==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-JUN-07 2JRT . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR L.WANG,C.CHEN,C.NWOSU,K.CUNNINGHAM,L.OWENS,L.MA,R.XIAO, . 95 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 56 58.9 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 . 4 4.2 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 1.1 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 . 10 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 31.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 3.2 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 0 0 0 2 0 0 1 0 1 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 180 0, 0.0 2,-0.5 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 157.9 5.9 19.5 8.5 2 2 A Y - 0 0 217 2,-0.2 2,-2.9 0, 0.0 0, 0.0 -0.979 360.0 -34.0-125.5 118.9 2.9 20.9 6.7 3 3 A L S S+ 0 0 168 -2,-0.5 2,-1.6 1,-0.1 0, 0.0 -0.319 125.4 78.8 72.6 -58.2 0.5 18.5 4.9 4 4 A K + 0 0 97 -2,-2.9 2,-0.4 2,-0.1 -2,-0.2 -0.615 54.9 132.9 -86.2 82.7 3.3 16.2 3.9 5 5 A R - 0 0 161 -2,-1.6 2,-1.3 -4,-0.1 49,-0.1 -0.840 29.6-176.0-131.0 97.9 4.0 14.2 7.1 6 6 A V + 0 0 36 -2,-0.4 2,-0.1 44,-0.0 -2,-0.1 -0.739 22.4 171.5 -91.4 87.5 4.4 10.5 6.6 7 7 A D + 0 0 99 -2,-1.3 -2,-0.0 43,-0.0 0, 0.0 -0.237 23.5 80.0 -89.0-177.6 4.8 9.3 10.2 8 8 A G S S- 0 0 36 -2,-0.1 41,-0.2 3,-0.0 40,-0.1 -0.554 83.4 -34.3 109.5 179.9 4.8 5.8 11.5 9 9 A P - 0 0 64 0, 0.0 3,-0.2 0, 0.0 38,-0.0 -0.301 45.9-125.1 -73.2 159.5 7.5 3.1 11.7 10 10 A R S S+ 0 0 214 1,-0.3 12,-2.1 11,-0.1 2,-0.3 0.777 102.3 19.0 -71.7 -27.3 10.1 2.5 9.0 11 11 A Q E S-A 21 0A 126 10,-0.3 10,-0.3 11,-0.1 -1,-0.3 -0.980 74.1-163.2-147.4 130.9 8.9 -1.1 8.8 12 12 A V E -A 20 0A 8 8,-3.2 8,-3.3 -2,-0.3 2,-0.3 -0.662 20.2-116.3-109.5 167.2 5.6 -2.5 10.0 13 13 A T E -A 19 0A 98 -2,-0.2 6,-0.2 6,-0.2 5,-0.0 -0.795 19.9-141.0-107.1 145.1 4.5 -6.1 10.6 14 14 A L > - 0 0 14 4,-2.8 3,-1.2 -2,-0.3 29,-0.0 -0.701 21.8-124.5 -98.3 156.8 1.9 -8.1 8.7 15 15 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.674 113.4 67.8 -68.8 -16.0 -0.6 -10.6 10.2 16 16 A D T 3 S- 0 0 103 2,-0.1 3,-0.1 1,-0.0 -3,-0.0 0.734 121.7-109.2 -70.1 -25.0 0.9 -12.9 7.7 17 17 A G S < S+ 0 0 63 -3,-1.2 2,-0.1 1,-0.4 -1,-0.0 0.397 80.0 128.4 102.1 2.0 4.1 -12.8 9.6 18 18 A T - 0 0 79 1,-0.0 -4,-2.8 -5,-0.0 2,-0.4 -0.388 58.1-123.3 -86.0 164.4 5.7 -10.8 6.9 19 19 A V E -A 13 0A 74 -6,-0.2 2,-0.6 -2,-0.1 -6,-0.2 -0.940 17.0-163.6-111.1 132.7 7.7 -7.5 7.2 20 20 A L E +A 12 0A 9 -8,-3.3 -8,-3.2 -2,-0.4 2,-0.1 -0.881 15.0 177.9-119.1 96.9 6.6 -4.4 5.3 21 21 A S E >> -A 11 0A 21 -2,-0.6 3,-1.0 -10,-0.3 4,-0.5 -0.396 47.7-103.9 -88.0 173.1 9.2 -1.8 5.2 22 22 A R T 34 S+ 0 0 96 -12,-2.1 -11,-0.1 1,-0.3 -1,-0.1 0.479 127.2 54.5 -75.4 -1.3 9.1 1.6 3.5 23 23 A A T 34 S+ 0 0 89 -13,-0.2 -1,-0.3 1,-0.1 -12,-0.1 0.530 93.9 68.0-101.4 -14.1 11.3 -0.1 0.9 24 24 A D T <4 S+ 0 0 87 -3,-1.0 -2,-0.2 16,-0.1 -1,-0.1 0.646 73.9 115.1 -79.0 -17.0 8.9 -3.0 0.5 25 25 A L S < S- 0 0 19 -4,-0.5 3,-0.1 1,-0.1 12,-0.1 -0.264 77.4-102.2 -54.2 137.2 6.4 -0.6 -1.2 26 26 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.138 48.6 -79.7 -60.2 157.6 5.9 -1.5 -4.9 27 27 A P - 0 0 77 0, 0.0 3,-0.2 0, 0.0 -3,-0.0 -0.180 28.3-135.6 -58.6 152.3 7.6 0.5 -7.7 28 28 A L S S+ 0 0 88 1,-0.2 -3,-0.0 -3,-0.1 0, 0.0 0.747 103.6 57.5 -80.9 -24.4 6.1 3.9 -8.7 29 29 A D S S+ 0 0 156 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.643 83.8 105.1 -80.8 -15.7 6.5 3.1 -12.4 30 30 A T + 0 0 22 -3,-0.2 3,-0.1 1,-0.2 0, 0.0 -0.413 32.2 163.3 -72.9 137.7 4.4 0.0 -12.1 31 31 A R + 0 0 129 -2,-0.1 2,-2.1 1,-0.1 -1,-0.2 0.512 56.6 89.5-125.0 -23.5 0.9 0.2 -13.5 32 32 A R - 0 0 203 1,-0.1 2,-1.2 2,-0.0 -1,-0.1 -0.572 69.3-165.4 -74.3 80.5 0.1 -3.5 -13.8 33 33 A W - 0 0 38 -2,-2.1 2,-0.1 -3,-0.1 -1,-0.1 -0.630 5.2-170.0 -78.9 97.7 -1.2 -3.6 -10.2 34 34 A V > - 0 0 66 -2,-1.2 4,-2.3 1,-0.1 3,-0.4 -0.396 38.1-100.2 -78.6 165.8 -1.4 -7.3 -9.2 35 35 A A H > S+ 0 0 76 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.893 121.5 50.9 -55.8 -46.0 -3.2 -8.3 -6.0 36 36 A S H > S+ 0 0 96 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.845 110.6 49.0 -64.5 -35.0 -0.1 -8.6 -3.9 37 37 A R H > S+ 0 0 95 -3,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.893 113.0 47.0 -71.9 -39.4 1.2 -5.2 -5.0 38 38 A K H X S+ 0 0 52 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.904 111.7 52.6 -64.0 -41.6 -2.2 -3.6 -4.1 39 39 A A H X S+ 0 0 13 -4,-2.9 4,-2.9 -5,-0.2 5,-0.3 0.915 105.3 54.0 -59.7 -45.8 -2.1 -5.5 -0.8 40 40 A A H X S+ 0 0 20 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.891 111.5 45.6 -57.4 -42.0 1.4 -4.2 0.0 41 41 A V H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.945 115.6 43.7 -68.1 -49.4 0.1 -0.6 -0.5 42 42 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.896 112.4 52.4 -67.9 -38.8 -3.1 -0.9 1.5 43 43 A K H X S+ 0 0 44 -4,-2.9 4,-2.7 -5,-0.2 6,-0.3 0.853 105.4 58.0 -62.9 -34.0 -1.4 -2.9 4.4 44 44 A A H <>S+ 0 0 0 -4,-1.4 5,-3.1 -5,-0.3 6,-1.0 0.933 110.0 41.5 -61.3 -47.4 1.1 -0.1 4.6 45 45 A V H ><5S+ 0 0 28 -4,-1.7 3,-1.0 3,-0.2 -2,-0.2 0.931 115.2 50.9 -65.6 -45.6 -1.6 2.5 5.2 46 46 A I H 3<5S+ 0 0 35 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.887 112.3 45.8 -61.4 -40.4 -3.5 0.3 7.6 47 47 A H T 3<5S- 0 0 70 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.479 117.8-111.5 -84.9 -1.9 -0.4 -0.5 9.7 48 48 A G T < 5S+ 0 0 30 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.738 81.5 127.0 80.7 22.4 0.6 3.1 9.7 49 49 A L S > - 0 0 69 -2,-0.2 4,-1.8 1,-0.1 3,-1.1 -0.779 26.4-117.0-109.3 155.5 -0.7 7.5 4.9 52 52 A E H 3> S+ 0 0 47 -2,-0.3 4,-2.2 1,-0.3 5,-0.2 0.893 116.5 51.1 -54.4 -43.9 -3.6 7.0 2.5 53 53 A R H 3> S+ 0 0 169 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.708 106.9 55.4 -70.0 -20.1 -3.0 10.3 0.8 54 54 A E H <> S+ 0 0 26 -3,-1.1 4,-2.6 2,-0.2 5,-0.3 0.859 107.4 48.5 -78.3 -37.3 0.7 9.4 0.4 55 55 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.944 113.2 46.2 -66.2 -47.8 -0.3 6.2 -1.4 56 56 A L H <>S+ 0 0 16 -4,-2.2 5,-2.5 1,-0.2 4,-0.5 0.850 114.7 51.6 -61.1 -34.7 -2.7 8.0 -3.7 57 57 A D H <5S+ 0 0 92 -4,-1.1 3,-0.4 -5,-0.2 -2,-0.2 0.960 115.3 35.6 -67.8 -54.5 -0.0 10.6 -4.3 58 58 A R H <5S+ 0 0 76 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.824 123.6 41.0 -77.1 -32.5 2.9 8.5 -5.3 59 59 A Y T <5S- 0 0 0 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.419 108.5-119.4 -97.3 1.9 1.1 5.8 -7.2 60 60 A S T 5 + 0 0 87 -4,-0.5 2,-0.3 -3,-0.4 -3,-0.2 0.991 60.5 149.9 57.7 66.2 -1.2 8.3 -8.9 61 61 A L < - 0 0 27 -5,-2.5 2,-0.3 -6,-0.1 -1,-0.2 -0.806 44.0-125.8-125.8 164.1 -4.5 6.9 -7.6 62 62 A S > - 0 0 67 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.721 28.6-116.0-103.7 162.2 -7.9 8.0 -6.6 63 63 A E H > S+ 0 0 88 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.868 118.0 56.4 -67.3 -34.8 -9.6 7.4 -3.2 64 64 A E H > S+ 0 0 156 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.814 105.9 53.2 -63.8 -29.5 -12.3 5.3 -4.8 65 65 A E H >> S+ 0 0 64 -3,-0.3 4,-2.1 2,-0.2 3,-0.7 0.960 108.5 46.9 -67.2 -51.7 -9.4 3.2 -6.2 66 66 A F H 3X S+ 0 0 4 -4,-2.0 4,-2.7 1,-0.3 5,-0.3 0.834 105.9 61.1 -60.6 -33.1 -7.9 2.7 -2.8 67 67 A A H 3X S+ 0 0 20 -4,-2.2 4,-1.3 1,-0.2 -1,-0.3 0.877 105.9 46.8 -59.9 -38.4 -11.4 1.9 -1.5 68 68 A L H S+ 0 0 22 -4,-2.7 5,-2.3 1,-0.2 4,-0.3 0.811 116.4 49.7 -66.0 -27.8 -8.8 -2.3 0.9 71 71 A S H <5S+ 0 0 23 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.798 112.6 46.2 -79.8 -28.6 -12.0 -4.0 -0.0 72 72 A A H <5S+ 0 0 54 -4,-2.3 -2,-0.2 -3,-0.2 -1,-0.2 0.637 130.7 18.4 -88.2 -15.8 -10.3 -6.6 -2.3 73 73 A V T ><5S+ 0 0 44 -4,-1.4 3,-0.6 -5,-0.2 4,-0.2 0.731 129.7 30.2-115.9 -68.0 -7.5 -7.3 0.2 74 74 A A T 3 5S+ 0 0 10 -5,-0.4 3,-0.2 -4,-0.3 -3,-0.2 0.855 134.1 24.6 -72.2 -37.6 -8.2 -6.3 3.9 75 75 A A T 3 + 0 0 34 -4,-0.2 3,-0.8 -3,-0.2 5,-0.3 -0.231 50.2 132.2 -89.3 47.1 -12.8 -12.0 3.7 78 78 A E T 3 + 0 0 108 -2,-0.7 3,-0.2 -3,-0.3 -1,-0.2 0.199 38.6 100.7 -86.3 17.5 -16.4 -11.0 4.4 79 79 A K T 3 S+ 0 0 195 1,-0.3 2,-0.3 -3,-0.1 -1,-0.2 0.923 101.5 1.7 -62.9 -45.3 -17.4 -14.7 4.1 80 80 A A S < S- 0 0 70 -3,-0.8 2,-1.8 2,-0.0 -1,-0.3 -0.976 75.9-123.4-146.8 130.4 -17.4 -14.9 7.9 81 81 A L - 0 0 110 -2,-0.3 -3,-0.1 -3,-0.2 5,-0.1 -0.575 34.1-159.3 -77.0 85.9 -16.8 -12.1 10.4 82 82 A K >> - 0 0 136 -2,-1.8 3,-1.6 -5,-0.3 4,-0.9 -0.266 32.9-105.5 -55.9 153.1 -14.0 -13.6 12.4 83 83 A V T 34 S+ 0 0 123 1,-0.3 4,-0.4 2,-0.2 3,-0.4 0.831 127.4 46.3 -53.8 -31.4 -13.5 -12.2 15.9 84 84 A T T 3> S+ 0 0 74 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.628 97.8 73.5 -84.8 -13.8 -10.4 -10.4 14.5 85 85 A M H <> S+ 0 0 21 -3,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.770 86.1 62.9 -74.1 -25.2 -12.4 -9.3 11.4 86 86 A I H X S+ 0 0 58 -4,-0.9 4,-1.0 -3,-0.4 -1,-0.2 0.890 98.0 56.4 -66.3 -36.6 -14.3 -6.7 13.4 87 87 A Q H > S+ 0 0 115 -4,-0.4 4,-1.8 -3,-0.2 3,-0.3 0.877 102.8 56.8 -61.0 -37.5 -11.0 -5.0 14.0 88 88 A K H X S+ 0 0 77 -4,-1.0 4,-3.2 1,-0.2 3,-0.4 0.961 109.5 43.3 -53.7 -53.5 -10.6 -4.8 10.3 89 89 A Y H < S+ 0 0 61 -4,-1.7 -1,-0.2 1,-0.2 5,-0.2 0.591 109.5 59.8 -74.2 -11.5 -13.8 -2.9 9.9 90 90 A R H < S+ 0 0 185 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.837 118.2 27.3 -81.9 -36.5 -12.9 -0.7 12.9 91 91 A Q H < S+ 0 0 104 -4,-1.8 2,-0.5 -3,-0.4 -2,-0.2 0.800 110.3 76.2 -94.9 -35.4 -9.8 0.6 11.3 92 92 A L S < S- 0 0 14 -4,-3.2 2,-0.6 -5,-0.3 3,-0.2 -0.679 77.5-147.5 -77.6 122.4 -10.9 0.2 7.7 93 93 A H - 0 0 140 -2,-0.5 -3,-0.1 1,-0.2 -4,-0.0 -0.851 62.9 -0.5-103.0 119.6 -13.4 3.0 6.9 94 94 A H 0 0 156 -2,-0.6 -1,-0.2 -5,-0.2 -23,-0.1 0.977 360.0 360.0 73.7 88.2 -16.2 2.4 4.5 95 95 A H 0 0 102 -3,-0.2 -24,-0.1 -6,-0.1 -2,-0.1 0.752 360.0 360.0-102.8 360.0 -16.2 -1.1 2.9