==== 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 UNKNOWN FUNCTION 25-JAN-07 2OOJ . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA ONEIDENSIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 265 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12515.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 75.1 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 . 162 61.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 5 1.9 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 0.4 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 . 20 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 6.8 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+4), 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 . 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 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 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 . 2 2 0 0 0 1 2 3 0 2 2 0 4 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 0 0 0 2 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 E 0 0 219 0, 0.0 2,-0.4 0, 0.0 127,-0.0 0.000 360.0 360.0 360.0 -28.3 61.5 5.9 -2.4 2 3 A X - 0 0 64 127,-0.1 2,-0.3 125,-0.0 127,-0.2 -0.716 360.0-138.7 -91.0 133.0 57.8 6.8 -2.8 3 4 A T E -A 128 0A 71 125,-3.1 125,-2.9 -2,-0.4 2,-0.5 -0.720 24.1-155.4 -79.1 140.3 56.0 6.7 -6.2 4 5 A K E +A 127 0A 153 -2,-0.3 2,-0.3 123,-0.2 123,-0.2 -0.977 19.1 166.9-128.3 117.2 53.8 9.8 -6.4 5 6 A V E -A 126 0A 19 121,-2.2 121,-2.7 -2,-0.5 2,-0.3 -0.871 13.7-161.8-125.3 156.6 50.7 10.0 -8.6 6 7 A T E +A 125 0A 101 -2,-0.3 34,-0.4 119,-0.2 2,-0.3 -0.958 21.6 138.2-130.0 158.1 47.7 12.4 -8.8 7 8 A G E -A 124 0A 13 117,-1.9 117,-2.5 -2,-0.3 2,-0.3 -0.954 44.8 -73.9-172.8-169.6 44.3 12.2 -10.3 8 9 A K E -A 123 0A 103 -2,-0.3 30,-2.8 30,-0.3 2,-0.3 -0.695 36.2-175.6-100.7 150.8 40.6 12.9 -10.0 9 10 A F E -AB 122 37A 5 113,-2.2 113,-0.7 -2,-0.3 2,-0.4 -0.974 16.0-144.6-139.5 159.8 38.0 11.3 -7.9 10 11 A D E - B 0 36A 74 26,-2.4 26,-2.4 -2,-0.3 2,-0.4 -0.963 18.1-165.8-113.6 143.0 34.3 11.5 -7.3 11 12 A V E - B 0 35A 48 -2,-0.4 2,-0.4 24,-0.2 24,-0.2 -0.985 11.7-170.7-134.0 140.0 32.7 11.0 -3.9 12 13 A K E - B 0 34A 92 22,-2.8 22,-2.1 -2,-0.4 2,-0.5 -1.000 8.7-165.8-124.0 130.1 29.1 10.4 -2.8 13 14 A L E - B 0 33A 76 -2,-0.4 20,-0.2 20,-0.2 35,-0.0 -0.873 3.6-162.3-125.8 106.2 28.3 10.5 1.0 14 15 A T E - B 0 32A 59 18,-1.5 18,-2.5 -2,-0.5 -2,-0.0 -0.635 24.0-117.3 -92.9 128.7 24.9 9.1 2.1 15 16 A P E - B 0 31A 111 0, 0.0 2,-0.3 0, 0.0 16,-0.2 -0.326 35.2-178.8 -65.0 144.6 23.7 10.1 5.6 16 17 A E E - B 0 30A 53 14,-2.4 14,-0.6 16,-0.0 2,-0.5 -0.842 35.1 -91.2-130.7 170.4 23.2 7.3 8.2 17 18 A N - 0 0 137 -2,-0.3 2,-0.2 12,-0.1 12,-0.1 -0.762 38.4-136.9 -87.3 126.7 22.0 7.3 11.8 18 19 A A - 0 0 19 -2,-0.5 12,-0.1 10,-0.2 10,-0.0 -0.586 4.7-139.7 -82.0 144.3 24.7 7.7 14.4 19 20 A Y S S+ 0 0 82 -2,-0.2 2,-0.2 10,-0.1 -1,-0.1 0.904 84.1 50.3 -67.9 -46.0 24.6 5.5 17.4 20 21 A A S S- 0 0 8 159,-0.1 2,-0.4 9,-0.1 8,-0.1 -0.516 78.5-131.1 -96.2 165.1 25.6 8.2 19.9 21 22 A T - 0 0 111 -2,-0.2 158,-0.1 179,-0.1 2,-0.1 -0.957 19.4-122.6-118.3 135.7 24.2 11.7 20.4 22 23 A G - 0 0 17 -2,-0.4 2,-0.3 6,-0.1 3,-0.1 -0.389 28.6-171.8 -71.8 144.3 26.2 14.9 20.7 23 24 A V > + 0 0 57 1,-0.1 3,-1.4 212,-0.1 178,-0.1 -0.899 58.9 34.2-130.3 164.6 25.9 17.1 23.7 24 25 A G T 3 S- 0 0 52 -2,-0.3 31,-0.3 1,-0.3 -1,-0.1 0.813 138.9 -44.8 63.6 29.8 27.2 20.5 24.7 25 26 A G T 3 S+ 0 0 50 1,-0.4 2,-0.3 -3,-0.1 -1,-0.3 0.358 106.7 131.5 97.1 -6.2 26.8 21.8 21.1 26 27 A V < - 0 0 11 -3,-1.4 2,-0.4 209,-0.2 -1,-0.4 -0.628 38.2-164.1 -79.3 139.0 28.4 18.8 19.5 27 28 A N E - C 0 53A 114 26,-2.4 26,-2.7 -2,-0.3 2,-0.3 -0.996 8.5-156.7-121.6 123.2 26.6 17.2 16.6 28 29 A L E - C 0 52A 24 -2,-0.4 2,-0.3 24,-0.2 24,-0.2 -0.714 11.2-173.5-100.4 150.7 27.7 13.6 15.6 29 30 A G E - C 0 51A 18 22,-2.0 22,-2.2 -2,-0.3 2,-0.4 -0.960 17.7-162.2-140.7 155.0 27.3 12.0 12.2 30 31 A R E +BC 16 50A 25 -14,-0.6 -14,-2.4 -2,-0.3 2,-0.3 -0.985 19.3 178.9-133.8 136.3 27.8 8.8 10.4 31 32 A X E -BC 15 49A 45 18,-2.3 18,-2.7 -2,-0.4 2,-0.3 -0.994 26.9-128.3-136.5 145.9 27.9 8.6 6.6 32 33 A A E -BC 14 48A 2 -18,-2.5 -18,-1.5 -2,-0.3 2,-0.4 -0.709 29.1-146.7 -86.9 140.3 28.4 5.9 4.0 33 34 A L E +BC 13 47A 2 14,-2.9 14,-2.0 -2,-0.3 2,-0.4 -0.938 21.0 175.3-117.5 132.2 31.1 6.6 1.5 34 35 A D E +BC 12 46A 40 -22,-2.1 -22,-2.8 -2,-0.4 2,-0.3 -0.994 15.3 173.0-131.6 124.2 31.2 5.6 -2.2 35 36 A K E -BC 11 45A 20 10,-2.3 10,-2.6 -2,-0.4 2,-0.4 -0.962 22.6-155.9-132.9 154.6 34.1 6.9 -4.3 36 37 A T E -BC 10 44A 41 -26,-2.4 -26,-2.4 -2,-0.3 2,-0.4 -0.996 12.8-157.0-127.7 123.8 35.5 6.4 -7.8 37 38 A F E -BC 9 43A 1 6,-3.5 6,-1.5 -2,-0.4 2,-0.3 -0.858 7.7-162.4 -99.4 136.8 39.1 7.1 -8.6 38 39 A Y + 0 0 105 -30,-2.8 3,-0.5 -2,-0.4 2,-0.4 -0.859 50.0 18.3-113.9 152.6 40.3 7.9 -12.1 39 40 A G S S+ 0 0 57 -2,-0.3 -32,-0.1 1,-0.2 34,-0.1 -0.785 123.2 0.8 101.8-130.5 43.8 7.8 -13.6 40 41 A E S S+ 0 0 101 -34,-0.4 33,-2.7 -2,-0.4 2,-0.7 0.909 138.1 48.6 -68.2 -34.7 46.8 5.9 -12.2 41 42 A L E S+ D 0 72A 0 -3,-0.5 2,-0.6 31,-0.2 31,-0.2 -0.917 76.3 177.6 -97.0 109.1 44.5 4.8 -9.4 42 43 A E E + D 0 71A 128 29,-2.9 29,-2.4 -2,-0.7 2,-0.3 -0.909 32.4 120.7-115.8 101.1 41.5 3.5 -11.3 43 44 A A E -CD 37 70A 7 -6,-1.5 -6,-3.5 -2,-0.6 2,-0.4 -0.951 55.7-126.9-159.8 163.2 39.2 2.2 -8.6 44 45 A R E -CD 36 69A 90 25,-2.5 25,-2.7 -2,-0.3 2,-0.3 -0.944 27.1-168.0-119.8 145.3 36.0 2.1 -6.7 45 46 A S E -CD 35 68A 4 -10,-2.6 -10,-2.3 -2,-0.4 2,-0.3 -0.960 10.4-173.6-135.5 151.1 35.8 2.4 -2.9 46 47 A Q E +CD 34 67A 78 21,-1.7 21,-3.2 -2,-0.3 2,-0.3 -0.988 28.4 113.8-133.5 145.5 33.2 1.9 -0.2 47 48 A G E -CD 33 66A 2 -14,-2.0 -14,-2.9 -2,-0.3 2,-0.3 -0.929 49.7 -91.1-174.1-157.9 33.3 2.6 3.5 48 49 A E E -CD 32 65A 6 17,-2.0 17,-2.0 -2,-0.3 2,-0.4 -0.961 20.2-155.0-139.2 155.9 32.0 4.8 6.3 49 50 A X E -CD 31 64A 32 -18,-2.7 -18,-2.3 -2,-0.3 2,-0.4 -0.965 3.7-156.2-125.0 143.6 32.9 8.0 8.0 50 51 A L E -CD 30 63A 6 13,-3.0 13,-2.7 -2,-0.4 2,-0.3 -0.964 18.2-170.2-117.0 149.2 32.2 9.3 11.5 51 52 A S E -CD 29 62A 13 -22,-2.2 -22,-2.0 -2,-0.4 2,-0.4 -0.922 19.7-164.2-140.1 151.0 32.1 13.0 12.3 52 53 A A E -CD 28 61A 1 9,-2.5 9,-2.8 -2,-0.3 2,-0.4 -0.951 10.0-168.8-140.3 117.0 31.9 15.4 15.2 53 54 A X E -CD 27 60A 78 -26,-2.7 -26,-2.4 -2,-0.4 7,-0.2 -0.885 12.3-154.7-102.3 137.0 31.0 19.0 14.6 54 55 A T - 0 0 8 5,-1.9 5,-0.2 -2,-0.4 181,-0.1 -0.495 30.1-104.1-106.1 176.5 31.5 21.4 17.6 55 56 A A S S+ 0 0 80 179,-0.6 2,-0.4 -31,-0.3 180,-0.1 0.455 97.6 86.6 -81.3 -0.7 29.8 24.7 18.4 56 57 A V S > S- 0 0 61 3,-0.2 3,-1.6 178,-0.2 -2,-0.4 -0.844 91.1-105.3-103.8 135.8 32.8 26.7 17.3 57 58 A K T 3 S+ 0 0 113 -2,-0.4 32,-0.4 1,-0.3 3,-0.1 -0.323 100.2 8.6 -63.5 137.6 33.1 27.6 13.6 58 59 A G T 3 S+ 0 0 28 31,-0.2 2,-0.6 1,-0.2 31,-0.5 0.614 98.3 118.7 72.1 12.2 35.6 25.5 11.6 59 60 A S < + 0 0 1 -3,-1.6 -5,-1.9 29,-0.3 2,-0.3 -0.952 34.8 120.1-115.0 117.5 36.2 23.1 14.4 60 61 A A E -DE 53 87A 0 27,-2.3 27,-2.5 -2,-0.6 2,-0.3 -0.974 43.6-136.2-163.8 163.2 35.3 19.5 13.7 61 62 A G E -DE 52 86A 0 -9,-2.8 -9,-2.5 -2,-0.3 2,-0.3 -0.987 16.1-177.1-132.4 148.5 36.7 15.9 13.5 62 63 A Y E -DE 51 85A 63 23,-2.2 23,-2.7 -2,-0.3 2,-0.3 -0.993 2.9-179.2-136.7 148.7 36.2 13.1 11.0 63 64 A V E +DE 50 84A 0 -13,-2.7 -13,-3.0 -2,-0.3 2,-0.3 -0.980 10.3 171.8-138.7 158.4 37.4 9.6 10.7 64 65 A A E -DE 49 83A 0 19,-1.6 19,-2.6 -2,-0.3 2,-0.4 -0.994 23.7-155.4-158.2 158.4 36.8 6.9 8.1 65 66 A I E +DE 48 82A 8 -17,-2.0 -17,-2.0 -2,-0.3 2,-0.4 -0.986 22.2 179.8-134.6 132.1 37.7 3.5 6.8 66 67 A E E -DE 47 81A 0 15,-2.4 15,-2.6 -2,-0.4 2,-0.6 -0.997 23.9-139.0-136.4 139.5 37.3 2.6 3.1 67 68 A Q E -DE 46 80A 8 -21,-3.2 -21,-1.7 -2,-0.4 2,-0.4 -0.862 22.2-160.0 -96.2 120.1 37.9 -0.5 1.0 68 69 A V E -DE 45 79A 0 11,-2.9 11,-1.8 -2,-0.6 2,-0.4 -0.804 9.2-176.1-103.6 133.9 39.4 0.3 -2.4 69 70 A V E +DE 44 78A 61 -25,-2.7 -25,-2.5 -2,-0.4 2,-0.3 -0.990 40.5 59.4-132.6 120.6 39.2 -2.2 -5.3 70 71 A G E S-DE 43 77A 11 7,-2.3 7,-3.1 -2,-0.4 2,-0.4 -0.956 80.3 -38.7 169.5-140.7 40.8 -1.6 -8.6 71 72 A K E -DE 42 76A 22 -29,-2.4 -29,-2.9 -2,-0.3 2,-0.5 -0.966 31.5-166.5-122.8 136.6 44.1 -0.9 -10.4 72 73 A L E > S-DE 41 75A 0 3,-2.2 3,-2.2 -2,-0.4 -31,-0.2 -0.988 85.2 -21.4-120.5 118.0 47.0 1.2 -9.2 73 74 A C T 3 S- 0 0 53 -33,-2.7 -1,-0.1 -2,-0.5 -32,-0.1 0.890 131.0 -48.9 50.0 43.4 49.5 1.8 -12.0 74 75 A G T 3 S+ 0 0 63 -34,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.263 110.7 122.6 86.3 -10.8 48.1 -1.3 -13.9 75 76 A R E < -E 72 0A 94 -3,-2.2 -3,-2.2 30,-0.1 2,-0.5 -0.765 55.8-139.9 -93.5 125.4 48.3 -3.6 -10.9 76 77 A Q E +E 71 0A 97 -2,-0.5 29,-2.8 -5,-0.2 30,-0.3 -0.690 51.2 87.7 -92.1 124.1 44.9 -5.2 -10.0 77 78 A G E -EF 70 104A 9 -7,-3.1 -7,-2.3 -2,-0.5 2,-0.3 -0.843 59.1 -95.2-174.8-152.0 44.1 -5.5 -6.4 78 79 A S E +EF 69 103A 6 25,-1.2 25,-2.3 -2,-0.3 2,-0.3 -0.977 25.6 171.5-152.3 158.3 42.6 -4.0 -3.3 79 80 A F E -E 68 0A 2 -11,-1.8 -11,-2.9 -2,-0.3 2,-0.4 -0.952 28.5-115.5-161.9 164.4 43.7 -2.0 -0.1 80 81 A V E -E 67 0A 0 18,-0.4 18,-2.6 -2,-0.3 2,-0.4 -0.943 19.0-154.5-111.5 133.8 42.1 -0.2 2.8 81 82 A L E -EG 66 97A 0 -15,-2.6 -15,-2.4 -2,-0.4 2,-0.5 -0.912 5.7-160.2-105.6 133.2 42.5 3.5 3.5 82 83 A Q E -EG 65 96A 0 14,-3.0 14,-2.6 -2,-0.4 2,-0.3 -0.971 9.5-159.6-117.5 131.1 42.1 4.9 7.0 83 84 A H E +EG 64 95A 15 -19,-2.6 -19,-1.6 -2,-0.5 2,-0.4 -0.860 17.0 175.4-115.7 139.8 41.4 8.6 7.6 84 85 A F E +EG 63 94A 11 10,-2.1 10,-2.8 -2,-0.3 2,-0.4 -0.954 14.6 173.7-142.2 121.5 41.8 10.9 10.6 85 86 A G E -EG 62 93A 7 -23,-2.7 -23,-2.2 -2,-0.4 2,-0.4 -0.989 14.7-176.6-132.4 137.2 41.0 14.6 10.2 86 87 A I E -EG 61 92A 4 6,-2.4 6,-2.2 -2,-0.4 2,-0.5 -0.977 6.5-168.1-132.1 120.6 40.8 17.5 12.6 87 88 A X E +E 60 0A 65 -27,-2.5 -27,-2.3 -2,-0.4 2,-0.4 -0.946 9.7 173.9-103.0 119.2 39.7 21.0 11.4 88 89 A T 0 0 42 1,-0.7 -29,-0.3 -2,-0.5 -30,-0.1 -0.862 360.0 360.0-133.2 106.9 40.4 23.8 13.9 89 90 A D 0 0 152 -31,-0.5 -1,-0.7 -2,-0.4 -31,-0.2 0.804 360.0 360.0 55.9 360.0 39.4 26.8 12.0 90 ! 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 91 93 A N 0 0 109 0, 0.0 2,-0.4 0, 0.0 -4,-0.2 0.000 360.0 360.0 360.0 127.5 43.1 21.4 9.0 92 94 A R E +G 86 0A 119 -6,-2.2 -6,-2.4 2,-0.0 2,-0.4 -0.995 360.0 178.3-128.9 123.8 45.1 18.3 9.7 93 95 A L E -G 85 0A 94 -2,-0.4 2,-0.5 -8,-0.2 -8,-0.2 -0.991 10.8-175.9-136.1 123.8 44.4 15.2 7.6 94 96 A H E +G 84 0A 78 -10,-2.8 -10,-2.1 -2,-0.4 2,-0.5 -0.987 5.3 176.4-117.3 118.8 46.1 11.8 7.7 95 97 A L E +G 83 0A 2 18,-0.5 18,-2.2 -2,-0.5 2,-0.4 -0.976 14.7 174.9-126.3 114.9 45.0 9.2 5.1 96 98 A E E -GH 82 112A 42 -14,-2.6 -14,-3.0 -2,-0.5 2,-0.4 -0.931 36.8-116.8-132.5 140.4 47.0 6.0 5.3 97 99 A V E -G 81 0A 4 14,-2.7 14,-0.4 -2,-0.4 -16,-0.2 -0.664 43.2-116.9 -70.3 123.5 47.0 2.5 3.7 98 100 A V > - 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