.3 -2,-0.3 -1,-0.1 0.623 98.0 -11.8 -37.7 -30.5 -30.9 -1.3 -0.8 50 50 A R S S- 0 0 108 54,-0.1 -1,-0.1 53,-0.1 -2,-0.1 -0.965 97.6 -53.7-172.9 167.3 -31.5 -3.9 -3.6 51 51 A E - 0 0 140 -2,-0.3 2,-0.4 1,-0.1 53,-0.3 -0.101 53.3-134.5 -59.1 149.7 -29.8 -6.5 -5.8 52 52 A F - 0 0 23 51,-2.4 2,-0.5 53,-0.1 53,-0.1 -0.870 10.9-158.1-114.5 144.9 -26.7 -5.4 -7.7 53 53 A D > - 0 0 65 -2,-0.4 3,-0.9 1,-0.1 51,-0.0 -0.898 11.6-179.1-125.2 99.9 -25.8 -6.1 -11.3 54 54 A I G > S+ 0 0 7 -2,-0.5 3,-1.8 1,-0.2 5,-0.4 0.827 79.8 71.2 -62.4 -31.4 -22.2 -5.9 -12.3 55 55 A N G 3 S+ 0 0 68 1,-0.3 -1,-0.2 3,-0.1 79,-0.1 0.698 85.3 64.8 -66.4 -18.2 -23.1 -6.7 -15.9 56 56 A K G < S+ 0 0 88 -3,-0.9 78,-1.3 78,-0.1 -1,-0.3 0.368 101.3 67.7 -78.2 6.7 -24.8 -3.3 -16.5 57 57 A F S < S- 0 0 17 -3,-1.8 2,-2.2 76,-0.3 77,-0.2 -0.853 96.9-100.2-132.5 162.1 -21.4 -1.7 -16.1 58 58 A K + 0 0 154 -2,-0.3 -3,-0.1 75,-0.2 -2,-0.1 -0.318 58.7 174.1 -84.4 58.3 -18.1 -1.6 -17.9 59 59 A Y - 0 0 74 -2,-2.2 2,-0.3 -5,-0.4 19,-0.2 -0.131 31.8-131.8 -59.7 152.6 -16.4 -4.2 -15.7 60 60 A I E -E 77 0A 57 17,-2.7 17,-2.3 -26,-0.0 2,-0.3 -0.711 26.9-153.6 -89.8 156.6 -13.0 -5.8 -16.1 61 61 A E E -E 76 0A 102 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -1.000 4.4-133.5-139.7 137.8 -13.1 -9.6 -15.8 62 62 A T - 0 0 3 13,-2.5 13,-0.1 -2,-0.3 3,-0.1 -0.658 18.5-114.6 -97.7 146.8 -10.3 -11.9 -14.7 63 63 A E - 0 0 135 -2,-0.3 -1,-0.1 11,-0.1 12,-0.1 -0.308 40.2-102.2 -59.8 152.4 -9.1 -15.1 -16.2 64 64 A D - 0 0 78 10,-0.1 2,-0.3 -2,-0.0 9,-0.2 -0.404 34.9-145.8 -71.1 158.0 -9.6 -18.2 -14.2 65 65 A F E -P 72 0B 31 7,-2.2 7,-3.5 -3,-0.1 2,-0.4 -0.907 8.5-161.4-121.3 156.8 -6.5 -19.6 -12.4 66 66 A E E +P 71 0B 114 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.980 29.1 130.4-138.4 122.0 -5.7 -23.2 -11.8 67 67 A F E > +P 70 0B 58 3,-1.3 3,-1.9 -2,-0.4 -2,-0.1 -0.950 58.2 30.1-160.1 166.2 -3.2 -24.4 -9.2 68 68 A N T 3 S- 0 0 142 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.887 130.2 -60.5 43.4 48.8 -2.9 -26.8 -6.3 69 69 A G T 3 S+ 0 0 82 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.573 115.2 112.5 65.7 14.9 -5.3 -29.2 -8.1 70 70 A K E < -P 67 0B 119 -3,-1.9 -3,-1.3 2,-0.0 2,-0.5 -0.811 62.8-133.4-125.1 157.6 -8.0 -26.5 -8.0 71 71 A R E -P 66 0B 138 -2,-0.3 2,-0.7 -5,-0.2 -5,-0.2 -0.949 15.5-161.6-114.6 122.8 -10.0 -24.2 -10.3 72 72 A F E -P 65 0B 11 -7,-3.5 -7,-2.2 -2,-0.5 -2,-0.0 -0.914 21.3-136.2-112.5 107.7 -10.3 -20.5 -9.4 73 73 A F - 0 0 77 -2,-0.7 -10,-0.1 -9,-0.2 -11,-0.1 -0.123 23.7 -87.3 -72.1 158.5 -13.1 -18.8 -11.2 74 74 A G - 0 0 3 22,-0.1 23,-1.9 -13,-0.1 2,-0.3 -0.078 37.5-155.2 -53.9 153.3 -13.3 -15.4 -12.9 75 75 A V E - F 0 96A 13 21,-0.2 -13,-2.5 -13,-0.1 2,-0.5 -0.952 11.2-133.4-127.1 151.4 -14.2 -12.4 -10.9 76 76 A K E -EF 61 95A 40 19,-1.8 19,-2.5 -2,-0.3 2,-0.4 -0.948 23.8-167.5-110.0 131.2 -15.7 -9.2 -12.3 77 77 A V E -EF 60 94A 0 -17,-2.3 -17,-2.7 -2,-0.5 17,-0.2 -0.904 8.5-172.6-121.4 141.7 -14.1 -6.0 -11.1 78 78 A L E - F 0 93A 7 15,-1.3 15,-1.9 -2,-0.4 -19,-0.1 -0.918 23.5-129.9-141.5 106.8 -15.4 -2.5 -11.4 79 79 A P E + F 0 92A 53 0, 0.0 13,-0.3 0, 0.0 2,-0.2 -0.261 40.7 163.0 -47.7 142.6 -13.4 0.6 -10.5 80 80 A I E - F 0 91A 2 11,-1.3 11,-1.1 50,-0.1 2,-0.4 -0.786 39.3-111.3-143.7-174.3 -15.5 2.9 -8.3 81 81 A K E -GF 129 90A 37 48,-1.0 48,-3.1 -2,-0.2 2,-0.5 -0.994 24.4-143.1-127.3 125.9 -15.1 5.8 -5.9 82 82 A I E -GF 128 89A 0 7,-4.8 7,-2.8 -2,-0.4 2,-0.7 -0.795 15.0-154.3 -87.5 125.0 -15.7 5.1 -2.2 83 83 A L E +G 127 0A 40 44,-3.8 44,-1.9 -2,-0.5 2,-0.5 -0.908 24.1 162.2-110.2 109.5 -17.4 8.2 -0.7 84 84 A I > - 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