==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 18-MAY-12 4F98 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 62 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4695.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 30 48.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 25.8 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 . 1 1.6 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 . 4 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 8.1 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 . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 1 0 0 0 0 1 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 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 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 25 A K 0 0 132 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -84.9 28.6 17.9 13.4 2 26 A D > + 0 0 116 1,-0.1 3,-1.5 3,-0.0 23,-0.1 -0.812 360.0 177.9-127.6 89.4 30.7 18.3 16.6 3 27 A P T 3 S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 22,-0.1 0.723 77.1 63.8 -68.4 -17.7 28.8 16.6 19.4 4 28 A G T > S+ 0 0 9 20,-0.1 3,-1.9 37,-0.1 47,-0.1 0.623 73.3 125.9 -75.9 -13.6 31.6 17.4 21.9 5 29 A R T < S- 0 0 219 -3,-1.5 -3,-0.0 1,-0.3 0, 0.0 -0.206 83.5 -3.1 -52.8 122.3 31.0 21.2 21.6 6 30 A G T 3 S+ 0 0 81 1,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.519 99.5 125.8 75.7 10.8 30.4 22.8 25.0 7 31 A L < - 0 0 43 -3,-1.9 -1,-0.2 43,-0.0 2,-0.2 -0.863 51.3-140.4-103.2 132.4 30.4 19.6 27.1 8 32 A P - 0 0 97 0, 0.0 43,-0.6 0, 0.0 2,-0.3 -0.543 32.8-100.8 -78.0 154.0 32.7 19.1 30.1 9 33 A V B -a 51 0A 64 -2,-0.2 2,-0.2 41,-0.1 43,-0.2 -0.619 45.9-149.6 -70.9 130.3 34.4 15.8 30.6 10 34 A E - 0 0 72 41,-2.8 43,-0.4 -2,-0.3 2,-0.1 -0.659 26.1 -79.2-104.8 162.5 32.3 14.0 33.3 11 35 A E - 0 0 151 -2,-0.2 2,-0.3 41,-0.1 -1,-0.1 -0.372 53.3-179.7 -58.4 127.7 33.3 11.4 35.9 12 36 A Y - 0 0 66 41,-0.2 2,-0.4 -2,-0.1 -1,-0.0 -0.953 14.5-164.6-135.1 149.3 33.6 8.0 34.4 13 37 A H > - 0 0 95 -2,-0.3 3,-2.0 3,-0.0 41,-0.0 -0.990 31.5-109.4-132.0 128.5 34.5 4.6 35.9 14 38 A Y T 3 S+ 0 0 227 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 -0.300 104.3 17.6 -53.4 132.9 35.5 1.5 34.0 15 39 A G T 3 S+ 0 0 64 1,-0.3 -1,-0.3 3,-0.0 2,-0.2 0.339 88.4 143.8 87.6 -4.6 32.8 -1.1 34.2 16 40 A X < - 0 0 77 -3,-2.0 2,-0.3 1,-0.1 -1,-0.3 -0.461 55.8-116.9 -74.2 137.3 30.1 1.3 35.2 17 41 A Q - 0 0 98 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.582 40.4-174.8 -67.7 124.4 26.6 0.7 33.9 18 42 A L - 0 0 59 -2,-0.3 2,-1.0 2,-0.0 -3,-0.0 -0.864 33.5-116.9-118.0 162.5 25.6 3.7 31.7 19 43 A D + 0 0 70 -2,-0.3 2,-0.7 0, 0.0 27,-0.1 -0.814 44.3 175.0 -99.1 90.1 22.4 4.6 30.0 20 44 A V + 0 0 67 -2,-1.0 24,-0.2 1,-0.2 3,-0.1 -0.890 19.7 157.5-105.0 109.9 23.7 4.6 26.4 21 45 A K S S+ 0 0 105 22,-2.9 2,-0.3 -2,-0.7 23,-0.2 0.872 74.8 2.9 -87.8 -53.2 21.1 5.1 23.6 22 46 A N E -B 43 0A 79 21,-1.7 21,-3.0 0, 0.0 2,-0.6 -0.996 59.5-138.6-137.3 143.6 23.5 6.4 20.9 23 47 A V E +B 42 0A 87 -2,-0.3 19,-0.3 19,-0.2 3,-0.1 -0.904 23.6 176.7 -97.6 116.6 27.2 6.9 20.6 24 48 A L E + 0 0 78 17,-2.3 2,-0.3 -2,-0.6 18,-0.2 0.753 63.5 12.4 -94.6 -27.8 27.7 10.2 18.7 25 49 A H E +B 41 0A 73 16,-1.9 16,-2.1 -22,-0.1 -1,-0.3 -0.989 56.0 168.9-149.2 140.4 31.5 10.4 18.8 26 50 A R E -B 40 0A 116 -2,-0.3 14,-0.2 14,-0.2 12,-0.0 -0.957 43.1-100.0-148.0 140.3 34.4 8.2 19.6 27 51 A T - 0 0 38 12,-1.5 2,-1.2 -2,-0.3 -2,-0.0 -0.240 35.9-119.5 -51.9 135.9 38.1 8.8 18.9 28 52 A D + 0 0 129 1,-0.2 3,-0.2 2,-0.0 -1,-0.1 -0.722 48.9 156.6 -83.2 101.1 39.4 7.0 15.8 29 53 A N > + 0 0 17 -2,-1.2 30,-2.5 1,-0.1 3,-1.4 0.126 29.3 120.8-108.0 19.8 42.0 4.7 17.3 30 54 A S T 3 S+ 0 0 59 1,-0.3 -1,-0.1 28,-0.2 -2,-0.0 0.841 77.6 42.9 -53.9 -41.9 41.9 2.2 14.5 31 55 A T T 3 S+ 0 0 104 -3,-0.2 -1,-0.3 28,-0.1 2,-0.2 0.524 96.3 98.6 -83.5 -8.8 45.6 2.6 13.6 32 56 A R < - 0 0 69 -3,-1.4 28,-2.7 25,-0.1 2,-0.4 -0.485 56.8-153.3 -85.5 150.8 46.9 2.7 17.2 33 57 A T + 0 0 72 26,-0.2 28,-0.1 -2,-0.2 26,-0.1 -0.956 57.4 2.9-121.0 143.8 48.5 -0.3 19.1 34 58 A G S S- 0 0 29 26,-0.4 24,-2.8 -2,-0.4 2,-0.3 -0.244 111.3 -14.3 78.4-167.1 48.5 -0.7 22.9 35 59 A V E S+ C 0 57A 81 22,-0.2 22,-0.2 20,-0.1 -2,-0.1 -0.509 71.1 160.1 -81.3 131.4 46.8 1.6 25.4 36 60 A V E - C 0 56A 22 20,-3.1 20,-2.6 -2,-0.3 2,-0.1 -0.934 41.3 -90.2-143.7 157.9 45.7 5.0 24.2 37 61 A P E - C 0 55A 82 0, 0.0 2,-0.3 0, 0.0 18,-0.2 -0.411 38.8-171.5 -74.2 149.8 43.3 7.7 25.2 38 62 A V E - C 0 54A 0 16,-2.4 16,-2.6 -2,-0.1 2,-0.4 -0.995 11.5-158.5-141.7 138.3 39.7 7.8 23.9 39 63 A T E - C 0 53A 27 -2,-0.3 -12,-1.5 14,-0.2 2,-0.4 -0.976 12.2-170.5-115.2 133.4 37.0 10.3 24.1 40 64 A V E -BC 26 52A 18 12,-2.5 12,-2.5 -2,-0.4 2,-0.5 -0.972 11.9-165.8-121.2 135.1 33.3 9.3 23.8 41 65 A V E +BC 25 51A 1 -16,-2.1 -17,-2.3 -2,-0.4 -16,-1.9 -0.998 23.4 174.2-112.5 124.5 30.2 11.5 23.4 42 66 A Y E -BC 23 50A 11 8,-2.3 8,-2.1 -2,-0.5 2,-0.4 -0.913 27.1-132.9-128.6 158.9 27.0 9.5 24.0 43 67 A E E -BC 22 49A 43 -21,-3.0 -22,-2.9 -2,-0.3 -21,-1.7 -0.916 20.8-146.2-109.1 132.5 23.3 10.3 24.2 44 68 A D > - 0 0 20 4,-2.6 3,-1.1 -2,-0.4 -24,-0.2 -0.355 32.9 -97.7 -90.6 175.4 21.2 8.8 27.0 45 69 A H T 3 S+ 0 0 113 1,-0.3 -25,-0.1 2,-0.1 -1,-0.1 0.756 123.9 58.0 -69.4 -21.6 17.5 7.7 26.8 46 70 A S T 3 S- 0 0 109 -27,-0.1 -1,-0.3 2,-0.1 -3,-0.0 0.674 121.5-108.5 -75.5 -19.2 16.4 11.1 28.3 47 71 A G S < S+ 0 0 39 -3,-1.1 2,-0.2 1,-0.3 -2,-0.1 0.398 73.1 136.2 104.5 2.0 18.2 12.9 25.4 48 72 A E - 0 0 125 1,-0.0 -4,-2.6 -5,-0.0 -1,-0.3 -0.563 47.5-131.4 -81.1 146.5 21.1 14.3 27.4 49 73 A L E - C 0 43A 60 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.691 18.9-167.1 -97.1 150.5 24.7 14.2 26.0 50 74 A H E - C 0 42A 30 -8,-2.1 -8,-2.3 -2,-0.3 2,-0.5 -0.998 9.1-156.2-141.2 129.1 27.7 13.1 28.0 51 75 A K E +aC 9 41A 39 -43,-0.6 -41,-2.8 -2,-0.4 2,-0.3 -0.955 19.7 173.5-106.1 127.5 31.4 13.5 27.2 52 76 A I E - C 0 40A 6 -12,-2.5 -12,-2.5 -2,-0.5 2,-0.4 -0.945 13.8-162.3-131.6 146.5 33.8 10.9 28.9 53 77 A R E + C 0 39A 142 -43,-0.4 -14,-0.2 -2,-0.3 2,-0.2 -1.000 29.3 127.6-135.5 135.4 37.5 10.4 28.4 54 78 A F E - C 0 38A 63 -16,-2.6 -16,-2.4 -2,-0.4 2,-0.3 -0.710 51.5 -71.7-161.0-162.2 39.4 7.3 29.4 55 79 A L E + C 0 37A 120 -18,-0.2 2,-0.3 -2,-0.2 -20,-0.1 -0.893 41.2 164.2-120.0 148.9 41.9 4.7 28.1 56 80 A E E - C 0 36A 36 -20,-2.6 -20,-3.1 -2,-0.3 2,-0.4 -0.948 41.9 -92.2-148.8 170.0 41.4 1.8 25.7 57 81 A W E - C 0 35A 198 -2,-0.3 -22,-0.2 -22,-0.2 -28,-0.1 -0.726 49.8-110.8 -85.5 135.5 43.4 -0.6 23.5 58 82 A G - 0 0 14 -24,-2.8 -24,-0.3 -2,-0.4 -28,-0.2 -0.125 24.0-110.9 -61.9 163.5 44.1 0.6 20.0 59 83 A G S S+ 0 0 63 -30,-2.5 2,-0.3 -26,-0.1 -29,-0.2 0.512 88.7 74.6 -77.7 -5.9 42.5 -1.0 17.0 60 84 A S - 0 0 49 -28,-2.7 -26,-0.4 -31,-0.4 2,-0.2 -0.717 64.2-141.2-111.4 155.6 45.6 -2.6 15.6 61 85 A T 0 0 134 -2,-0.3 -2,-0.0 -28,-0.1 -1,-0.0 -0.583 360.0 360.0 -96.6 170.2 48.0 -5.4 16.3 62 86 A S 0 0 156 -2,-0.2 -1,-0.1 -29,-0.0 -28,-0.0 -0.417 360.0 360.0 -83.8 360.0 51.8 -5.2 15.9