==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 12-FEB-09 3G8D . COMPND 2 MOLECULE: BIOTIN CARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.Y.CHOU,L.P.YU,L.TONG . 817 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30643.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 564 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 141 17.3 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 . 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 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.7 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 0 6 0 0 6 4 1 4 0 0 4 0 0 1 1 1 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 . 5 3 2 6 1 2 2 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 0 1 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 97 0, 0.0 243,-0.1 0, 0.0 242,-0.0 0.000 360.0 360.0 360.0 161.2 24.8 -1.9 56.9 2 2 A L - 0 0 13 241,-0.2 25,-0.2 1,-0.1 3,-0.1 -0.368 360.0-139.8 -48.0 131.2 23.3 -5.3 57.3 3 3 A D S S- 0 0 82 1,-0.3 24,-2.6 23,-0.2 2,-0.3 0.917 75.9 -5.5 -65.2 -43.0 25.6 -7.7 55.4 4 4 A K E -a 27 0A 30 22,-0.2 72,-2.9 70,-0.1 73,-1.0 -0.983 64.5-167.4-161.3 133.6 22.8 -9.9 54.0 5 5 A I E -ab 28 77A 0 22,-2.4 24,-2.2 -2,-0.3 2,-0.4 -0.943 20.9-128.1-129.9 150.7 19.1 -10.1 54.3 6 6 A V E -ab 29 78A 0 71,-2.4 73,-2.7 -2,-0.3 2,-1.0 -0.826 18.9-143.2 -88.8 132.1 16.3 -12.6 53.4 7 7 A I E -ab 30 79A 0 22,-2.7 2,-1.6 -2,-0.4 24,-0.9 -0.869 14.4-165.2 -95.8 99.0 13.4 -11.0 51.5 8 8 A A + 0 0 5 71,-2.3 77,-0.3 -2,-1.0 2,-0.2 -0.458 60.1 58.8 -88.1 62.8 10.5 -12.9 53.0 9 9 A N - 0 0 3 -2,-1.6 2,-0.2 22,-0.3 22,-0.1 -0.885 66.0-136.7-163.6-165.8 8.0 -11.9 50.4 10 10 A R >> + 0 0 23 -2,-0.2 4,-1.3 22,-0.1 3,-0.5 -0.849 53.8 29.2-151.9 179.5 7.2 -12.0 46.7 11 11 A G H 3> S- 0 0 3 -2,-0.2 4,-1.5 1,-0.2 30,-0.2 -0.158 114.5 -14.3 62.7-145.5 6.0 -9.9 43.7 12 12 A E H 3> S+ 0 0 5 302,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.866 134.6 53.1 -66.2 -39.6 6.4 -6.1 43.5 13 13 A I H <> S+ 0 0 1 -3,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.879 106.3 52.9 -67.1 -35.5 7.3 -5.5 47.2 14 14 A A H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.897 111.2 47.2 -63.4 -40.2 10.1 -8.1 47.1 15 15 A L H X S+ 0 0 1 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.903 109.6 54.2 -67.2 -41.8 11.5 -6.3 44.0 16 16 A R H X S+ 0 0 6 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.903 111.5 44.8 -53.9 -46.1 11.1 -2.9 45.8 17 17 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.899 109.3 55.8 -68.8 -41.2 13.1 -4.3 48.8 18 18 A L H X S+ 0 0 1 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.909 105.5 52.3 -57.9 -42.7 15.8 -5.8 46.6 19 19 A R H X S+ 0 0 25 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.911 109.1 48.8 -62.5 -43.4 16.4 -2.4 44.9 20 20 A A H X S+ 0 0 1 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.904 111.2 51.2 -63.0 -41.7 16.9 -0.7 48.2 21 21 A C H X>S+ 0 0 0 -4,-2.4 5,-2.9 2,-0.2 4,-0.7 0.921 108.9 50.7 -57.0 -47.9 19.3 -3.5 49.3 22 22 A K H ><5S+ 0 0 68 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.918 109.2 51.4 -58.6 -44.0 21.3 -3.0 46.1 23 23 A E H 3<5S+ 0 0 31 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.865 114.7 42.6 -60.7 -38.2 21.6 0.7 46.6 24 24 A L H 3<5S- 0 0 35 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.441 114.8-114.0 -88.4 -1.1 22.9 0.1 50.2 25 25 A G T <<5 + 0 0 65 -3,-0.9 2,-0.4 -4,-0.7 -3,-0.2 0.742 63.6 151.7 72.6 25.4 25.2 -2.7 49.2 26 26 A I < - 0 0 4 -5,-2.9 -1,-0.3 -6,-0.2 -22,-0.2 -0.757 46.5-122.4 -89.6 129.6 23.3 -5.3 51.2 27 27 A K E -a 4 0A 98 -24,-2.6 -22,-2.4 -2,-0.4 2,-0.4 -0.442 29.5-137.0 -70.0 144.9 23.4 -8.9 49.8 28 28 A T E -a 5 0A 0 -24,-0.2 19,-1.9 -2,-0.1 2,-0.5 -0.862 18.7-168.6-114.6 139.3 20.1 -10.4 49.0 29 29 A V E -ac 6 47A 0 -24,-2.2 -22,-2.7 -2,-0.4 2,-0.8 -0.986 13.4-157.1-119.1 116.4 18.5 -13.8 49.6 30 30 A A E -ac 7 48A 0 17,-2.8 19,-2.4 -2,-0.5 2,-0.4 -0.858 4.9-166.0 -95.4 108.1 15.3 -14.5 47.7 31 31 A V E + c 0 49A 0 -24,-0.9 2,-0.3 -2,-0.8 -22,-0.3 -0.797 22.2 167.7 -87.1 134.5 13.2 -17.2 49.4 32 32 A H E - c 0 50A 9 17,-2.3 19,-2.4 -2,-0.4 20,-0.6 -0.979 34.2-112.0-147.9 157.0 10.4 -18.3 47.0 33 33 A S E > - c 0 52A 0 -2,-0.3 3,-1.6 17,-0.2 21,-0.2 -0.358 44.7 -97.8 -78.4 169.2 7.8 -21.0 46.4 34 34 A S T 3 S+ 0 0 39 18,-2.0 3,-0.5 1,-0.3 -1,-0.1 0.730 125.6 53.8 -58.9 -23.5 8.0 -23.6 43.6 35 35 A A T 3 S+ 0 0 36 1,-0.2 -1,-0.3 2,-0.1 3,-0.3 0.556 103.1 57.4 -88.7 -8.5 5.7 -21.4 41.5 36 36 A D X + 0 0 1 -3,-1.6 3,-1.6 1,-0.2 -1,-0.2 0.082 61.8 114.5-113.4 21.4 7.8 -18.2 41.9 37 37 A R T 3 S+ 0 0 139 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.807 81.3 51.5 -62.1 -27.1 11.2 -19.3 40.4 38 38 A D T 3 S+ 0 0 102 -3,-0.3 -1,-0.3 268,-0.1 -2,-0.1 0.257 76.7 131.7 -98.9 11.0 10.7 -16.8 37.6 39 39 A L <> - 0 0 0 -3,-1.6 4,-2.4 1,-0.1 5,-0.2 -0.387 65.3-123.5 -57.7 138.9 9.9 -13.7 39.7 40 40 A K H > S+ 0 0 16 260,-0.4 4,-1.5 1,-0.2 5,-0.2 0.907 111.4 48.7 -54.1 -46.5 12.0 -10.7 38.6 41 41 A H H > S+ 0 0 0 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.871 109.1 53.7 -67.3 -34.2 13.5 -10.2 42.1 42 42 A V H 4 S+ 0 0 10 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.934 109.4 48.7 -60.3 -45.8 14.4 -13.9 42.3 43 43 A L H < S+ 0 0 100 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.787 117.1 42.3 -64.7 -27.6 16.2 -13.6 39.0 44 44 A L H < S+ 0 0 43 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.596 92.1 106.6 -93.8 -13.9 18.1 -10.5 40.3 45 45 A A S < S- 0 0 16 -4,-1.3 -16,-0.1 -3,-0.5 3,-0.1 -0.245 72.1-128.7 -72.5 155.4 18.9 -11.7 43.8 46 46 A D S S+ 0 0 91 -18,-0.3 2,-0.3 1,-0.2 -17,-0.2 0.896 93.3 11.3 -69.4 -41.8 22.4 -12.7 44.9 47 47 A E E S-c 29 0A 71 -19,-1.9 -17,-2.8 2,-0.0 2,-0.3 -0.960 70.1-159.9-135.3 151.5 21.2 -16.1 46.3 48 48 A T E -c 30 0A 71 -2,-0.3 2,-0.4 -19,-0.2 -17,-0.2 -0.978 4.8-171.7-134.1 146.6 17.9 -17.9 46.0 49 49 A V E -c 31 0A 32 -19,-2.4 -17,-2.3 -2,-0.3 2,-0.7 -0.982 21.6-137.6-138.9 125.0 16.2 -20.7 48.1 50 50 A C E -c 32 0A 60 -2,-0.4 -17,-0.2 -19,-0.2 -19,-0.1 -0.755 23.5-177.9 -79.6 116.3 13.1 -22.6 47.2 51 51 A I E - 0 0 14 -19,-2.4 -18,-0.2 -2,-0.7 -1,-0.1 0.473 52.5 -38.2 -99.6 -3.7 11.2 -22.7 50.6 52 52 A G E S-c 33 0A 17 -20,-0.6 -18,-2.0 13,-0.1 -1,-0.2 -0.960 72.7 -54.3 166.0 177.3 8.1 -24.8 49.6 53 53 A P - 0 0 62 0, 0.0 5,-0.1 0, 0.0 -2,-0.1 -0.083 69.4 -79.8 -71.2-179.5 5.4 -25.7 47.1 54 54 A A S S+ 0 0 8 -21,-0.2 5,-0.1 5,-0.1 -21,-0.1 0.855 98.3 92.3 -55.2 -50.4 3.1 -23.2 45.6 55 55 A P S >> S- 0 0 68 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.213 75.0-133.8 -56.4 134.6 0.4 -22.6 48.4 56 56 A S G >4>S+ 0 0 24 254,-0.4 5,-2.7 1,-0.3 3,-1.4 0.851 102.9 67.1 -54.3 -39.4 1.4 -19.7 50.6 57 57 A V G 345S+ 0 0 108 1,-0.3 -1,-0.3 3,-0.2 -3,-0.1 0.847 109.8 35.7 -48.9 -38.8 0.6 -21.8 53.7 58 58 A K G <45S+ 0 0 124 -3,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.384 133.0 21.1-102.3 2.1 3.6 -24.0 52.9 59 59 A S T X<5S+ 0 0 0 -3,-1.4 3,-2.1 -4,-0.5 7,-0.2 0.416 127.2 25.6-128.6 -86.6 5.9 -21.4 51.5 60 60 A Y T 3 5S+ 0 0 2 1,-0.3 25,-0.3 5,-0.1 -3,-0.2 0.659 130.8 42.2 -64.7 -15.9 5.6 -17.7 52.4 61 61 A L T 3 - 0 0 49 -3,-2.1 4,-2.0 -6,-0.3 5,-0.2 -0.676 46.8-174.0 -87.4 94.0 6.1 -21.3 56.5 63 63 A I H > S+ 0 0 36 -2,-1.2 4,-2.6 1,-0.2 5,-0.2 0.927 80.2 46.7 -59.2 -52.0 8.1 -20.0 59.5 64 64 A P H > S+ 0 0 93 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.869 111.8 52.7 -59.7 -37.2 10.6 -22.8 60.0 65 65 A A H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.914 112.1 44.6 -62.9 -43.7 11.4 -22.9 56.2 66 66 A I H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.917 114.7 47.7 -68.8 -44.7 12.1 -19.2 56.1 67 67 A I H X S+ 0 0 10 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.924 111.7 51.2 -60.2 -45.3 14.2 -19.3 59.3 68 68 A S H X S+ 0 0 56 -4,-2.6 4,-2.8 -5,-0.2 5,-0.2 0.918 109.5 50.2 -58.7 -44.1 16.1 -22.3 58.0 69 69 A A H X S+ 0 0 2 -4,-2.2 4,-1.8 1,-0.2 6,-0.2 0.915 110.9 49.3 -59.9 -44.2 16.8 -20.5 54.7 70 70 A A H <>S+ 0 0 0 -4,-2.2 5,-2.0 2,-0.2 4,-0.4 0.868 113.3 47.3 -62.1 -40.3 18.1 -17.5 56.6 71 71 A E H ><5S+ 0 0 107 -4,-2.3 3,-1.1 3,-0.2 -2,-0.2 0.955 112.6 47.1 -66.9 -49.6 20.4 -19.7 58.7 72 72 A I H 3<5S+ 0 0 124 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.820 113.3 47.7 -66.8 -31.2 21.8 -21.7 55.8 73 73 A T T 3<5S- 0 0 13 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.517 110.4-120.1 -87.9 -6.8 22.6 -18.6 53.7 74 74 A G T < 5 + 0 0 44 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.790 53.2 164.2 73.6 28.4 24.2 -16.8 56.6 75 75 A A < - 0 0 8 -5,-2.0 -70,-0.2 -6,-0.2 -1,-0.2 -0.301 30.4-158.5 -70.0 160.6 21.8 -13.9 56.5 76 76 A V + 0 0 61 -72,-2.9 25,-2.7 1,-0.2 2,-0.3 0.512 69.7 26.6-115.9 -11.6 21.6 -11.5 59.5 77 77 A A E -bd 5 101A 0 -73,-1.0 -71,-2.4 23,-0.2 2,-0.4 -0.973 60.1-144.4-150.5 159.7 18.1 -10.0 59.0 78 78 A I E -bd 6 102A 0 23,-2.1 25,-2.6 -2,-0.3 -71,-0.2 -0.998 5.6-156.9-132.4 126.8 14.7 -10.7 57.5 79 79 A H E -b 7 0A 1 -73,-2.7 -71,-2.3 -2,-0.4 25,-0.1 -0.932 3.5-168.3-102.2 117.1 12.4 -8.2 55.8 80 80 A P - 0 0 4 0, 0.0 6,-0.4 0, 0.0 5,-0.3 0.524 18.4-159.2 -84.1 -6.0 8.8 -9.4 55.8 81 81 A G - 0 0 1 22,-0.2 142,-0.6 4,-0.1 2,-0.3 -0.427 46.6 -42.1 64.1-137.9 7.5 -6.8 53.3 82 82 A Y S S+ 0 0 32 140,-0.1 3,-0.2 -2,-0.1 142,-0.1 -0.871 108.9 7.4-121.0 161.5 3.7 -6.4 53.7 83 83 A G S > S+ 0 0 36 -2,-0.3 3,-2.4 1,-0.2 4,-0.3 -0.320 101.6 63.5 65.0-154.5 1.0 -9.0 54.2 84 84 A F T 3 S- 0 0 68 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.153 127.2 -18.6 38.8-113.0 2.1 -12.6 54.8 85 85 A L T > S+ 0 0 8 -77,-0.3 3,-1.8 -25,-0.3 -1,-0.3 0.319 104.9 105.9-105.0 6.8 4.1 -12.7 58.1 86 86 A S T < S+ 0 0 1 -3,-2.4 -1,-0.2 -6,-0.4 -2,-0.1 0.811 93.2 31.9 -58.8 -33.5 4.9 -9.0 58.4 87 87 A E T 3 S+ 0 0 74 -4,-0.3 2,-0.8 -3,-0.3 -1,-0.3 0.030 89.5 115.4-113.8 24.1 2.3 -8.6 61.2 88 88 A N <> - 0 0 57 -3,-1.8 4,-2.2 1,-0.2 3,-0.4 -0.849 48.6-165.6 -93.2 103.8 2.7 -12.1 62.6 89 89 A A H > S+ 0 0 10 -2,-0.8 4,-2.4 1,-0.3 5,-0.2 0.850 87.1 57.5 -63.6 -35.5 4.0 -11.5 66.2 90 90 A N H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.874 107.2 49.0 -60.1 -38.9 5.0 -15.1 66.6 91 91 A F H > S+ 0 0 0 -3,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.951 110.1 49.6 -65.8 -49.1 7.2 -14.8 63.4 92 92 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 -7,-0.2 -2,-0.2 0.894 112.3 50.0 -53.8 -42.9 8.9 -11.5 64.7 93 93 A E H X S+ 0 0 91 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.912 112.1 45.9 -63.9 -45.9 9.6 -13.3 68.0 94 94 A Q H X S+ 0 0 66 -4,-2.1 4,-2.7 2,-0.2 6,-0.2 0.892 109.2 55.0 -66.5 -42.8 11.1 -16.4 66.4 95 95 A V H <>S+ 0 0 0 -4,-2.8 5,-2.1 2,-0.2 -2,-0.2 0.953 114.6 40.6 -52.6 -50.5 13.2 -14.3 64.0 96 96 A E H ><5S+ 0 0 60 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.871 113.0 54.0 -70.4 -36.0 14.7 -12.5 67.0 97 97 A R H 3<5S+ 0 0 213 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.873 104.0 56.8 -63.7 -35.9 15.0 -15.7 69.1 98 98 A S T 3<5S- 0 0 36 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.442 125.7-105.5 -75.9 1.7 16.9 -17.2 66.2 99 99 A G T < 5S+ 0 0 69 -3,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.522 79.4 125.2 89.4 7.2 19.4 -14.3 66.5 100 100 A F < - 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