==== 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 TRANSFERASE 23-FEB-09 3GD5 . COMPND 2 MOLECULE: ORNITHINE CARBAMOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GLOEOBACTER VIOLACEUS; . AUTHOR A.A.FEDOROV,E.V.FEDOROV,R.TORO,U.A.RAMAGOPAL,J.M.SAUDER,S.K. . 1710 18 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 59441.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1273 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 275 16.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 12 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 102 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 159 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 620 36.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 33 1.9 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 10 13 1 0 2 0 0 10 6 6 6 8 4 0 0 0 6 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 24 0 1 29 12 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 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 6 0 6 6 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 10 A T 0 0 119 0, 0.0 2,-0.3 0, 0.0 16,-0.0 0.000 360.0 360.0 360.0 146.2 23.8 23.1 -4.1 2 11 A R - 0 0 222 0, 0.0 2,-0.3 0, 0.0 282,-0.0 -0.738 360.0-157.3 -95.5 146.3 24.6 20.6 -1.3 3 12 A F - 0 0 53 -2,-0.3 10,-0.1 281,-0.2 4,-0.1 -0.755 24.2-101.1-117.4 165.4 26.9 21.5 1.6 4 13 A R - 0 0 139 8,-0.4 -1,-0.1 -2,-0.3 8,-0.0 -0.307 43.6-101.3 -75.0 170.5 28.9 19.4 4.0 5 14 A P S S+ 0 0 95 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.893 98.7 32.9 -61.7 -41.1 27.4 18.9 7.5 6 15 A D - 0 0 36 103,-0.2 2,-0.3 6,-0.1 -2,-0.2 -0.653 58.8-145.7-117.1 169.8 29.7 21.4 9.1 7 16 A L B +a 111 0A 6 103,-2.1 105,-2.8 -2,-0.2 114,-0.1 -0.735 45.9 138.0-133.0 79.5 31.5 24.7 8.5 8 17 A L S S+ 0 0 20 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.748 74.7 18.4 -92.1 -34.3 34.7 24.3 10.6 9 18 A S S > S- 0 0 21 -3,-0.1 3,-2.0 110,-0.1 -1,-0.3 -0.960 76.1-120.7-137.3 149.5 37.1 25.8 8.0 10 19 A L G > S+ 0 0 0 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.800 113.3 70.4 -62.3 -23.0 36.4 28.0 5.0 11 20 A D G 3 S+ 0 0 41 1,-0.3 -1,-0.3 -3,-0.0 -4,-0.0 0.325 76.1 80.2 -76.0 10.0 37.9 25.1 3.1 12 21 A D G < S+ 0 0 25 -3,-2.0 2,-0.5 1,-0.1 -8,-0.4 0.496 88.8 64.6 -89.9 -6.9 34.9 23.0 3.9 13 22 A L S < S- 0 0 10 -3,-1.6 -1,-0.1 -4,-0.1 2,-0.1 -0.974 78.1-149.1-117.5 126.1 33.2 24.8 1.0 14 23 A D > - 0 0 66 -2,-0.5 4,-2.2 1,-0.1 5,-0.2 -0.275 44.7 -85.5 -80.8 179.8 34.5 24.4 -2.5 15 24 A E H > S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.893 130.4 50.6 -53.7 -41.9 34.3 27.3 -5.0 16 25 A A H > S+ 0 0 56 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.890 109.9 47.5 -65.1 -42.5 30.7 26.3 -5.9 17 26 A Q H > S+ 0 0 20 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.881 108.8 55.3 -69.1 -34.9 29.4 26.0 -2.3 18 27 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.918 108.4 47.5 -64.0 -43.6 30.9 29.3 -1.4 19 28 A H H X S+ 0 0 70 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.918 110.4 51.4 -64.3 -44.0 29.1 31.1 -4.2 20 29 A A H X S+ 0 0 25 -4,-1.9 4,-3.2 2,-0.2 5,-0.2 0.949 111.3 48.7 -56.8 -48.5 25.8 29.5 -3.4 21 30 A L H X S+ 0 0 6 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.942 112.2 48.0 -55.5 -51.6 26.2 30.6 0.3 22 31 A L H X S+ 0 0 21 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.865 113.0 48.8 -58.9 -38.5 27.0 34.1 -0.8 23 32 A T H X S+ 0 0 73 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.921 110.7 50.2 -68.6 -43.7 24.0 34.1 -3.1 24 33 A L H X S+ 0 0 25 -4,-3.2 4,-2.9 -5,-0.2 5,-0.2 0.931 109.8 51.0 -59.9 -45.5 21.7 32.8 -0.4 25 34 A A H X S+ 0 0 2 -4,-2.8 4,-2.9 -5,-0.2 -1,-0.2 0.942 112.5 46.4 -57.7 -48.5 23.0 35.5 2.0 26 35 A H H X S+ 0 0 69 -4,-2.2 4,-2.6 2,-0.2 6,-0.3 0.930 113.5 47.5 -60.5 -47.1 22.3 38.2 -0.6 27 36 A Q H X>S+ 0 0 47 -4,-2.9 5,-2.0 1,-0.2 6,-1.1 0.910 114.1 48.1 -61.4 -42.0 18.9 36.9 -1.4 28 37 A L H <5S+ 0 0 15 -4,-2.9 3,-0.5 -5,-0.2 -2,-0.2 0.912 111.3 50.9 -64.8 -42.1 18.0 36.6 2.2 29 38 A K H <5S+ 0 0 46 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.911 115.4 40.9 -62.7 -42.6 19.3 40.1 2.9 30 39 A R H <5S- 0 0 114 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.509 111.1-115.8 -86.1 -4.6 17.2 41.7 0.1 31 40 A G T <5S+ 0 0 54 -4,-0.9 -3,-0.2 -3,-0.5 -4,-0.1 0.670 81.8 124.8 78.8 15.3 14.1 39.6 0.8 32 41 A E S + 0 0 0 27,-3.2 3,-2.1 -2,-0.3 30,-0.3 -0.138 29.9 163.3-117.5 33.8 14.3 27.3 11.1 38 47 A H T 3 + 0 0 141 26,-0.3 28,-0.2 1,-0.3 3,-0.1 -0.252 66.4 25.1 -54.9 136.5 11.1 27.4 13.2 39 48 A G T 3 S+ 0 0 57 26,-0.5 2,-0.3 1,-0.3 -1,-0.3 0.376 102.7 109.9 88.3 -4.9 11.1 24.7 15.9 40 49 A K < - 0 0 70 -3,-2.1 27,-2.9 25,-0.2 2,-0.4 -0.775 53.1-151.9-108.9 152.5 14.9 24.5 15.9 41 50 A V E -b 67 0A 4 -2,-0.3 46,-3.0 25,-0.2 47,-0.8 -0.975 2.7-154.8-124.8 132.5 17.4 25.7 18.6 42 51 A L E -bc 68 88A 0 25,-2.4 27,-2.7 -2,-0.4 2,-0.4 -0.891 12.2-150.5-105.5 129.9 20.9 26.8 18.0 43 52 A G E -bc 69 89A 0 45,-3.3 47,-2.6 -2,-0.5 2,-0.6 -0.835 1.7-152.0-102.5 140.2 23.4 26.4 20.9 44 53 A L E -bc 70 90A 3 25,-2.9 27,-3.0 -2,-0.4 2,-0.7 -0.946 12.7-178.5-112.5 113.2 26.3 28.8 21.3 45 54 A V E + c 0 91A 13 45,-1.9 47,-2.0 -2,-0.6 2,-0.7 -0.837 7.3 174.5-114.9 93.8 29.3 27.4 23.1 46 55 A F E - c 0 92A 26 -2,-0.7 47,-0.2 25,-0.6 3,-0.1 -0.875 20.0-171.5-103.3 108.5 31.9 30.1 23.4 47 56 A L S S+ 0 0 67 45,-3.2 2,-0.4 -2,-0.7 -1,-0.1 0.575 89.1 40.0 -71.0 -7.8 35.0 29.0 25.4 48 57 A K S S- 0 0 105 44,-0.3 -1,-0.2 45,-0.0 44,-0.0 -0.968 100.7-112.6-142.9 120.8 35.8 32.7 25.1 49 58 A A + 0 0 91 -2,-0.4 2,-0.1 -3,-0.1 3,-0.1 -0.174 37.7 169.2 -55.2 144.3 33.2 35.4 25.4 50 59 A S > - 0 0 22 1,-0.1 4,-3.4 -4,-0.1 5,-0.2 -0.593 14.4-178.8-160.5 89.6 32.4 37.4 22.3 51 60 A T H > S+ 0 0 59 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.863 87.4 58.0 -58.8 -37.5 29.3 39.6 22.5 52 61 A R H > S+ 0 0 44 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.963 113.1 36.9 -57.4 -55.1 30.0 40.6 18.9 53 62 A T H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.934 116.6 53.8 -65.5 -44.1 29.8 37.1 17.7 54 63 A R H X S+ 0 0 50 -4,-3.4 4,-2.2 1,-0.2 -2,-0.2 0.893 110.9 45.0 -59.5 -42.0 27.0 36.1 20.1 55 64 A V H X S+ 0 0 1 -4,-3.1 4,-2.6 2,-0.2 5,-0.4 0.933 112.6 49.6 -69.3 -45.3 24.7 39.0 19.0 56 65 A S H X S+ 0 0 0 -4,-2.1 4,-1.3 -5,-0.3 -2,-0.2 0.904 115.9 43.7 -61.3 -40.4 25.3 38.5 15.3 57 66 A F H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.905 115.0 48.6 -70.0 -41.6 24.6 34.7 15.6 58 67 A T H X S+ 0 0 5 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.875 112.3 45.7 -68.4 -41.6 21.5 35.2 17.9 59 68 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.861 111.3 56.2 -70.3 -32.4 19.8 37.8 15.8 60 69 A A H X S+ 0 0 0 -4,-1.3 4,-0.9 -5,-0.4 -2,-0.2 0.966 110.0 43.1 -61.6 -52.2 20.5 35.7 12.7 61 70 A M H ><>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 3,-0.6 0.879 112.1 55.0 -62.6 -36.7 18.7 32.7 14.2 62 71 A Y H ><5S+ 0 0 36 -4,-2.1 3,-1.2 1,-0.2 -1,-0.2 0.888 105.3 52.0 -64.5 -36.6 15.9 34.9 15.5 63 72 A Q H 3<5S+ 0 0 91 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.687 106.4 54.5 -73.3 -15.8 15.3 36.3 12.0 64 73 A L T <<5S- 0 0 5 -4,-0.9 -27,-3.2 -3,-0.6 -26,-0.3 0.422 121.6-110.6 -92.5 -2.6 15.1 32.7 10.7 65 74 A G T < 5S+ 0 0 36 -3,-1.2 -26,-0.5 -4,-0.3 -3,-0.2 0.644 77.7 119.2 84.3 15.6 12.4 32.0 13.3 66 75 A G < - 0 0 8 -5,-2.5 -1,-0.3 -28,-0.2 2,-0.2 -0.471 59.5-111.4-105.3-179.8 14.4 29.7 15.6 67 76 A Q E -b 41 0A 25 -27,-2.9 -25,-2.4 -30,-0.3 2,-0.3 -0.687 22.4-149.6-108.0 165.9 15.5 29.9 19.2 68 77 A V E -b 42 0A 11 -2,-0.2 2,-0.4 -27,-0.2 -25,-0.2 -0.989 8.2-170.5-137.6 143.1 19.0 30.3 20.7 69 78 A I E -b 43 0A 6 -27,-2.7 -25,-2.9 -2,-0.3 2,-0.6 -0.995 17.8-140.6-136.9 130.9 20.7 29.1 23.9 70 79 A D E b 44 0A 63 -2,-0.4 -25,-0.2 -27,-0.2 -27,-0.1 -0.804 360.0 360.0 -89.8 123.0 24.1 30.1 25.3 71 80 A L 0 0 33 -27,-3.0 -25,-0.6 -2,-0.6 269,-0.0 -0.506 360.0 360.0-115.9 360.0 25.9 27.1 26.8 72 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 73 91 A E 0 0 117 0, 0.0 465,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 131.2 33.7 17.2 31.7 74 92 A P >> - 0 0 48 0, 0.0 4,-1.9 0, 0.0 3,-1.1 -0.331 360.0-124.1 -63.8 143.3 35.1 15.7 28.5 75 93 A V H 3> S+ 0 0 20 1,-0.3 4,-3.4 2,-0.2 5,-0.3 0.821 107.7 63.4 -57.1 -35.2 33.8 17.2 25.3 76 94 A R H 3> S+ 0 0 70 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.832 107.6 43.7 -62.2 -29.8 32.6 13.9 23.9 77 95 A D H <> S+ 0 0 0 -3,-1.1 4,-2.0 2,-0.2 -2,-0.2 0.942 116.9 44.1 -78.9 -48.8 30.1 13.6 26.8 78 96 A T H X S+ 0 0 25 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.865 114.0 51.5 -64.5 -33.7 29.0 17.2 26.6 79 97 A A H X S+ 0 0 0 -4,-3.4 4,-2.3 -5,-0.2 -1,-0.2 0.934 109.4 49.6 -68.4 -44.4 28.7 17.1 22.8 80 98 A R H < S+ 0 0 37 -4,-1.4 4,-0.4 -5,-0.3 -2,-0.2 0.874 113.6 45.5 -62.5 -38.6 26.6 13.9 22.9 81 99 A V H >< S+ 0 0 4 -4,-2.0 3,-1.5 2,-0.2 4,-0.5 0.925 112.3 50.8 -70.7 -44.2 24.2 15.4 25.4 82 100 A L H >X S+ 0 0 13 -4,-2.3 4,-2.4 1,-0.3 3,-1.5 0.870 102.5 61.6 -60.5 -36.9 24.0 18.7 23.6 83 101 A G T 3< S+ 0 0 19 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.707 101.2 54.3 -63.8 -18.3 23.2 16.8 20.4 84 102 A R T <4 S+ 0 0 79 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.581 116.9 34.5 -90.5 -11.5 20.1 15.4 22.1 85 103 A Y T <4 S+ 0 0 7 -3,-1.5 -2,-0.2 -4,-0.5 2,-0.2 0.808 114.5 38.1-109.6 -46.0 18.8 18.9 23.0 86 104 A V < - 0 0 4 -4,-2.4 -44,-0.2 -46,-0.1 3,-0.1 -0.541 62.8-135.4-105.8 175.4 19.6 21.4 20.3 87 105 A D S S+ 0 0 54 -46,-3.0 2,-0.3 1,-0.2 -45,-0.2 0.403 81.4 11.9-110.3 -0.1 19.8 21.3 16.5 88 106 A G E -c 42 0A 0 -47,-0.8 -45,-3.3 20,-0.1 2,-0.4 -0.961 58.8-141.1-171.8 154.3 23.0 23.2 15.9 89 107 A L E -cd 43 110A 0 20,-2.4 22,-3.5 -2,-0.3 2,-0.6 -0.983 5.4-170.5-132.1 124.9 26.1 24.5 17.5 90 108 A A E -cd 44 111A 0 -47,-2.6 -45,-1.9 -2,-0.4 2,-0.4 -0.965 30.9-171.0-107.0 114.6 28.0 27.7 16.8 91 109 A I E -cd 45 112A 0 20,-2.9 22,-2.6 -2,-0.6 23,-1.1 -0.934 28.3-161.5-128.0 142.8 31.2 27.3 18.7 92 110 A R E +cd 46 114A 21 -47,-2.0 -45,-3.2 -2,-0.4 -44,-0.3 -0.935 29.8 150.0-112.0 109.4 34.2 29.4 19.8 93 111 A T - 0 0 0 21,-1.4 3,-0.1 -2,-0.6 -45,-0.0 -0.698 46.6-127.8-126.4-178.3 37.3 27.4 20.9 94 112 A F S S+ 0 0 86 -2,-0.2 22,-2.3 21,-0.2 2,-0.4 0.832 92.0 55.1 -97.8 -48.3 41.0 28.1 20.8 95 113 A A S > S- 0 0 42 20,-0.2 4,-1.4 1,-0.1 3,-0.4 -0.739 70.3-146.0 -92.9 132.9 42.2 24.9 19.1 96 114 A Q H > S+ 0 0 27 -2,-0.4 4,-1.7 1,-0.2 5,-0.2 0.877 101.1 61.7 -59.0 -37.4 40.7 23.9 15.8 97 115 A T H > S+ 0 0 87 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.890 100.3 50.8 -58.4 -42.3 41.1 20.3 17.0 98 116 A E H > S+ 0 0 57 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.881 106.8 55.7 -63.4 -36.7 38.8 20.8 19.9 99 117 A L H X S+ 0 0 0 -4,-1.4 4,-1.8 1,-0.2 -1,-0.2 0.875 106.6 50.8 -61.0 -37.7 36.2 22.2 17.5 100 118 A E H X S+ 0 0 93 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.834 101.6 61.6 -70.0 -33.0 36.5 19.0 15.5 101 119 A E H X S+ 0 0 63 -4,-1.6 4,-2.1 2,-0.2 5,-0.2 0.948 106.6 46.0 -56.3 -51.6 35.9 17.0 18.7 102 120 A Y H X S+ 0 0 16 -4,-1.7 4,-3.4 1,-0.2 5,-0.3 0.938 111.9 49.0 -57.4 -51.7 32.5 18.6 19.1 103 121 A A H X S+ 0 0 16 -4,-1.8 4,-0.8 1,-0.2 -1,-0.2 0.888 110.8 53.6 -56.7 -39.3 31.5 18.1 15.4 104 122 A H H < S+ 0 0 143 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.908 122.1 25.4 -62.7 -45.5 32.6 14.5 15.7 105 123 A Y H < S+ 0 0 77 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.733 105.4 74.6 -94.3 -26.7 30.4 13.7 18.7 106 124 A A H < S- 0 0 6 -4,-3.4 -3,-0.1 -5,-0.2 -2,-0.1 0.859 76.4-150.7 -57.4 -41.2 27.5 16.2 18.6 107 125 A G < + 0 0 72 -4,-0.8 -1,-0.1 1,-0.3 -4,-0.1 0.623 67.8 89.2 76.9 9.5 25.8 14.5 15.7 108 126 A I S S- 0 0 26 -5,-0.2 -1,-0.3 -19,-0.0 -20,-0.1 -0.953 94.5 -71.7-136.6 155.8 24.5 17.9 14.7 109 127 A P - 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