==== 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 HYDROLASE 24-APR-09 3H7C . COMPND 2 MOLECULE: AGMATINE DEIMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR E.S.BURGIE,C.A.BINGMAN,G.N.PHILLIPS JR.,CENTER FOR . 369 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14926.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 238 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 9.2 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 1 0.3 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 . 21 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 5 1 0 1 0 0 0 0 3 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 2 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 PARALLEL BRIDGES PER LADDER . 4 0 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 3 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 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 X S 0 0 95 0, 0.0 114,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0-169.1 35.9 38.4 29.8 2 2 X E - 0 0 165 1,-0.1 2,-0.3 149,-0.1 3,-0.0 -0.238 360.0-105.4 -86.4 176.0 33.7 41.1 31.3 3 3 X E - 0 0 74 148,-0.2 148,-0.2 1,-0.1 -1,-0.1 -0.773 38.3 -94.4-102.8 146.4 33.0 44.6 29.9 4 4 X S - 0 0 32 146,-2.4 -1,-0.1 -2,-0.3 148,-0.1 -0.247 33.6-121.4 -51.4 144.6 34.3 47.8 31.2 5 5 X R S S+ 0 0 225 1,-0.1 2,-0.4 2,-0.0 -1,-0.1 0.776 98.8 32.2 -63.9 -32.7 32.0 49.5 33.7 6 6 X E S S- 0 0 62 5,-0.0 -1,-0.1 3,-0.0 -2,-0.1 -0.986 86.9-124.1-127.0 144.6 31.8 52.7 31.5 7 7 X S > - 0 0 4 -2,-0.4 4,-0.8 1,-0.1 3,-0.3 -0.342 25.2-109.5 -83.5 160.8 32.0 52.8 27.7 8 8 X P T >4>S+ 0 0 0 0, 0.0 5,-2.4 0, 0.0 3,-1.3 0.899 119.3 55.5 -50.3 -46.1 34.4 54.8 25.6 9 9 X A G >45S+ 0 0 46 186,-2.6 3,-1.6 1,-0.3 187,-0.1 0.865 98.6 60.8 -64.0 -31.5 31.6 57.1 24.5 10 10 X E G 345S+ 0 0 126 -3,-0.3 -1,-0.3 185,-0.3 186,-0.1 0.764 109.2 44.1 -62.5 -26.2 30.8 57.9 28.1 11 11 X H G <<5S- 0 0 76 -3,-1.3 -1,-0.3 -4,-0.8 -2,-0.2 0.239 124.8-101.7-100.6 4.4 34.3 59.3 28.5 12 12 X G T < 5S+ 0 0 46 -3,-1.6 91,-0.4 1,-0.3 -3,-0.2 0.570 74.6 139.2 89.9 8.2 34.2 61.2 25.1 13 13 X Y < + 0 0 14 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.3 -0.562 21.2 168.6 -86.9 157.9 36.3 58.8 23.0 14 14 X Y B -A 101 0A 52 87,-2.2 87,-2.8 -2,-0.2 184,-0.3 -0.973 41.1 -98.8-155.1 162.0 35.7 57.7 19.5 15 15 X X - 0 0 15 182,-2.7 149,-0.3 -2,-0.3 151,-0.2 -0.765 40.8-143.0 -87.1 121.2 37.6 55.8 16.8 16 16 X P - 0 0 6 0, 0.0 148,-0.2 0, 0.0 146,-0.1 -0.328 28.9 -87.5 -78.2 161.6 39.2 58.3 14.4 17 17 X A > - 0 0 3 146,-0.3 3,-1.9 1,-0.1 146,-0.1 -0.352 35.3-116.3 -63.0 154.8 39.5 57.6 10.7 18 18 X E T 3 S+ 0 0 14 144,-0.5 -1,-0.1 1,-0.3 145,-0.1 0.748 113.8 61.8 -64.0 -26.9 42.6 55.7 9.6 19 19 X W T 3 S+ 0 0 61 2,-0.1 -1,-0.3 293,-0.1 294,-0.2 0.553 83.0 99.4 -82.0 -1.3 43.7 58.7 7.6 20 20 X D S < S- 0 0 72 -3,-1.9 2,-0.0 1,-0.2 144,-0.0 -0.313 93.6 -65.2 -74.0 175.1 44.0 60.9 10.7 21 21 X S - 0 0 81 345,-0.1 346,-3.0 1,-0.1 2,-0.3 -0.242 52.4-153.2 -73.4 135.8 47.5 61.3 12.2 22 22 X H E -D 366 0B 11 344,-0.3 3,-0.1 1,-0.1 -1,-0.1 -0.792 20.7-161.0-103.9 150.2 49.3 58.3 13.7 23 23 X A E S- 0 0 40 342,-3.0 2,-0.3 1,-0.4 -1,-0.1 0.732 78.5 -27.6 -82.8 -37.6 52.0 58.1 16.3 24 24 X Q E -D 365 0B 19 341,-1.5 341,-3.0 34,-0.1 2,-0.4 -0.974 55.6-117.1-168.0 165.2 53.0 54.6 15.1 25 25 X T E -De 364 60B 0 34,-2.1 36,-2.5 -2,-0.3 2,-0.4 -0.969 22.0-147.4-114.4 140.5 52.0 51.4 13.4 26 26 X W E +De 363 61B 0 337,-2.5 337,-1.3 -2,-0.4 2,-0.3 -0.889 20.2 173.6-107.3 135.8 52.0 48.0 15.1 27 27 X I E -De 362 62B 1 34,-2.0 36,-2.7 -2,-0.4 335,-0.1 -0.993 19.4-141.6-141.3 140.0 52.8 44.8 13.1 28 28 X G - 0 0 0 333,-0.6 36,-0.1 -2,-0.3 62,-0.1 -0.060 21.3-117.8 -84.1-170.7 53.2 41.1 14.2 29 29 X W - 0 0 2 33,-0.1 36,-0.3 60,-0.1 2,-0.1 -0.982 23.1-129.3-138.1 122.6 55.7 38.6 12.8 30 30 X P + 0 0 0 0, 0.0 59,-0.1 0, 0.0 14,-0.0 -0.456 44.4 136.3 -76.8 151.7 54.7 35.4 11.1 31 31 X E + 0 0 58 -2,-0.1 2,-0.1 57,-0.1 10,-0.1 0.501 23.7 117.7-157.5 -31.6 56.1 32.0 11.9 32 32 X R >> - 0 0 34 1,-0.2 4,-1.7 56,-0.1 3,-1.6 -0.316 49.7-149.1 -71.7 129.9 53.7 29.1 12.1 33 33 X Q T 34 S+ 0 0 91 1,-0.3 254,-2.4 2,-0.2 6,-0.2 0.621 92.8 62.8 -72.6 -15.1 54.5 26.4 9.5 34 34 X D T 34 S+ 0 0 9 252,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.373 117.7 27.2 -91.9 4.2 50.9 25.3 9.1 35 35 X N T <4 S+ 0 0 7 -3,-1.6 2,-0.5 1,-0.2 -2,-0.2 0.480 118.7 54.2-128.3 -21.5 49.9 28.8 7.8 36 36 X W S X S- 0 0 4 -4,-1.7 4,-1.0 -5,-0.1 3,-0.4 -0.958 82.0-127.6-129.1 113.6 53.1 30.2 6.2 37 37 X R T >4 S+ 0 0 34 -2,-0.5 3,-0.7 1,-0.2 6,-0.4 -0.111 83.3 19.6 -59.9 155.7 54.9 28.2 3.6 38 38 X H G >4 S- 0 0 91 247,-2.0 3,-1.7 1,-0.3 -1,-0.2 0.893 137.4 -52.9 56.7 46.1 58.6 27.4 3.7 39 39 X N G 34 S- 0 0 94 246,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 0.802 95.4 -73.7 60.6 30.9 59.0 27.9 7.4 40 40 X A G S+ 0 0 65 -3,-1.7 4,-2.0 -4,-0.2 5,-0.2 0.947 70.3 46.2 -65.7 -44.4 60.6 32.8 5.4 42 42 X P H > S+ 0 0 30 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.944 116.0 46.5 -64.8 -37.4 58.9 34.3 2.3 43 43 X A H > S+ 0 0 3 -6,-0.4 4,-3.2 1,-0.2 5,-0.2 0.886 107.9 56.6 -67.8 -38.9 56.2 35.8 4.3 44 44 X Q H X S+ 0 0 4 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.927 106.8 50.7 -55.7 -40.7 58.7 37.2 6.9 45 45 X R H X S+ 0 0 152 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.919 111.6 46.4 -69.7 -31.4 60.5 39.0 4.1 46 46 X V H X S+ 0 0 15 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.936 111.4 51.4 -76.7 -39.1 57.2 40.6 2.8 47 47 X F H X S+ 0 0 2 -4,-3.2 4,-2.9 1,-0.2 -2,-0.2 0.928 109.8 51.2 -57.9 -43.4 56.2 41.6 6.3 48 48 X A H X S+ 0 0 9 -4,-2.7 4,-2.7 -5,-0.2 -2,-0.2 0.912 109.7 50.3 -63.7 -34.2 59.6 43.2 6.7 49 49 X G H X S+ 0 0 34 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.884 110.9 48.0 -69.3 -37.7 59.1 45.1 3.4 50 50 X V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.952 113.3 48.1 -66.2 -44.9 55.7 46.3 4.5 51 51 X A H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.913 112.7 48.4 -61.2 -44.0 57.1 47.4 7.8 52 52 X K H X S+ 0 0 100 -4,-2.7 4,-0.7 2,-0.2 -1,-0.2 0.899 109.7 51.8 -65.6 -41.5 60.0 49.2 6.2 53 53 X A H >< S+ 0 0 16 -4,-2.4 3,-1.1 1,-0.2 4,-0.4 0.942 111.8 47.0 -61.4 -43.3 57.8 50.9 3.7 54 54 X I H >X S+ 0 0 0 -4,-2.5 3,-2.3 1,-0.2 4,-1.8 0.885 101.6 66.1 -63.5 -35.6 55.6 52.2 6.5 55 55 X S H 3< S+ 0 0 15 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.657 89.0 66.5 -64.4 -16.9 58.6 53.3 8.5 56 56 X K T << S+ 0 0 134 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.713 112.8 32.8 -69.9 -20.4 59.4 55.9 5.8 57 57 X F T <4 S- 0 0 52 -3,-2.3 -2,-0.2 -4,-0.4 -1,-0.2 0.733 132.2 -10.6-103.8 -35.7 56.2 57.7 6.9 58 58 X E S < S- 0 0 9 -4,-1.8 -1,-0.3 253,-0.0 -34,-0.1 -0.981 84.6 -67.3-160.0 167.1 55.9 57.0 10.6 59 59 X P - 0 0 78 0, 0.0 -34,-2.1 0, 0.0 2,-0.4 -0.287 46.5-160.1 -65.7 146.8 57.4 54.9 13.5 60 60 X V E -e 25 0B 4 19,-0.4 21,-2.1 -36,-0.2 2,-0.5 -0.985 11.6-165.1-126.2 139.7 56.8 51.2 13.4 61 61 X T E -ef 26 81B 0 -36,-2.5 -34,-2.0 -2,-0.4 2,-0.5 -0.996 8.9-161.8-117.1 125.5 57.0 48.6 16.1 62 62 X V E -ef 27 82B 1 19,-2.9 21,-2.4 -2,-0.5 2,-0.5 -0.905 7.0-152.0-101.4 133.4 57.2 44.9 15.1 63 63 X C E - f 0 83B 0 -36,-2.7 2,-0.3 -2,-0.5 21,-0.2 -0.918 17.3-178.9-107.0 130.7 56.3 42.3 17.7 64 64 X A E - f 0 84B 0 19,-2.6 21,-2.4 -2,-0.5 5,-0.1 -0.972 29.0-103.6-134.7 149.1 57.9 38.9 17.4 65 65 X S >> - 0 0 8 -2,-0.3 4,-1.3 -36,-0.3 3,-1.1 -0.092 40.4-101.3 -68.6 162.2 57.6 35.7 19.4 66 66 X P G >4 S+ 0 0 69 0, 0.0 3,-0.6 0, 0.0 4,-0.4 0.913 124.7 49.9 -48.2 -42.7 60.4 34.7 21.8 67 67 X A G 34 S+ 0 0 83 1,-0.2 4,-0.2 2,-0.1 3,-0.1 0.758 117.8 38.7 -69.1 -23.3 61.6 32.2 19.3 68 68 X Q G <> S+ 0 0 30 -3,-1.1 4,-3.0 1,-0.1 5,-0.3 0.439 82.0 100.9-106.6 -5.2 61.7 34.7 16.5 69 69 X W H S+ 0 0 143 -4,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.902 114.2 50.3 -61.5 -42.3 66.5 37.7 16.9 71 71 X N H > S+ 0 0 50 -4,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.943 112.4 46.2 -59.3 -49.1 65.4 36.8 13.3 72 72 X A H X S+ 0 0 0 -4,-3.0 4,-1.1 1,-0.2 -2,-0.2 0.944 110.7 52.9 -59.6 -42.4 62.9 39.7 13.2 73 73 X R H < S+ 0 0 51 -4,-2.7 3,-0.4 -5,-0.3 -1,-0.2 0.882 111.3 47.2 -65.1 -35.8 65.6 42.1 14.5 74 74 X K H < S+ 0 0 170 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.897 113.2 48.4 -65.9 -37.1 68.0 40.9 11.7 75 75 X Q H < S+ 0 0 44 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.537 104.4 68.9 -86.0 -9.0 65.4 41.2 9.0 76 76 X L S < S- 0 0 9 -4,-1.1 -27,-0.1 -3,-0.4 6,-0.1 -0.879 88.3-104.1-112.3 146.3 64.2 44.7 9.9 77 77 X P > - 0 0 28 0, 0.0 3,-2.2 0, 0.0 -2,-0.1 -0.249 36.6-108.6 -64.8 158.9 66.1 48.0 9.7 78 78 X E T 3 S+ 0 0 162 1,-0.3 4,-0.1 -4,-0.1 -2,-0.0 0.789 113.6 62.6 -66.8 -25.0 67.4 49.5 12.9 79 79 X D T 3 S+ 0 0 110 2,-0.1 2,-0.5 -20,-0.0 -19,-0.4 0.548 86.4 86.8 -83.4 3.8 64.9 52.3 13.1 80 80 X I S < S- 0 0 0 -3,-2.2 2,-0.3 -21,-0.1 -19,-0.2 -0.860 82.5-131.7 -94.5 127.4 62.0 49.8 13.4 81 81 X R E -f 61 0B 96 -21,-2.1 -19,-2.9 -2,-0.5 2,-0.5 -0.626 19.4-160.1 -79.3 133.0 61.6 48.8 17.0 82 82 X V E +f 62 0B 12 -2,-0.3 2,-0.3 -21,-0.2 -19,-0.2 -0.985 12.2 179.6-117.8 123.1 61.4 45.1 17.6 83 83 X V E -f 63 0B 20 -21,-2.4 -19,-2.6 -2,-0.5 2,-0.4 -0.900 30.5-109.9-121.7 154.0 59.8 43.8 20.8 84 84 X E E +f 64 0B 126 -2,-0.3 2,-0.3 -21,-0.2 -19,-0.2 -0.659 45.5 156.1 -83.0 132.4 59.2 40.3 22.2 85 85 X X - 0 0 7 -21,-2.4 2,-0.1 -2,-0.4 51,-0.0 -0.901 37.6-128.6-156.7 133.5 55.5 39.2 22.3 86 86 X S + 0 0 30 -2,-0.3 2,-0.3 -21,-0.2 49,-0.1 -0.458 39.1 159.9 -78.2 143.9 53.9 35.7 22.3 87 87 X X - 0 0 15 -2,-0.1 3,-0.1 1,-0.1 44,-0.1 -0.964 45.8-136.3-157.9 155.1 51.2 35.3 19.7 88 88 X N S S- 0 0 21 -2,-0.3 2,-0.3 1,-0.2 -56,-0.1 0.778 91.3 -10.8 -88.6 -23.0 49.5 32.4 18.0 89 89 X D S S- 0 0 7 -3,-0.1 2,-0.5 41,-0.1 -1,-0.2 -0.924 73.9-102.9-160.5-177.7 49.7 34.1 14.6 90 90 X S + 0 0 0 -2,-0.3 2,-0.4 -62,-0.1 -62,-0.3 -0.471 66.9 120.1-118.1 60.9 50.5 37.5 13.2 91 91 X W >> + 0 0 11 -2,-0.5 3,-2.1 1,-0.1 4,-2.0 -0.651 26.1 169.3-123.3 73.4 47.3 39.4 12.2 92 92 X F H 3> S+ 0 0 0 -2,-0.4 4,-1.5 269,-0.4 269,-0.2 0.718 70.4 68.8 -72.0 -15.1 47.4 42.6 14.4 93 93 X R H 34 S+ 0 0 3 267,-1.5 64,-0.6 1,-0.2 -1,-0.3 0.845 115.5 29.7 -58.6 -32.3 44.5 44.3 12.6 94 94 X D H <4 S+ 0 0 6 -3,-2.1 63,-0.3 266,-0.5 -2,-0.2 0.789 130.7 31.6-102.4 -41.4 42.4 41.6 14.1 95 95 X S H < S+ 0 0 11 -4,-2.0 42,-0.5 61,-0.1 -3,-0.2 0.626 104.0 86.4 -93.7 -18.0 44.0 40.6 17.4 96 96 X G S < S- 0 0 1 -4,-1.5 18,-0.3 -5,-0.3 61,-0.3 -0.073 90.3 -82.7 -77.6 170.8 45.5 44.0 18.3 97 97 X P - 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