==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 17-JUN-10 3NJA . COMPND 2 MOLECULE: PROBABLE GGDEF FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CHROMOBACTERIUM VIOLACEUM; . AUTHOR K.TAN,R.WU,B.FELDMANN,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCT . 427 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23488.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 326 76.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 139 32.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 . 41 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 21.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.1 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 0 2 1 5 0 0 0 0 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 7 0 3 1 0 4 0 4 4 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 0 0 3 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 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 14 A G 0 0 89 0, 0.0 2,-0.6 0, 0.0 211,-0.4 0.000 360.0 360.0 360.0-135.5 11.0 84.5 37.3 2 15 A I - 0 0 116 209,-0.1 2,-0.4 207,-0.1 17,-0.2 -0.795 360.0-143.8 -92.1 122.7 10.9 81.7 34.7 3 16 A G E -A 210 0A 0 207,-2.0 207,-1.3 -2,-0.6 2,-0.3 -0.670 3.5-146.0 -95.2 135.3 13.8 79.3 35.3 4 17 A S E +A 209 0A 65 -2,-0.4 13,-2.8 205,-0.2 2,-0.3 -0.759 23.9 174.5 -96.5 145.5 15.6 77.6 32.5 5 18 A W E -AB 208 16A 18 203,-2.2 203,-2.5 -2,-0.3 2,-0.4 -0.999 19.3-163.6-151.7 152.0 17.0 74.1 33.0 6 19 A V E -AB 207 15A 42 9,-1.8 9,-2.0 -2,-0.3 2,-0.5 -0.963 7.2-159.5-139.3 120.4 18.7 71.3 31.1 7 20 A L E -AB 206 14A 10 199,-1.6 199,-1.9 -2,-0.4 2,-0.8 -0.873 8.1-151.7 -99.6 128.6 19.1 67.6 32.2 8 21 A H E >>> -AB 205 13A 40 5,-2.7 4,-2.7 -2,-0.5 5,-0.5 -0.868 11.1-159.6 -94.1 109.3 21.8 65.5 30.6 9 22 A X T 345S+ 0 0 64 195,-1.5 -1,-0.2 -2,-0.8 196,-0.1 0.939 81.2 55.6 -56.9 -59.7 20.4 61.9 30.7 10 23 A E T 345S+ 0 0 158 194,-0.4 -1,-0.2 1,-0.2 195,-0.1 0.782 126.6 21.8 -46.9 -34.1 23.5 59.8 30.4 11 24 A S T <45S- 0 0 38 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.665 93.9-130.3-109.2 -23.4 25.1 61.4 33.5 12 25 A G T <5 + 0 0 9 -4,-2.7 23,-1.7 1,-0.3 -3,-0.2 0.510 53.2 157.3 77.8 5.8 22.1 62.9 35.3 13 26 A R E < -BC 8 34A 127 -5,-0.5 -5,-2.7 21,-0.2 2,-0.4 -0.393 27.1-153.5 -64.0 139.2 24.0 66.1 35.4 14 27 A L E -B 7 0A 18 19,-1.8 2,-0.4 -7,-0.2 19,-0.3 -0.956 11.2-156.9-129.2 138.3 21.7 69.0 35.8 15 28 A E E -B 6 0A 131 -9,-2.0 -9,-1.8 -2,-0.4 2,-0.5 -0.944 14.4-165.1-117.5 132.2 22.0 72.7 34.8 16 29 A W E -B 5 0A 37 -2,-0.4 -11,-0.2 -11,-0.2 5,-0.0 -0.957 18.7-134.3-132.2 121.8 20.0 75.5 36.5 17 30 A S >> - 0 0 44 -13,-2.8 4,-1.5 -2,-0.5 3,-0.6 -0.252 35.7-114.9 -46.6 144.3 19.2 79.1 35.7 18 31 A Q H 3> S+ 0 0 99 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.850 120.4 65.7 -53.7 -31.5 19.7 81.3 38.7 19 32 A A H 3> S+ 0 0 16 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.916 97.8 52.0 -57.8 -42.1 15.9 81.6 38.3 20 33 A V H <> S+ 0 0 1 -3,-0.6 4,-2.4 -16,-0.3 5,-0.2 0.918 106.6 51.4 -63.6 -44.7 15.6 78.0 39.2 21 34 A H H X>S+ 0 0 12 -4,-1.5 4,-2.3 1,-0.2 5,-1.5 0.933 107.1 53.5 -56.8 -48.4 17.6 78.2 42.4 22 35 A D H <5S+ 0 0 99 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.884 111.8 47.7 -51.3 -41.1 15.5 81.2 43.6 23 36 A I H <5S+ 0 0 9 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.902 117.1 38.8 -69.1 -43.6 12.5 78.9 43.0 24 37 A F H <5S- 0 0 2 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.652 107.8-122.4 -83.2 -16.3 13.8 75.9 44.8 25 38 A G T <5 + 0 0 34 -4,-2.3 -3,-0.2 -5,-0.2 -4,-0.1 0.638 66.2 138.4 81.3 19.5 15.4 78.0 47.5 26 39 A T < - 0 0 19 -5,-1.5 2,-0.6 -6,-0.2 -1,-0.2 -0.339 56.9-107.2 -92.8 172.8 18.8 76.5 46.7 27 40 A D >> - 0 0 78 1,-0.2 4,-3.3 -2,-0.1 3,-1.5 -0.885 16.6-151.8-115.1 116.6 22.2 78.3 46.5 28 41 A S T 34 S+ 0 0 49 -2,-0.6 -1,-0.2 1,-0.3 -12,-0.1 0.862 91.7 48.4 -44.0 -58.2 23.8 78.8 43.1 29 42 A A T 34 S+ 0 0 98 1,-0.2 -1,-0.3 3,-0.0 3,-0.0 0.658 128.5 19.1 -66.1 -16.3 27.4 78.9 44.1 30 43 A T T <4 S+ 0 0 108 -3,-1.5 2,-0.6 1,-0.1 -2,-0.2 0.755 90.8 96.8-125.2 -39.9 27.2 75.7 46.2 31 44 A F < - 0 0 50 -4,-3.3 2,-0.6 1,-0.1 -1,-0.1 -0.480 61.6-146.9 -69.9 109.0 24.2 73.5 45.5 32 45 A D - 0 0 129 -2,-0.6 2,-0.5 1,-0.0 -1,-0.1 -0.670 16.4-141.9 -81.7 117.5 25.3 70.8 43.0 33 46 A A + 0 0 8 -2,-0.6 -19,-1.8 -19,-0.3 2,-0.3 -0.670 33.8 149.6 -92.9 123.9 22.4 69.9 40.8 34 47 A T B > -C 13 0A 41 -2,-0.5 4,-3.1 -21,-0.2 -21,-0.2 -0.910 56.9-106.5-140.1 166.6 21.6 66.4 39.7 35 48 A E H > S+ 0 0 49 -23,-1.7 4,-2.1 -2,-0.3 -1,-0.1 0.945 122.0 49.5 -62.5 -46.5 18.5 64.5 38.9 36 49 A D H 4 S+ 0 0 107 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.900 112.6 47.7 -59.1 -42.5 18.7 62.6 42.1 37 50 A A H >> S+ 0 0 15 1,-0.2 3,-1.7 2,-0.2 4,-0.9 0.921 107.4 56.2 -64.4 -45.2 19.2 65.8 44.1 38 51 A Y H >X S+ 0 0 19 -4,-3.1 3,-1.3 1,-0.3 4,-0.7 0.925 101.8 57.6 -49.8 -46.1 16.3 67.5 42.2 39 52 A F H 3< S+ 0 0 9 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.585 97.1 62.0 -67.0 -10.8 14.0 64.7 43.4 40 53 A Q H <4 S+ 0 0 122 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.759 101.8 51.3 -85.7 -26.7 14.8 65.4 47.0 41 54 A R H << S+ 0 0 53 -3,-1.3 139,-2.5 -4,-0.9 2,-0.3 0.654 91.0 100.5 -74.5 -20.8 13.3 68.9 46.6 42 55 A V B < S-D 179 0A 0 -4,-0.7 137,-0.3 137,-0.2 5,-0.2 -0.513 91.8-100.9 -72.9 132.6 10.2 67.3 45.2 43 56 A H >> - 0 0 29 135,-2.8 3,-1.9 -2,-0.3 4,-1.6 -0.261 28.8-127.2 -50.0 135.7 7.4 67.1 47.7 44 57 A P T 34 S+ 0 0 73 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.772 110.5 56.1 -59.9 -34.6 7.3 63.5 49.0 45 58 A D T 34 S+ 0 0 121 1,-0.2 4,-0.2 2,-0.1 -2,-0.1 0.642 116.8 38.8 -69.6 -14.8 3.6 63.2 48.1 46 59 A D T <> S+ 0 0 11 -3,-1.9 4,-2.4 132,-0.1 5,-0.3 0.650 88.9 88.6-111.0 -21.5 4.6 64.1 44.5 47 60 A R H X S+ 0 0 75 -4,-1.6 4,-1.5 1,-0.2 -2,-0.1 0.857 92.9 44.3 -48.4 -46.1 7.9 62.3 44.0 48 61 A A H > S+ 0 0 49 -4,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.868 112.6 49.3 -73.2 -39.8 6.3 59.1 42.7 49 62 A R H > S+ 0 0 73 -4,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.878 109.0 53.9 -66.0 -38.9 3.7 60.7 40.4 50 63 A V H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.871 107.1 50.8 -67.8 -36.6 6.3 62.9 38.8 51 64 A R H X S+ 0 0 71 -4,-1.5 4,-2.5 -5,-0.3 -1,-0.2 0.922 112.3 46.5 -65.2 -41.2 8.5 60.0 37.9 52 65 A R H X S+ 0 0 138 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.860 112.4 50.4 -69.2 -34.9 5.6 58.1 36.3 53 66 A E H X S+ 0 0 43 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.923 111.0 48.2 -70.2 -45.1 4.5 61.2 34.4 54 67 A L H X S+ 0 0 17 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.981 115.1 45.8 -52.5 -57.7 8.0 61.8 33.0 55 68 A D H X>S+ 0 0 98 -4,-2.5 4,-3.3 1,-0.2 5,-1.3 0.900 110.6 52.9 -56.3 -44.7 8.3 58.2 32.0 56 69 A R H X5S+ 0 0 137 -4,-2.7 4,-0.5 1,-0.2 -1,-0.2 0.917 117.2 37.8 -57.6 -44.1 4.9 58.1 30.4 57 70 A H H <5S+ 0 0 39 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.813 126.4 36.1 -79.5 -28.4 5.7 61.1 28.3 58 71 A V H <5S+ 0 0 8 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.789 133.1 18.8 -99.0 -30.8 9.3 60.2 27.6 59 72 A L H <5S+ 0 0 47 -4,-3.3 29,-0.6 -5,-0.3 -3,-0.2 0.562 110.5 82.6-113.2 -19.5 9.4 56.4 27.2 60 73 A G S < - 0 0 60 4,-3.3 3,-1.4 -2,-0.5 62,-0.2 -0.206 33.9-106.3 -57.6 162.2 -2.6 50.2 -6.2 73 86 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.1 0, 0.0 61,-0.1 0.844 121.3 61.7 -63.6 -29.5 -0.8 48.1 -8.8 74 87 A D T 3 S- 0 0 113 1,-0.1 3,-0.1 2,-0.1 -2,-0.1 0.097 125.3-101.3 -84.1 23.7 -3.7 48.8 -11.2 75 88 A G S < S+ 0 0 50 -3,-1.4 -1,-0.1 1,-0.3 2,-0.1 0.349 76.4 145.9 77.0 -7.4 -2.9 52.5 -11.0 76 89 A Q - 0 0 87 -5,-0.1 -4,-3.3 1,-0.1 2,-0.5 -0.366 40.5-143.5 -63.7 139.3 -5.8 53.1 -8.6 77 90 A V E -G 71 0B 56 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.2 -0.926 16.4-169.6-114.0 120.6 -5.0 55.8 -6.0 78 91 A R E -G 70 0B 48 -8,-1.6 -8,-2.8 -2,-0.5 2,-0.6 -0.863 19.2-140.0-110.3 139.8 -6.3 55.5 -2.4 79 92 A E E -G 69 0B 102 -2,-0.4 25,-3.1 -10,-0.2 26,-0.7 -0.884 32.1-172.9 -89.2 117.7 -6.4 58.0 0.4 80 93 A L E -GI 68 103B 0 -12,-3.0 -12,-1.5 -2,-0.6 2,-0.5 -0.757 21.5-144.1-109.5 159.8 -5.4 56.2 3.6 81 94 A L E -GI 67 102B 50 21,-2.4 21,-3.4 -2,-0.3 2,-0.5 -0.996 16.7-161.7-117.5 125.0 -5.3 57.1 7.3 82 95 A E E -GI 66 101B 17 -16,-3.1 -16,-2.3 -2,-0.5 2,-0.6 -0.939 5.2-158.6-109.4 121.8 -2.5 55.7 9.3 83 96 A R E -GI 65 100B 99 17,-1.8 17,-1.0 -2,-0.5 2,-0.5 -0.892 18.9-157.4 -96.8 118.7 -2.7 55.6 13.1 84 97 A N E -GI 64 99B 2 -20,-3.6 -20,-1.1 -2,-0.6 2,-0.4 -0.844 14.7-175.3-105.8 128.6 0.8 55.3 14.6 85 98 A H E - 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