==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 08-APR-02 1LD3 . COMPND 2 MOLECULE: FERROCHELATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR D.LECEROF,M.N.FODJE,R.A.LEON,U.OLSSON,A.HANSSON, . 309 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14302.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 75.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 0 0.0 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 . 19 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 39.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 4.5 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 2 0 0 0 1 1 0 1 1 1 1 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 1 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 2 A S 0 0 175 0, 0.0 2,-0.1 0, 0.0 74,-0.0 0.000 360.0 360.0 360.0 -11.0 9.5 59.7 33.8 2 3 A R - 0 0 99 75,-0.1 2,-0.5 1,-0.1 75,-0.2 -0.405 360.0-124.4 -79.1 153.3 9.0 56.8 31.5 3 4 A K E -a 77 0A 93 73,-2.3 75,-2.1 -2,-0.1 2,-0.3 -0.855 23.7-131.6 -98.9 126.5 7.8 57.0 27.9 4 5 A K E +a 78 0A 102 -2,-0.5 2,-0.3 73,-0.2 101,-0.3 -0.601 31.9 174.4 -78.4 128.8 4.7 54.9 27.1 5 6 A M E -a 79 0A 1 73,-2.0 75,-1.2 -2,-0.3 2,-0.4 -0.955 30.3-119.1-134.6 154.5 5.0 52.8 23.9 6 7 A G E -ab 80 107A 0 100,-1.9 102,-2.9 -2,-0.3 2,-0.7 -0.752 16.4-153.2 -92.8 137.8 2.8 50.2 22.3 7 8 A L E -ab 81 108A 0 73,-2.3 75,-2.7 -2,-0.4 2,-1.1 -0.875 11.9-167.5-110.7 96.3 4.2 46.8 21.9 8 9 A L E -ab 82 109A 0 100,-2.0 102,-2.2 -2,-0.7 2,-0.7 -0.719 3.6-173.4 -89.7 97.9 2.5 45.3 18.8 9 10 A V E -ab 83 110A 1 73,-2.5 75,-2.1 -2,-1.1 2,-0.2 -0.825 11.4-165.3 -89.6 116.0 3.2 41.6 18.8 10 11 A M E +ab 84 111A 0 100,-2.8 102,-2.4 -2,-0.7 2,-0.3 -0.666 16.3 152.2-102.7 158.1 1.8 40.1 15.6 11 12 A A - 0 0 10 73,-2.1 81,-0.1 -2,-0.2 75,-0.1 -0.864 51.6 -88.9-158.3-165.8 1.2 36.5 14.7 12 13 A Y - 0 0 87 -2,-0.3 75,-2.7 73,-0.2 74,-1.6 0.926 58.8-124.5 -82.5 -57.9 -0.8 34.1 12.7 13 14 A G - 0 0 3 73,-0.2 -1,-0.1 72,-0.2 76,-0.0 -0.314 18.5-145.2 119.6 158.3 -3.6 33.3 15.0 14 15 A T - 0 0 9 -2,-0.2 71,-0.0 247,-0.0 38,-0.0 -0.966 29.6 -91.7-153.7 148.1 -4.9 29.9 16.2 15 16 A P - 0 0 0 0, 0.0 41,-0.6 0, 0.0 3,-0.1 -0.247 26.0-154.8 -59.1 151.4 -8.4 28.5 17.0 16 17 A Y S S+ 0 0 86 1,-0.4 2,-0.3 39,-0.1 41,-0.1 0.698 76.5 9.3 -98.3 -30.5 -9.3 29.0 20.6 17 18 A K S >> S- 0 0 110 35,-0.1 3,-2.5 1,-0.1 4,-0.5 -0.968 85.1 -97.7-148.7 160.0 -11.7 26.1 20.7 18 19 A E G >4 S+ 0 0 93 -2,-0.3 3,-1.5 1,-0.3 4,-0.3 0.835 117.4 63.5 -47.6 -41.5 -12.7 23.2 18.4 19 20 A E G 34 S+ 0 0 132 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.397 94.9 61.6 -67.9 2.9 -15.7 25.1 17.1 20 21 A D G <> S+ 0 0 5 -3,-2.5 4,-2.7 2,-0.1 -1,-0.3 0.628 75.9 90.9-100.0 -18.9 -13.4 27.8 15.5 21 22 A I H S+ 0 0 78 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.955 114.3 36.1 -51.7 -63.8 -14.1 26.0 10.4 23 24 A R H > S+ 0 0 105 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.829 115.5 58.8 -63.8 -31.6 -13.9 29.8 10.2 24 25 A Y H X S+ 0 0 9 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.984 113.8 34.3 -60.8 -58.0 -10.2 29.7 11.0 25 26 A Y H X S+ 0 0 28 -4,-2.7 4,-2.6 1,-0.2 7,-0.2 0.837 114.7 58.8 -67.5 -31.2 -9.3 27.5 8.0 26 27 A T H <>S+ 0 0 28 -4,-2.5 5,-1.8 -5,-0.3 6,-0.8 0.899 108.7 45.8 -64.0 -38.2 -12.0 29.2 5.9 27 28 A H H ><5S+ 0 0 75 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.952 113.2 49.4 -66.6 -48.4 -10.2 32.4 6.5 28 29 A I H 3<5S+ 0 0 40 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.837 109.9 52.0 -58.4 -35.4 -6.9 30.8 5.7 29 30 A R T ><5S- 0 0 84 -4,-2.6 3,-0.7 -5,-0.1 -1,-0.3 0.051 118.6-112.1 -92.5 24.4 -8.4 29.3 2.5 30 31 A R T < 5S- 0 0 169 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.918 82.6 -31.8 46.0 63.7 -9.6 32.7 1.4 31 32 A G T 3 > - 0 0 135 1,-0.1 4,-2.5 -3,-0.1 3,-0.6 -0.316 36.8 -99.4 -67.3 157.2 -15.4 20.1 3.1 36 37 A P H 3> S+ 0 0 88 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.834 125.0 51.2 -46.0 -40.1 -17.1 18.1 5.9 37 38 A E H 3> S+ 0 0 151 2,-0.2 4,-2.8 1,-0.2 5,-0.1 0.889 108.3 48.8 -67.0 -43.5 -14.3 15.5 5.7 38 39 A M H <> S+ 0 0 73 -3,-0.6 4,-3.4 2,-0.2 5,-0.3 0.981 110.6 53.1 -59.6 -54.2 -11.5 18.1 6.0 39 40 A L H X S+ 0 0 22 -4,-2.5 4,-1.9 1,-0.3 -2,-0.2 0.904 112.0 44.0 -44.7 -54.4 -13.3 19.5 9.0 40 41 A Q H X S+ 0 0 98 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.3 0.892 113.9 50.9 -62.6 -39.0 -13.5 16.1 10.7 41 42 A D H X S+ 0 0 59 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.964 109.5 50.7 -61.9 -49.3 -9.8 15.4 9.8 42 43 A L H X S+ 0 0 9 -4,-3.4 4,-1.9 1,-0.2 -1,-0.2 0.804 107.6 52.0 -56.6 -36.7 -8.7 18.8 11.2 43 44 A K H X S+ 0 0 47 -4,-1.9 4,-1.9 -5,-0.3 -1,-0.2 0.923 108.6 53.3 -68.2 -40.7 -10.5 18.2 14.5 44 45 A D H X S+ 0 0 70 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.886 107.3 49.2 -59.9 -44.8 -8.8 14.8 14.8 45 46 A R H X S+ 0 0 63 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.948 110.7 49.6 -62.8 -47.2 -5.3 16.2 14.3 46 47 A Y H <>S+ 0 0 5 -4,-1.9 5,-2.4 1,-0.2 -1,-0.2 0.859 113.1 48.0 -60.1 -32.3 -5.9 18.9 16.9 47 48 A E H ><5S+ 0 0 133 -4,-1.9 3,-1.4 3,-0.2 -1,-0.2 0.895 108.3 55.8 -72.9 -39.2 -7.1 16.2 19.2 48 49 A A H 3<5S+ 0 0 73 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.757 106.2 49.9 -63.2 -28.7 -4.1 14.1 18.4 49 50 A I T 3<5S- 0 0 30 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.338 133.7 -80.9 -95.4 7.5 -1.6 16.8 19.4 50 51 A G T < 5S- 0 0 58 -3,-1.4 -3,-0.2 -5,-0.2 -2,-0.2 0.627 76.3 -71.2 106.6 16.7 -3.3 17.5 22.8 51 52 A G < - 0 0 26 -5,-2.4 4,-0.2 -6,-0.2 -4,-0.1 -0.087 49.1 -89.4 87.7 168.5 -6.2 19.7 22.0 52 53 A I S >> S+ 0 0 12 1,-0.1 3,-2.8 2,-0.1 4,-0.6 0.900 99.6 78.0 -88.1 -49.0 -6.5 23.3 21.0 53 54 A S H 3> S+ 0 0 86 1,-0.3 4,-1.0 2,-0.2 -1,-0.1 0.762 91.8 57.2 -36.6 -41.4 -6.7 25.5 24.1 54 55 A P H 3> S+ 0 0 63 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.797 100.1 61.5 -66.6 -23.9 -3.0 25.4 24.7 55 56 A L H X> S+ 0 0 6 -3,-2.8 4,-0.8 2,-0.2 3,-0.6 0.992 103.4 40.2 -66.9 -66.3 -2.1 26.7 21.3 56 57 A A H 3X S+ 0 0 13 -41,-0.6 4,-1.1 -4,-0.6 3,-0.2 0.851 111.6 68.2 -51.0 -32.4 -3.6 30.2 21.1 57 58 A Q H >X S+ 0 0 103 -4,-1.0 4,-2.1 -5,-0.3 3,-1.0 0.915 87.9 58.8 -49.8 -60.3 -2.4 30.4 24.7 58 59 A I H X S+ 0 0 42 -4,-2.3 4,-2.2 1,-0.2 3,-2.0 0.958 110.7 48.0 -59.6 -51.5 10.5 41.6 30.7 70 71 A L H 3< S+ 0 0 0 -4,-3.2 4,-0.4 1,-0.3 -1,-0.2 0.849 108.4 58.0 -57.6 -32.5 11.1 44.6 28.5 71 72 A N H 3< S+ 0 0 32 -4,-1.5 -1,-0.3 -5,-0.4 -2,-0.2 0.600 113.6 37.1 -75.8 -10.3 9.6 46.7 31.3 72 73 A E H << S+ 0 0 116 -3,-2.0 -2,-0.2 -4,-0.6 -1,-0.2 0.653 105.2 62.2-112.4 -22.1 12.2 45.5 33.8 73 74 A I S < S+ 0 0 70 -4,-2.2 2,-0.3 -5,-0.2 -2,-0.1 0.493 115.6 23.8 -84.5 0.5 15.4 45.2 31.8 74 75 A Q - 0 0 23 -4,-0.4 -1,-0.1 -5,-0.2 235,-0.0 -0.978 61.5-152.4-158.4 151.9 15.4 49.0 31.1 75 76 A D S S+ 0 0 119 -2,-0.3 3,-0.1 1,-0.1 -4,-0.1 0.196 77.5 77.7-119.0 20.6 13.9 52.0 32.7 76 77 A E S S+ 0 0 95 1,-0.2 -73,-2.3 -74,-0.1 2,-0.4 0.797 96.1 40.6 -93.8 -35.4 13.4 54.6 30.0 77 78 A I E -a 3 0A 5 -75,-0.2 2,-0.6 -7,-0.2 -73,-0.2 -0.913 59.7-155.5-122.1 143.1 10.3 53.0 28.4 78 79 A T E -a 4 0A 51 -75,-2.1 -73,-2.0 -2,-0.4 2,-0.2 -0.978 24.9-156.1-114.1 118.1 7.1 51.4 29.8 79 80 A F E -a 5 0A 5 -2,-0.6 2,-0.4 -12,-0.3 -73,-0.2 -0.623 12.9-160.4 -95.5 154.4 5.6 49.0 27.2 80 81 A K E -a 6 0A 70 -75,-1.2 -73,-2.3 -2,-0.2 -16,-0.1 -0.917 23.2-135.1-135.9 104.8 2.0 47.8 26.8 81 82 A A E -a 7 0A 6 -2,-0.4 2,-0.3 -75,-0.2 -73,-0.2 -0.271 22.3-177.8 -64.9 143.8 1.6 44.6 24.7 82 83 A Y E -a 8 0A 11 -75,-2.7 -73,-2.5 -19,-0.0 2,-0.6 -0.990 18.2-139.3-142.4 132.9 -1.1 44.2 22.0 83 84 A I E -a 9 0A 18 -2,-0.3 2,-0.6 -75,-0.2 -73,-0.2 -0.847 16.4-175.4-100.9 120.1 -1.7 41.1 19.9 84 85 A G E -a 10 0A 0 -75,-2.1 -73,-2.1 -2,-0.6 8,-0.3 -0.949 10.8-171.1-115.5 115.2 -2.5 41.5 16.3 85 86 A L B -d 91 0B 6 5,-2.9 7,-1.8 -2,-0.6 -73,-0.2 -0.480 21.3-144.3-100.0 174.4 -3.3 38.2 14.5 86 87 A K S S+ 0 0 30 -74,-1.6 -73,-0.2 5,-0.2 -74,-0.1 0.793 91.5 24.1-105.1 -39.3 -3.8 37.4 10.8 87 88 A H S S+ 0 0 20 -75,-2.7 2,-0.3 1,-0.1 -60,-0.2 0.353 122.6 31.3-113.0 4.5 -6.6 34.7 10.6 88 89 A I S S- 0 0 2 -76,-0.3 -3,-0.3 2,-0.2 -1,-0.1 -0.983 92.7 -53.5-154.2 159.5 -8.6 35.2 13.8 89 90 A E S S+ 0 0 75 -2,-0.3 -3,-0.1 1,-0.2 -5,-0.1 -0.503 108.0 59.2 -77.6 152.0 -9.5 38.0 16.1 90 91 A P S S- 0 0 51 0, 0.0 -5,-2.9 0, 0.0 -1,-0.2 0.347 87.4-166.9 -74.7 125.4 -8.0 40.0 17.5 91 92 A F B > -d 85 0B 53 -7,-0.2 4,-2.3 -4,-0.1 -5,-0.2 -0.278 34.9-101.0 -74.1 166.1 -6.9 41.0 14.0 92 93 A I H > S+ 0 0 0 -7,-1.8 4,-2.6 -8,-0.3 5,-0.2 0.944 123.4 49.2 -52.1 -54.9 -4.0 43.3 13.3 93 94 A E H > S+ 0 0 49 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.882 108.7 55.7 -54.6 -38.9 -6.3 46.3 12.6 94 95 A D H > S+ 0 0 82 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.968 108.2 45.6 -60.0 -52.6 -8.2 45.6 15.8 95 96 A A H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.958 112.6 51.9 -55.0 -52.0 -5.1 45.7 18.0 96 97 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.921 109.7 48.7 -50.8 -51.4 -3.9 48.9 16.2 97 98 A A H X S+ 0 0 36 -4,-2.9 4,-3.0 1,-0.2 -1,-0.2 0.905 109.1 53.8 -57.3 -42.2 -7.2 50.6 16.8 98 99 A E H X S+ 0 0 100 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.939 107.3 49.7 -59.5 -48.1 -7.2 49.6 20.5 99 100 A M H X>S+ 0 0 0 -4,-2.4 5,-2.7 2,-0.2 4,-0.5 0.944 111.9 49.2 -53.9 -49.8 -3.8 51.1 21.1 100 101 A H H ><5S+ 0 0 67 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.946 112.8 47.1 -54.0 -50.9 -5.0 54.3 19.4 101 102 A K H 3<5S+ 0 0 153 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.798 107.9 55.7 -60.6 -34.6 -8.1 54.3 21.6 102 103 A D H 3<5S- 0 0 56 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.507 125.3-105.0 -77.2 -5.5 -6.0 53.6 24.7 103 104 A G T <<5 + 0 0 50 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.1 0.501 66.2 154.4 96.1 2.1 -4.0 56.7 23.8 104 105 A I < + 0 0 4 -5,-2.7 -1,-0.3 -6,-0.2 3,-0.1 -0.367 10.6 168.5 -63.0 144.0 -0.8 55.1 22.4 105 106 A T + 0 0 91 1,-0.4 34,-1.9 -101,-0.3 2,-0.4 0.494 64.1 44.4-132.4 -16.9 0.9 57.4 19.9 106 107 A E E S+ c 0 139A 70 -102,-0.3 -100,-1.9 32,-0.2 -1,-0.4 -0.995 70.6 170.8-136.2 123.4 4.3 55.7 19.4 107 108 A A E -bc 6 140A 0 32,-2.4 34,-2.4 -2,-0.4 2,-0.4 -0.951 24.0-154.1-137.5 157.2 4.6 52.0 18.9 108 109 A V E -bc 7 141A 1 -102,-2.9 -100,-2.0 -2,-0.3 2,-0.3 -0.996 19.7-160.9-128.7 133.6 7.0 49.3 18.0 109 110 A S E -bc 8 142A 0 32,-2.6 34,-2.4 -2,-0.4 2,-0.3 -0.819 11.6-177.8-119.5 158.6 6.0 46.0 16.4 110 111 A I E -b 9 0A 0 -102,-2.2 -100,-2.8 -2,-0.3 2,-0.4 -0.985 20.0-136.0-150.6 139.0 7.4 42.5 16.0 111 112 A V E -b 10 0A 5 32,-0.3 2,-2.8 -2,-0.3 -100,-0.2 -0.838 23.1-123.7-101.5 136.9 6.2 39.4 14.3 112 113 A L S S+ 0 0 17 -102,-2.4 146,-0.3 -2,-0.4 -100,-0.2 -0.378 90.0 84.7 -75.6 64.4 6.5 36.0 16.0 113 114 A A S S- 0 0 26 -2,-2.8 -2,-0.2 144,-0.1 33,-0.1 -0.741 70.1-147.6-166.1 109.7 8.4 34.6 13.0 114 115 A P S S+ 0 0 0 0, 0.0 32,-2.2 0, 0.0 33,-1.5 0.854 75.2 67.6 -50.2 -49.1 12.2 35.2 12.7 115 116 A H S S- 0 0 5 30,-0.2 6,-0.3 31,-0.2 2,-0.2 -0.565 78.7-125.6 -86.7 143.4 12.5 35.4 8.9 116 117 A F + 0 0 24 -2,-0.3 2,-0.3 5,-0.1 82,-0.2 -0.558 31.0 171.3 -82.6 144.4 11.2 38.1 6.7 117 118 A S > - 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