==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 19-DEC-08 2W70 . COMPND 2 MOLECULE: BIOTIN CARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR I.MOCHALKIN,J.R.MILLER . 892 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33477.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 616 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 153 17.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.6 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 . 62 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 254 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.8 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 2 0 6 3 2 5 0 0 4 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 2 2 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 . 4 2 3 6 3 2 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 2 2 0 0 0 2 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 95 0, 0.0 2,-0.1 0, 0.0 313,-0.1 0.000 360.0 360.0 360.0 151.4 43.9 -27.4 26.0 2 2 A L - 0 0 13 311,-0.2 25,-0.2 1,-0.1 3,-0.1 -0.428 360.0-147.6 -64.2 130.2 42.8 -26.3 22.5 3 3 A D S S- 0 0 82 1,-0.3 24,-2.7 23,-0.2 2,-0.3 0.910 72.7 -4.8 -66.9 -44.3 45.6 -24.3 20.9 4 4 A K E -a 27 0A 28 22,-0.2 72,-2.8 70,-0.1 73,-0.8 -0.985 64.7-165.8-157.6 135.9 43.5 -21.9 18.9 5 5 A I E -ab 28 77A 0 22,-2.4 24,-2.3 -2,-0.3 2,-0.5 -0.958 20.7-128.0-131.8 149.9 39.8 -21.6 18.1 6 6 A V E -ab 29 78A 0 71,-2.6 73,-2.6 -2,-0.3 2,-1.0 -0.834 18.9-144.6 -89.6 127.0 37.5 -19.7 15.7 7 7 A I E -ab 30 79A 0 22,-2.5 2,-1.7 -2,-0.5 24,-0.9 -0.845 14.4-164.6 -91.8 98.8 34.8 -17.8 17.4 8 8 A A + 0 0 5 71,-2.4 77,-0.3 -2,-1.0 2,-0.3 -0.424 59.7 56.9 -89.4 61.1 32.0 -18.3 14.8 9 9 A N - 0 0 4 -2,-1.7 2,-0.2 22,-0.3 22,-0.1 -0.899 66.2-135.0-167.4-171.8 29.8 -15.5 16.1 10 10 A R >> + 0 0 20 -2,-0.3 4,-1.4 22,-0.1 3,-0.5 -0.807 54.0 27.6-146.5-178.3 29.5 -11.8 16.9 11 11 A G H 3> S- 0 0 4 -2,-0.2 4,-1.7 1,-0.2 30,-0.2 -0.107 114.2 -12.7 59.8-143.1 28.4 -9.2 19.5 12 12 A E H 3> S+ 0 0 4 372,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.894 135.3 51.4 -66.3 -40.1 28.1 -10.0 23.2 13 13 A I H <> S+ 0 0 1 -3,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.878 106.5 54.3 -68.8 -34.8 28.5 -13.8 22.9 14 14 A A H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.912 111.0 46.3 -62.9 -40.8 31.7 -13.5 20.8 15 15 A L H X S+ 0 0 1 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.908 110.1 54.5 -65.6 -43.1 33.2 -11.3 23.5 16 16 A R H X S+ 0 0 2 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.920 111.3 43.8 -53.5 -49.4 32.0 -13.8 26.2 17 17 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.900 110.3 56.4 -66.4 -40.7 33.8 -16.7 24.4 18 18 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.913 105.9 50.5 -58.3 -46.0 36.9 -14.5 23.8 19 19 A R H X S+ 0 0 9 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.926 110.5 49.0 -58.4 -45.6 37.2 -13.8 27.6 20 20 A A H X S+ 0 0 0 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.917 111.7 49.7 -60.2 -44.4 36.9 -17.6 28.4 21 21 A C H X>S+ 0 0 0 -4,-2.7 5,-2.6 1,-0.2 4,-0.6 0.943 109.6 50.7 -58.7 -49.7 39.6 -18.4 25.8 22 22 A K H ><5S+ 0 0 63 -4,-2.7 3,-1.0 1,-0.2 -2,-0.2 0.899 108.1 52.8 -57.3 -43.4 41.9 -15.7 27.1 23 23 A E H 3<5S+ 0 0 26 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.828 112.9 44.6 -59.0 -34.5 41.5 -17.1 30.7 24 24 A L H 3<5S- 0 0 30 -4,-1.5 -1,-0.2 -3,-0.5 -2,-0.2 0.399 116.0-112.3 -92.5 -0.6 42.4 -20.7 29.4 25 25 A G T <<5 + 0 0 61 -3,-1.0 2,-0.4 -4,-0.6 -3,-0.2 0.684 65.6 151.3 76.4 20.8 45.4 -19.5 27.3 26 26 A I < - 0 0 4 -5,-2.6 -1,-0.3 -6,-0.2 -22,-0.2 -0.727 46.7-123.3 -88.6 126.8 43.6 -20.4 24.0 27 27 A K E -a 4 0A 91 -24,-2.7 -22,-2.4 -2,-0.4 2,-0.4 -0.434 29.0-136.7 -69.2 143.2 44.5 -18.3 21.0 28 28 A T E -a 5 0A 0 -24,-0.2 19,-1.8 -2,-0.1 2,-0.5 -0.852 18.7-168.5-112.7 137.5 41.5 -16.6 19.3 29 29 A V E -ac 6 47A 0 -24,-2.3 -22,-2.5 -2,-0.4 2,-0.8 -0.985 13.2-158.0-117.8 116.4 40.5 -16.1 15.7 30 30 A A E -ac 7 48A 0 17,-2.8 19,-2.3 -2,-0.5 2,-0.4 -0.857 4.6-165.5 -98.4 107.7 37.7 -13.6 15.2 31 31 A V E + c 0 49A 0 -24,-0.9 2,-0.3 -2,-0.8 -22,-0.3 -0.772 22.6 168.7 -86.2 137.8 35.8 -14.2 12.0 32 32 A H E - c 0 50A 6 17,-2.2 19,-2.5 -2,-0.4 20,-0.7 -0.992 35.3-110.8-151.5 154.8 33.7 -11.2 11.1 33 33 A S E > - c 0 52A 0 -2,-0.3 3,-1.6 17,-0.2 21,-0.1 -0.340 43.1-103.6 -75.3 166.5 31.6 -9.5 8.5 34 34 A S G > S+ 0 0 50 18,-1.9 3,-0.6 1,-0.3 -1,-0.1 0.741 123.2 56.8 -65.6 -21.8 32.7 -6.3 6.8 35 35 A A G 3 S+ 0 0 40 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.560 103.5 55.4 -80.5 -9.4 30.2 -4.4 9.0 36 36 A D G X + 0 0 1 -3,-1.6 3,-1.7 1,-0.2 -1,-0.2 0.054 62.8 118.1-117.4 23.9 31.8 -5.8 12.2 37 37 A R T < S+ 0 0 128 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.786 81.9 47.3 -61.9 -28.6 35.4 -4.7 11.9 38 38 A D T 3 S+ 0 0 101 -3,-0.2 -1,-0.3 338,-0.1 2,-0.1 0.130 76.9 135.6-105.7 19.3 35.1 -2.6 15.0 39 39 A L <> - 0 0 0 -3,-1.7 4,-2.2 1,-0.1 3,-0.2 -0.443 64.2-121.5 -58.9 138.4 33.4 -5.2 17.3 40 40 A K H > S+ 0 0 15 330,-0.4 4,-1.4 1,-0.2 5,-0.1 0.904 112.3 47.8 -51.4 -47.7 35.0 -5.1 20.7 41 41 A H H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.866 108.7 55.1 -66.8 -33.3 36.0 -8.8 20.5 42 42 A V H 4 S+ 0 0 10 -3,-0.2 3,-0.4 1,-0.2 -1,-0.2 0.920 108.3 48.7 -61.5 -44.4 37.4 -8.4 17.0 43 43 A L H < S+ 0 0 104 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.779 116.3 43.6 -66.4 -27.6 39.7 -5.6 18.3 44 44 A L H < S+ 0 0 45 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.587 91.6 108.8 -90.9 -12.9 40.8 -7.8 21.2 45 45 A A S < S- 0 0 15 -4,-1.2 3,-0.1 -3,-0.4 -16,-0.1 -0.255 70.8-131.2 -72.6 155.1 41.3 -11.1 19.2 46 46 A D S S+ 0 0 95 -18,-0.3 2,-0.3 1,-0.2 -17,-0.2 0.873 93.2 11.6 -71.1 -39.7 44.7 -12.5 18.5 47 47 A E E S-c 29 0A 71 -19,-1.8 -17,-2.8 2,-0.0 2,-0.3 -0.981 70.4-156.7-136.2 150.2 43.9 -12.9 14.8 48 48 A T E -c 30 0A 73 -2,-0.3 2,-0.4 -19,-0.2 -17,-0.2 -0.963 6.0-172.7-128.8 146.7 41.1 -11.6 12.6 49 49 A V E -c 31 0A 34 -19,-2.3 -17,-2.2 -2,-0.3 2,-0.7 -0.976 19.9-141.4-137.5 120.4 39.6 -12.8 9.3 50 50 A C E -c 32 0A 52 -2,-0.4 -17,-0.2 -19,-0.2 -19,-0.1 -0.752 19.6-174.9 -80.9 119.4 36.9 -10.9 7.3 51 51 A I E - 0 0 15 -19,-2.5 -18,-0.2 -2,-0.7 -1,-0.1 0.507 51.4 -54.5-100.7 -4.9 34.7 -13.7 6.0 52 52 A G E S-c 33 0A 16 -20,-0.7 -18,-1.9 13,-0.1 -1,-0.3 -0.923 72.1 -39.5 156.9-178.2 32.3 -11.6 3.9 53 53 A P - 0 0 65 0, 0.0 5,-0.1 0, 0.0 -2,-0.0 -0.065 68.6 -85.8 -68.2 174.9 29.9 -8.7 3.5 54 54 A A S S+ 0 0 9 -21,-0.1 6,-0.3 5,-0.1 5,-0.1 0.840 96.5 93.6 -55.3 -48.7 27.4 -7.6 6.1 55 55 A P S >> S- 0 0 64 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.235 78.5-130.3 -55.7 131.5 24.4 -9.9 5.3 56 56 A S G >4>S+ 0 0 23 324,-0.4 5,-2.7 1,-0.3 3,-1.1 0.801 101.9 67.4 -56.9 -32.8 24.6 -13.0 7.4 57 57 A V G 345S+ 0 0 99 1,-0.3 -1,-0.3 3,-0.2 -3,-0.1 0.842 109.3 38.0 -56.3 -32.5 24.1 -15.4 4.5 58 58 A K G <45S+ 0 0 113 -3,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.458 133.8 18.9 -99.8 -1.0 27.5 -14.3 3.1 59 59 A S T X<5S+ 0 0 0 -3,-1.1 3,-1.8 -4,-0.6 7,-0.2 0.446 128.0 23.3-127.1 -88.3 29.3 -14.0 6.5 60 60 A Y T 3 5S+ 0 0 2 1,-0.3 25,-0.3 -6,-0.3 -3,-0.2 0.630 131.9 40.1 -70.4 -14.7 28.0 -15.7 9.8 61 61 A L T 3 - 0 0 28 -3,-1.8 4,-2.1 -6,-0.4 5,-0.2 -0.645 45.5-175.2 -84.4 93.4 28.7 -18.9 5.2 63 63 A I H > S+ 0 0 24 -2,-1.3 4,-2.5 1,-0.2 5,-0.3 0.913 79.0 48.1 -60.9 -51.0 30.0 -22.4 6.0 64 64 A P H > S+ 0 0 85 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.880 112.3 50.6 -56.0 -40.4 32.9 -22.5 3.4 65 65 A A H > S+ 0 0 20 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.899 112.0 46.0 -65.4 -42.4 34.1 -19.1 4.6 66 66 A I H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.921 114.7 46.3 -69.0 -44.6 34.2 -20.0 8.3 67 67 A I H X S+ 0 0 10 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.914 111.5 53.0 -65.1 -40.6 35.8 -23.4 7.7 68 68 A S H X S+ 0 0 66 -4,-2.6 4,-2.9 -5,-0.3 5,-0.2 0.896 106.1 53.4 -60.0 -41.5 38.4 -21.7 5.3 69 69 A A H X S+ 0 0 2 -4,-2.1 4,-1.6 2,-0.2 6,-0.3 0.893 109.0 49.3 -58.7 -42.2 39.2 -19.2 8.1 70 70 A A H X>S+ 0 0 0 -4,-1.8 5,-2.0 2,-0.2 4,-0.8 0.930 113.3 47.4 -62.6 -44.4 39.9 -22.1 10.5 71 71 A E H ><5S+ 0 0 112 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.941 111.9 47.3 -62.2 -50.9 42.1 -23.7 7.9 72 72 A I H 3<5S+ 0 0 142 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.813 116.1 44.4 -65.0 -31.2 44.2 -20.6 7.0 73 73 A T H 3<5S- 0 0 17 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.527 108.3-119.6 -90.9 -8.8 44.8 -19.7 10.6 74 74 A G T <<5 + 0 0 45 -3,-0.8 -3,-0.2 -4,-0.8 -4,-0.1 0.814 53.6 165.2 71.4 29.8 45.7 -23.2 11.8 75 75 A A < - 0 0 5 -5,-2.0 -70,-0.2 -6,-0.3 -1,-0.2 -0.371 29.4-157.5 -72.3 158.7 42.8 -23.2 14.3 76 76 A V + 0 0 50 -72,-2.8 25,-2.6 1,-0.2 2,-0.3 0.515 67.6 24.8-115.1 -11.8 41.7 -26.6 15.8 77 77 A A E -bd 5 101A 0 -73,-0.8 -71,-2.6 23,-0.3 2,-0.4 -0.970 59.8-141.1-152.9 160.9 38.1 -25.9 16.9 78 78 A I E -bd 6 102A 0 23,-2.6 25,-2.5 -2,-0.3 -71,-0.2 -0.995 6.5-157.8-133.2 123.7 35.1 -23.7 16.2 79 79 A H E -b 7 0A 1 -73,-2.6 -71,-2.4 -2,-0.4 25,-0.1 -0.919 4.6-169.0 -99.6 118.0 32.7 -22.3 18.8 80 80 A P - 0 0 6 0, 0.0 6,-0.4 0, 0.0 5,-0.3 0.496 16.1-161.6 -86.3 -4.2 29.4 -21.5 17.2 81 81 A G - 0 0 1 22,-0.2 212,-0.5 4,-0.1 2,-0.3 -0.350 46.6 -41.1 59.1-136.9 27.9 -19.5 20.2 82 82 A Y S S+ 0 0 39 210,-0.1 3,-0.1 212,-0.0 212,-0.1 -0.857 108.3 10.1-119.8 162.3 24.1 -19.2 19.9 83 83 A G S > S+ 0 0 40 -2,-0.3 3,-2.6 1,-0.2 4,-0.2 -0.348 101.0 61.3 66.9-156.0 21.9 -18.5 16.9 84 84 A F T 3 S- 0 0 69 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.125 127.8 -17.0 39.6-112.7 23.5 -18.6 13.4 85 85 A L T > S+ 0 0 9 -77,-0.3 3,-1.9 -25,-0.3 -1,-0.3 0.304 103.3 108.4-104.3 9.7 24.9 -22.1 12.8 86 86 A S T < S+ 0 0 4 -3,-2.6 -1,-0.2 -6,-0.4 -2,-0.1 0.779 89.4 34.4 -65.1 -28.6 24.9 -23.4 16.4 87 87 A E T 3 S+ 0 0 61 -3,-0.3 2,-0.9 -4,-0.2 -1,-0.3 0.115 89.1 116.3-108.0 17.5 22.0 -25.8 15.9 88 88 A N <> - 0 0 56 -3,-1.9 4,-2.2 1,-0.2 5,-0.2 -0.783 43.5-172.4 -93.0 101.4 23.0 -26.6 12.3 89 89 A A H > S+ 0 0 10 -2,-0.9 4,-2.8 1,-0.2 -1,-0.2 0.870 85.2 55.6 -63.9 -38.5 23.8 -30.4 12.3 90 90 A N H > S+ 0 0 90 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.892 108.2 49.6 -61.3 -38.7 25.1 -30.3 8.7 91 91 A F H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.945 111.2 48.1 -62.9 -49.9 27.5 -27.5 9.7 92 92 A A H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.907 112.1 50.6 -54.9 -45.0 28.7 -29.5 12.7 93 93 A E H X S+ 0 0 76 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.932 111.2 47.3 -58.8 -49.0 29.1 -32.6 10.5 94 94 A Q H X S+ 0 0 68 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.871 109.5 54.2 -61.6 -41.0 31.2 -30.6 7.9 95 95 A V H <>S+ 0 0 0 -4,-2.7 5,-2.3 2,-0.2 4,-0.4 0.936 114.0 40.9 -57.7 -48.4 33.4 -29.1 10.7 96 96 A E H ><5S+ 0 0 69 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.902 113.7 53.0 -69.6 -41.4 34.2 -32.6 12.0 97 97 A R H 3<5S+ 0 0 167 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.863 107.0 54.2 -56.5 -38.9 34.6 -34.0 8.4 98 98 A S T 3<5S- 0 0 51 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.565 124.4-106.1 -76.4 -10.4 37.0 -31.1 7.8 99 99 A G T < 5S+ 0 0 65 -3,-1.2 2,-0.3 -4,-0.4 -3,-0.2 0.513 79.5 119.1 100.6 9.3 39.1 -32.2 10.8 100 100 A F < - 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