==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 10-JUN-09 3HSA . COMPND 2 MOLECULE: PLECKSTRIN HOMOLOGY DOMAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA AMAZONENSIS SB2B; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 582 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28334.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 442 75.9 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 . 208 35.7 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 . 10 1.7 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 . 2 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 . 87 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 16.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 1 0 0 1 5 0 0 0 3 2 0 0 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 . 0 0 0 7 12 4 0 7 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 0 0 0 5 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 A X 0 0 192 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 157.3 35.0 53.6 -82.9 2 2 A G >> - 0 0 34 1,-0.1 3,-0.7 0, 0.0 4,-0.7 -0.439 360.0-101.4 -77.4 159.5 31.4 52.0 -82.9 3 3 A F T 34 S+ 0 0 208 1,-0.2 4,-0.3 2,-0.1 3,-0.1 0.829 120.3 27.1 -53.4 -38.9 29.2 52.5 -86.0 4 4 A L T 3> S+ 0 0 98 2,-0.1 4,-2.6 1,-0.1 -1,-0.2 0.445 95.2 94.0-105.9 -1.8 27.1 55.3 -84.4 5 5 A D H <> S+ 0 0 75 -3,-0.7 4,-1.4 1,-0.2 -2,-0.1 0.879 88.1 47.6 -59.9 -42.2 29.7 56.8 -81.8 6 6 A A H X S+ 0 0 50 -4,-0.7 4,-2.0 2,-0.2 3,-0.3 0.970 114.3 45.0 -64.8 -52.5 30.9 59.5 -84.2 7 7 A L H > S+ 0 0 106 -4,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.923 110.0 54.0 -59.8 -45.9 27.4 60.6 -85.2 8 8 A X H X S+ 0 0 44 -4,-2.6 4,-0.9 1,-0.2 103,-0.6 0.852 109.0 50.7 -59.4 -34.0 26.0 60.6 -81.7 9 9 A G H < S+ 0 0 27 -4,-1.4 3,-0.4 -3,-0.3 4,-0.2 0.917 111.9 45.6 -68.8 -43.9 28.9 62.9 -80.7 10 10 A N H >< S+ 0 0 94 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.854 103.8 65.8 -64.7 -33.5 28.2 65.3 -83.5 11 11 A A H 3< S+ 0 0 35 -4,-2.5 -1,-0.2 98,-0.3 -2,-0.2 0.822 114.6 27.0 -63.0 -33.6 24.4 65.3 -82.8 12 12 A S T 3< S+ 0 0 2 -4,-0.9 26,-2.3 -3,-0.4 -1,-0.3 0.185 95.3 129.6-112.2 15.6 24.8 67.0 -79.4 13 13 A E < - 0 0 104 -3,-1.0 2,-0.4 -4,-0.2 24,-0.1 -0.436 34.8-171.8 -72.2 142.6 28.1 68.9 -80.2 14 14 A V - 0 0 36 22,-0.4 2,-0.8 -2,-0.2 22,-0.1 -0.980 33.7-108.8-132.1 142.5 28.4 72.6 -79.5 15 15 A D > - 0 0 77 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 -0.619 28.7-163.7 -69.8 108.0 31.3 74.9 -80.6 16 16 A L H > S+ 0 0 55 -2,-0.8 4,-2.7 1,-0.2 5,-0.2 0.808 85.1 58.9 -65.5 -29.4 33.0 75.6 -77.3 17 17 A G H > S+ 0 0 50 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.939 109.1 41.9 -64.9 -49.9 34.9 78.5 -78.7 18 18 A X H > S+ 0 0 192 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.907 117.0 49.3 -61.4 -42.6 31.8 80.3 -79.7 19 19 A L H X S+ 0 0 23 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.907 109.7 50.6 -65.8 -41.3 30.1 79.4 -76.4 20 20 A A H X S+ 0 0 35 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.930 107.7 53.7 -63.6 -42.3 33.1 80.5 -74.3 21 21 A A H < S+ 0 0 70 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.917 115.8 39.4 -59.7 -42.5 33.1 83.9 -76.1 22 22 A E H < S+ 0 0 162 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.877 121.1 41.1 -78.7 -35.5 29.5 84.4 -75.3 23 23 A L H >X S+ 0 0 11 -4,-3.0 3,-2.5 1,-0.2 4,-0.5 0.658 87.7 95.5 -82.1 -17.1 29.4 83.1 -71.8 24 24 A S G >< S+ 0 0 52 -4,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.772 71.4 67.0 -51.7 -33.5 32.8 84.6 -70.7 25 25 A P G 34 S+ 0 0 51 0, 0.0 -1,-0.3 0, 0.0 441,-0.2 0.728 110.9 35.8 -59.8 -21.5 31.2 87.7 -69.1 26 26 A I G <4 S+ 0 0 17 -3,-2.5 2,-0.3 439,-0.1 -2,-0.2 0.323 99.1 97.0-111.5 5.8 29.6 85.5 -66.4 27 27 A L S << S- 0 0 11 -3,-1.2 443,-0.1 -4,-0.5 439,-0.1 -0.694 80.7-106.7 -94.8 148.3 32.5 82.9 -66.0 28 28 A G > - 0 0 8 -2,-0.3 3,-1.6 1,-0.1 -1,-0.1 -0.299 28.4-118.0 -63.1 152.0 35.1 83.2 -63.3 29 29 A D T 3 S+ 0 0 112 1,-0.3 -1,-0.1 437,-0.1 -2,-0.0 0.825 119.1 50.3 -66.6 -25.9 38.6 84.2 -64.5 30 30 A N T 3 S+ 0 0 119 444,-0.2 2,-0.4 2,-0.0 -1,-0.3 -0.007 96.2 100.8 -95.9 30.2 39.8 80.8 -63.3 31 31 A E < - 0 0 21 -3,-1.6 2,-0.4 -7,-0.1 -4,-0.1 -0.926 47.0-175.9-122.5 136.5 37.0 79.0 -65.2 32 32 A E - 0 0 117 -2,-0.4 16,-1.8 -5,-0.0 2,-0.3 -0.982 28.9-118.8-129.4 145.7 37.1 77.1 -68.5 33 33 A L E +A 47 0A 21 -2,-0.4 14,-0.3 14,-0.2 3,-0.1 -0.655 33.9 172.4 -75.6 140.0 34.4 75.4 -70.5 34 34 A Q E - 0 0 65 12,-3.0 2,-0.3 1,-0.5 13,-0.2 0.753 57.7 -3.1-120.0 -44.2 35.3 71.7 -70.8 35 35 A L E -A 46 0A 62 11,-1.9 11,-3.1 -19,-0.0 -1,-0.5 -0.976 56.1-165.3-147.6 157.4 32.4 69.9 -72.5 36 36 A A E -A 45 0A 16 -2,-0.3 2,-0.4 9,-0.2 -22,-0.4 -0.994 4.6-161.6-147.7 144.9 28.9 70.8 -73.7 37 37 A Y E -A 44 0A 18 7,-2.5 7,-2.9 -2,-0.3 2,-0.9 -0.989 7.0-157.4-129.2 118.4 25.8 68.8 -74.8 38 38 A X E +A 43 0A 141 -26,-2.3 5,-0.2 -2,-0.4 2,-0.1 -0.865 28.4 175.7 -92.9 100.9 23.0 70.3 -76.8 39 39 A X - 0 0 12 3,-2.9 67,-0.1 -2,-0.9 66,-0.0 -0.365 48.3 -70.3-100.6-176.1 20.1 68.1 -76.0 40 40 A V S S- 0 0 54 65,-0.3 66,-0.1 1,-0.2 3,-0.1 0.873 122.4 -8.1 -44.7 -53.8 16.4 68.3 -77.1 41 41 A R S S+ 0 0 164 64,-0.4 15,-0.5 1,-0.1 2,-0.3 0.348 125.3 63.4-131.0 10.0 15.5 71.4 -75.1 42 42 A D E - B 0 55A 5 63,-0.2 -3,-2.9 13,-0.1 2,-0.6 -0.988 60.0-144.8-140.7 143.6 18.6 72.1 -72.8 43 43 A L E -AB 38 54A 35 11,-2.8 11,-3.0 -2,-0.3 2,-0.7 -0.950 16.9-159.0-104.7 117.2 22.2 73.0 -73.2 44 44 A F E -AB 37 53A 0 -7,-2.9 -7,-2.5 -2,-0.6 2,-0.6 -0.925 9.3-169.5 -96.0 116.5 24.3 71.3 -70.6 45 45 A V E -AB 36 52A 0 7,-2.4 7,-2.6 -2,-0.7 2,-0.8 -0.942 5.8-158.5-111.4 110.2 27.6 73.3 -70.3 46 46 A F E +AB 35 51A 1 -11,-3.1 -12,-3.0 -2,-0.6 -11,-1.9 -0.830 16.2 178.1 -91.8 110.9 30.3 71.5 -68.2 47 47 A T E -A 33 0A 0 3,-3.0 -14,-0.2 -2,-0.8 -16,-0.0 -0.477 48.0 -98.6 -96.5 177.8 32.8 74.0 -66.9 48 48 A S S S+ 0 0 37 -16,-1.8 -15,-0.1 -2,-0.2 3,-0.1 0.662 123.7 27.5 -68.1 -16.6 35.8 73.2 -64.6 49 49 A X S S+ 0 0 98 1,-0.3 22,-1.0 -17,-0.2 2,-0.3 0.684 124.4 3.1-118.4 -28.0 33.6 74.5 -61.7 50 50 A R E - C 0 70A 3 20,-0.2 -3,-3.0 21,-0.1 2,-0.6 -0.982 60.6-108.3-155.4 161.8 29.9 73.9 -62.5 51 51 A L E -BC 46 69A 0 18,-2.4 18,-3.5 -2,-0.3 2,-0.7 -0.871 30.4-159.4 -87.1 124.4 27.3 72.6 -64.7 52 52 A I E -BC 45 68A 0 -7,-2.6 -7,-2.4 -2,-0.6 2,-0.6 -0.956 6.2-161.8-106.8 112.8 25.5 75.6 -66.4 53 53 A L E -BC 44 67A 0 14,-3.0 14,-2.8 -2,-0.7 2,-0.5 -0.864 9.2-169.0 -98.8 118.4 22.1 74.3 -67.5 54 54 A I E +BC 43 66A 19 -11,-3.0 -11,-2.8 -2,-0.6 2,-0.3 -0.947 18.6 142.5-115.8 124.8 20.7 76.6 -70.2 55 55 A D E -BC 42 65A 20 10,-1.7 10,-3.3 -2,-0.5 2,-0.4 -0.957 49.6 -93.9-152.2 169.9 17.1 76.4 -71.4 56 56 A X E + C 0 64A 203 -15,-0.5 8,-0.2 -2,-0.3 2,-0.2 -0.754 48.3 166.0 -90.2 134.6 14.1 78.6 -72.6 57 57 A Q E + C 0 63A 51 6,-2.5 6,-2.4 -2,-0.4 3,-0.1 -0.705 18.2 85.8-135.4-175.8 11.6 79.4 -69.9 58 58 A G S > S- 0 0 40 3,-0.2 3,-1.4 -2,-0.2 374,-0.1 -0.029 86.3 -70.4 98.6 160.9 8.6 81.7 -69.3 59 59 A V T 3 S+ 0 0 154 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.773 137.3 24.5 -56.4 -31.5 4.9 81.6 -70.1 60 60 A T T 3 S- 0 0 91 -3,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.111 115.6-104.9-121.0 19.2 5.6 82.1 -73.8 61 61 A G S < S+ 0 0 28 -3,-1.4 -3,-0.2 1,-0.1 -2,-0.1 0.772 83.7 124.7 64.0 29.2 9.2 80.7 -73.9 62 62 A X + 0 0 173 369,-0.1 2,-0.3 -6,-0.1 370,-0.2 0.558 49.7 82.5 -94.8 -10.0 10.8 84.2 -74.1 63 63 A X E -C 57 0A 54 -6,-2.4 -6,-2.5 368,-0.1 2,-0.5 -0.660 65.8-146.9 -93.7 152.0 13.1 83.9 -71.1 64 64 A V E -C 56 0A 41 -2,-0.3 366,-2.3 -8,-0.2 2,-0.5 -0.985 12.7-151.3-116.4 130.3 16.5 82.2 -71.1 65 65 A S E -CD 55 429A 0 -10,-3.3 -10,-1.7 -2,-0.5 2,-0.6 -0.905 10.8-169.2-106.3 127.6 17.6 80.5 -67.9 66 66 A Y E -CD 54 428A 68 362,-3.2 362,-2.2 -2,-0.5 2,-0.7 -0.931 14.1-172.4-111.6 96.6 21.3 80.1 -66.9 67 67 A H E -CD 53 427A 11 -14,-2.8 -14,-3.0 -2,-0.6 2,-0.6 -0.862 8.6-155.8-101.4 111.3 21.2 77.7 -64.0 68 68 A S E -CD 52 426A 4 358,-2.9 358,-1.9 -2,-0.7 -16,-0.2 -0.800 12.4-178.0 -90.6 119.0 24.6 77.3 -62.3 69 69 A I E -C 51 0A 0 -18,-3.5 -18,-2.4 -2,-0.6 356,-0.1 -0.876 18.9-144.8-120.4 96.1 25.0 74.0 -60.5 70 70 A P E > -C 50 0A 4 0, 0.0 3,-2.4 0, 0.0 4,-0.3 -0.337 25.1-120.8 -54.5 141.8 28.3 73.5 -58.7 71 71 A Y G > S+ 0 0 24 -22,-1.0 3,-1.9 1,-0.3 -21,-0.1 0.852 111.8 62.9 -62.8 -36.0 29.2 69.9 -58.9 72 72 A X G 3 S+ 0 0 139 1,-0.3 -1,-0.3 52,-0.0 -22,-0.1 0.655 95.7 63.5 -56.7 -19.4 29.3 69.5 -55.1 73 73 A A G < S+ 0 0 2 -3,-2.4 23,-2.7 351,-0.1 2,-0.8 0.511 75.9 97.2 -84.3 -6.8 25.5 70.4 -55.2 74 74 A I E < +G 95 0B 12 -3,-1.9 21,-0.2 -4,-0.3 3,-0.1 -0.769 50.0 176.6 -84.1 113.3 24.6 67.3 -57.2 75 75 A V E - 0 0 24 19,-3.3 2,-0.3 -2,-0.8 -1,-0.2 0.914 60.3 -25.1 -88.7 -46.1 23.5 64.9 -54.4 76 76 A H E -G 94 0B 2 18,-0.9 18,-2.4 454,-0.1 -1,-0.4 -0.935 61.1-156.2-157.3 170.6 22.4 61.9 -56.5 77 77 A F E -GH 93 529B 7 452,-2.0 452,-2.8 -2,-0.3 2,-0.3 -0.987 2.6-161.3-156.9 154.1 21.1 61.3 -60.0 78 78 A Q E -GH 92 528B 15 14,-2.5 14,-3.0 -2,-0.3 2,-0.4 -0.993 5.0-161.3-142.7 141.9 19.1 58.8 -62.0 79 79 A V E +GH 91 527B 9 448,-2.0 448,-2.9 -2,-0.3 2,-0.3 -0.995 19.7 179.1-125.7 134.7 18.7 57.9 -65.7 80 80 A E E -GH 90 526B 22 10,-2.2 10,-2.6 -2,-0.4 446,-0.2 -0.973 38.1 -94.5-134.8 143.9 15.6 56.0 -66.8 81 81 A T E +G 89 0B 41 444,-2.4 8,-0.3 -2,-0.3 2,-0.3 -0.383 55.5 178.4 -49.2 130.7 14.2 54.7 -70.1 82 82 A A E +G 88 0B 18 6,-2.0 6,-1.8 24,-0.1 5,-0.1 -0.873 25.6 62.5-138.7 171.4 11.7 57.3 -71.4 83 83 A G S > S- 0 0 39 -2,-0.3 3,-1.7 3,-0.2 7,-0.0 0.248 83.4 -88.1 87.9 146.3 9.3 58.1 -74.4 84 84 A T T 3 S+ 0 0 139 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.840 131.8 44.5 -53.3 -37.4 6.2 56.2 -75.6 85 85 A F T 3 S- 0 0 181 -3,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.457 111.1-123.0 -88.3 -2.7 8.4 53.9 -77.8 86 86 A D S < S+ 0 0 64 -3,-1.7 -3,-0.2 1,-0.0 -2,-0.1 0.709 77.7 120.1 65.1 27.8 11.0 53.5 -75.0 87 87 A X + 0 0 92 -6,-0.1 -4,-0.2 -5,-0.1 -1,-0.0 0.729 61.9 53.9 -86.9 -28.0 13.8 54.9 -77.2 88 88 A D E S-G 82 0B 38 -6,-1.8 -6,-2.0 19,-0.1 2,-0.3 -0.097 72.6-123.5-103.1-167.8 14.9 57.9 -75.1 89 89 A A E -GI 81 106B 8 17,-2.4 17,-2.4 -8,-0.3 2,-0.5 -0.968 3.2-145.6-139.7 158.7 16.0 58.6 -71.6 90 90 A E E -GI 80 105B 56 -10,-2.6 -10,-2.2 -2,-0.3 2,-0.4 -0.996 15.4-155.2-124.6 124.3 15.0 60.8 -68.7 91 91 A L E -GI 79 104B 1 13,-3.1 13,-3.3 -2,-0.5 2,-0.5 -0.866 5.1-166.2 -98.1 132.4 17.7 62.3 -66.4 92 92 A X E -GI 78 103B 80 -14,-3.0 -14,-2.5 -2,-0.4 2,-0.5 -0.992 3.8-171.9-117.3 124.8 16.8 63.3 -62.9 93 93 A L E -GI 77 102B 0 9,-2.4 9,-2.7 -2,-0.5 2,-0.7 -0.975 11.1-152.0-117.0 118.6 19.4 65.4 -61.0 94 94 A W E -G 76 0B 22 -18,-2.4 -19,-3.3 -2,-0.5 -18,-0.9 -0.819 14.1-158.9 -93.7 118.1 18.8 66.0 -57.3 95 95 A I E > -G 74 0B 5 -2,-0.7 3,-2.6 5,-0.4 -21,-0.2 -0.802 32.4 -89.9 -98.2 138.7 20.3 69.3 -56.2 96 96 A S T 3 S+ 0 0 42 -23,-2.7 -1,-0.1 -2,-0.4 3,-0.1 -0.154 113.3 18.7 -46.8 127.9 21.2 70.0 -52.6 97 97 A G T 3 S+ 0 0 48 1,-0.2 2,-0.5 124,-0.1 -1,-0.3 0.244 103.7 98.2 92.1 -10.8 18.2 71.6 -50.8 98 98 A Q < - 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