==== 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 07-MAY-07 2PST . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PA2412; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1; . AUTHOR A.M.GULICK,E.J.DRAKE,M.B.SHAH . 61 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4549.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 34 55.7 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 . 13 21.3 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 . 2 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 23.0 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 1 0 0 0 1 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 8 X D 0 0 101 0, 0.0 3,-0.1 0, 0.0 35,-0.1 0.000 360.0 360.0 360.0 131.8 9.1 38.1 37.3 2 9 X D + 0 0 140 1,-0.2 2,-0.5 0, 0.0 34,-0.0 -0.001 360.0 87.8-172.3 -15.7 10.4 41.7 37.6 3 10 X I S S- 0 0 58 17,-0.0 2,-0.5 16,-0.0 34,-0.4 -0.793 73.1-134.6-104.1 128.4 10.4 42.2 33.9 4 11 X Q - 0 0 88 -2,-0.5 16,-2.6 32,-0.1 17,-0.4 -0.707 27.8-167.3 -76.5 126.0 7.3 43.5 31.9 5 12 X F E -AB 19 35A 35 30,-3.8 30,-2.5 -2,-0.5 2,-0.4 -0.734 12.9-143.2-106.6 161.5 6.8 41.5 28.8 6 13 X Q E -AB 18 34A 33 12,-2.8 12,-2.2 -2,-0.3 2,-0.4 -0.982 19.4-125.9-118.2 138.6 4.6 42.1 25.8 7 14 X V E -A 17 0A 0 26,-3.0 24,-2.7 -2,-0.4 26,-0.4 -0.719 34.7-165.3 -76.2 131.3 2.8 39.3 23.9 8 15 X V E -AB 16 30A 3 8,-2.7 8,-2.4 -2,-0.4 2,-0.3 -0.881 9.3-161.3-123.0 153.9 3.8 39.6 20.3 9 16 X V E -AB 15 29A 3 20,-2.4 20,-1.9 -2,-0.3 6,-0.2 -0.980 5.1-150.3-136.6 141.3 2.2 38.0 17.1 10 17 X N E > - B 0 28A 28 4,-1.8 3,-1.6 -2,-0.3 18,-0.2 -0.342 42.6 -86.2-100.1-172.8 3.6 37.5 13.6 11 18 X H T 3 S+ 0 0 153 16,-0.6 17,-0.1 1,-0.3 16,-0.0 0.662 126.6 58.4 -74.7 -13.1 1.9 37.3 10.2 12 19 X E T 3 S- 0 0 62 2,-0.1 42,-2.4 42,-0.1 -1,-0.3 0.307 117.5-112.3 -92.3 9.8 1.2 33.6 10.7 13 20 X E < + 0 0 77 -3,-1.6 2,-0.3 1,-0.3 -2,-0.1 0.910 69.7 145.2 55.3 44.4 -0.7 34.3 13.9 14 21 X Q - 0 0 63 39,-0.0 -4,-1.8 34,-0.0 2,-0.3 -0.883 37.6-140.2-105.4 146.4 2.0 32.6 16.0 15 22 X Y E +A 9 0A 41 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.797 26.1 161.0-117.3 148.1 2.7 34.1 19.5 16 23 X S E -A 8 0A 55 -8,-2.4 -8,-2.7 -2,-0.3 2,-0.4 -0.887 35.3-110.2-144.7 177.2 5.7 34.8 21.6 17 24 X I E -A 7 0A 34 -2,-0.3 -10,-0.2 -10,-0.2 20,-0.0 -0.911 30.1-173.8-111.4 148.2 6.7 37.0 24.5 18 25 X W E -A 6 0A 64 -12,-2.2 -12,-2.8 -2,-0.4 6,-0.1 -0.997 32.6-104.9-144.0 132.5 9.1 39.9 24.2 19 26 X P E > -A 5 0A 18 0, 0.0 3,-1.8 0, 0.0 -14,-0.3 -0.372 25.0-135.2 -62.0 131.6 10.6 42.1 26.8 20 27 X E T 3 S+ 0 0 80 -16,-2.6 -15,-0.1 1,-0.3 4,-0.1 0.798 103.1 64.9 -53.4 -31.4 8.9 45.5 26.8 21 28 X Y T 3 S+ 0 0 171 -17,-0.4 2,-0.3 2,-0.1 -1,-0.3 0.660 93.5 75.7 -70.8 -14.7 12.3 47.2 27.1 22 29 X K S < S- 0 0 97 -3,-1.8 2,-0.1 1,-0.1 -4,-0.0 -0.769 90.3-106.7-100.1 142.9 13.3 45.8 23.6 23 30 X E - 0 0 172 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.393 43.0-106.2 -56.4 134.6 12.1 47.1 20.2 24 31 X I - 0 0 55 -4,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.530 41.4-116.0 -67.0 127.3 9.6 44.7 18.6 25 32 X P > - 0 0 47 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.287 36.5 -87.0 -67.4 151.0 11.5 42.9 15.8 26 33 X Q T 3 S+ 0 0 191 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.289 117.2 35.7 -51.1 136.7 10.4 43.4 12.1 27 34 X G T 3 S+ 0 0 25 1,-0.3 -16,-0.6 -3,-0.1 2,-0.3 0.335 107.1 85.2 98.3 -6.3 7.6 40.9 11.2 28 35 X W E < -B 10 0A 86 -3,-1.6 -1,-0.3 -18,-0.2 2,-0.3 -0.889 50.7-178.4-126.5 154.7 6.0 41.1 14.7 29 36 X R E -B 9 0A 155 -20,-1.9 -20,-2.4 -2,-0.3 2,-0.2 -0.964 41.7 -78.4-145.6 163.2 3.6 43.4 16.4 30 37 X A E -B 8 0A 43 -2,-0.3 -22,-0.2 -22,-0.2 4,-0.1 -0.422 32.2-158.0 -62.1 130.5 2.0 43.9 19.9 31 38 X A E - 0 0 21 -24,-2.7 -23,-0.1 2,-0.2 -1,-0.1 0.376 52.4 -90.2 -94.4 1.9 -0.9 41.4 20.3 32 39 X G E S+ 0 0 63 -25,-0.4 2,-0.3 1,-0.2 -24,-0.1 0.777 93.5 94.9 97.0 31.5 -2.6 43.4 23.1 33 40 X K E + 0 0 77 -26,-0.4 -26,-3.0 2,-0.0 2,-0.3 -0.900 37.6 173.5-153.9 124.3 -1.2 42.1 26.3 34 41 X S E +B 6 0A 52 -2,-0.3 2,-0.3 -28,-0.2 -28,-0.2 -0.922 32.2 91.9-119.9 153.9 1.7 43.4 28.6 35 42 X G E S-B 5 0A 9 -30,-2.5 -30,-3.8 -2,-0.3 -15,-0.1 -0.966 71.6 -27.5 158.2-173.2 2.6 42.1 32.0 36 43 X L > - 0 0 54 -2,-0.3 4,-2.3 -32,-0.2 3,-0.4 -0.278 69.1-100.0 -65.0 158.5 4.7 39.7 34.0 37 44 X K H > S+ 0 0 110 -34,-0.4 4,-2.8 1,-0.2 5,-0.2 0.886 120.8 51.7 -49.4 -50.3 5.8 36.5 32.2 38 45 X K H > S+ 0 0 156 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.884 111.0 47.8 -59.7 -39.1 3.2 34.3 33.9 39 46 X D H > S+ 0 0 65 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.897 112.6 48.7 -70.9 -38.5 0.3 36.7 32.8 40 47 X C H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.917 112.8 48.3 -63.7 -41.8 1.6 36.9 29.3 41 48 X L H X S+ 0 0 84 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.894 109.9 52.0 -66.8 -39.1 1.9 33.1 29.1 42 49 X A H X S+ 0 0 53 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.920 109.9 50.4 -59.9 -45.8 -1.6 32.7 30.5 43 50 X Y H X S+ 0 0 55 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.928 109.2 49.2 -57.6 -50.8 -2.9 35.1 27.8 44 51 X I H X S+ 0 0 22 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.934 110.9 51.1 -56.7 -46.4 -1.1 33.2 25.0 45 52 X E H < S+ 0 0 155 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.879 111.7 48.5 -57.8 -38.4 -2.6 29.9 26.3 46 53 X E H < S+ 0 0 144 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.915 122.4 31.0 -66.4 -43.7 -6.1 31.6 26.3 47 54 X V H < S+ 0 0 51 -4,-2.6 2,-1.2 1,-0.2 3,-0.3 0.730 105.6 69.4 -94.9 -26.9 -5.9 33.0 22.8 48 55 X W < + 0 0 56 -4,-2.9 -1,-0.2 -5,-0.3 3,-0.1 -0.660 52.8 134.5 -98.1 80.7 -3.7 30.5 20.8 49 56 X T + 0 0 117 -2,-1.2 2,-0.7 1,-0.2 -1,-0.2 0.701 65.8 53.8-101.5 -24.6 -6.0 27.5 20.7 50 57 X D - 0 0 53 -3,-0.3 -1,-0.2 1,-0.1 7,-0.1 -0.920 68.2-175.5-110.2 101.4 -5.5 26.6 17.0 51 58 X M + 0 0 125 -2,-0.7 -1,-0.1 -3,-0.1 3,-0.1 0.413 43.7 113.8 -89.7 8.6 -1.8 26.3 16.6 52 59 X R S S- 0 0 60 1,-0.1 -2,-0.1 2,-0.1 5,-0.0 -0.518 81.1-101.7 -66.0 139.5 -1.7 25.7 12.9 53 60 X P >> - 0 0 37 0, 0.0 4,-2.2 0, 0.0 3,-0.8 -0.360 34.2-109.8 -58.4 150.2 -0.0 28.7 11.2 54 61 X L H 3> S+ 0 0 50 -42,-2.4 4,-2.5 1,-0.3 5,-0.2 0.853 119.1 53.6 -49.3 -44.6 -2.6 31.0 9.6 55 62 X S H 3> S+ 0 0 42 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.843 108.1 50.9 -65.0 -31.5 -1.5 30.0 6.1 56 63 X L H <> S+ 0 0 73 -3,-0.8 4,-2.3 2,-0.2 5,-0.3 0.932 109.2 49.9 -68.1 -46.9 -2.0 26.3 7.0 57 64 X R H X S+ 0 0 31 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.933 110.3 51.8 -53.4 -46.8 -5.6 27.0 8.3 58 65 X Q H < S+ 0 0 130 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.863 112.7 44.9 -60.2 -37.7 -6.3 28.9 5.1 59 66 X H H < S+ 0 0 164 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.827 120.5 38.1 -74.9 -31.3 -5.2 25.9 3.1 60 67 X M H < 0 0 120 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.810 360.0 360.0 -90.4 -32.3 -7.0 23.2 5.1 61 68 X D < 0 0 142 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.1 -0.059 360.0 360.0-100.9 360.0 -10.2 25.0 5.9