==== 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 05-JUN-07 2JQN . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CAULOBACTER VIBRIOIDES; . AUTHOR J.M.ARAMINI,P.ROSSI,H.N.B.MOSELEY,D.WANG,C.NWOSU, . 116 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7048.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 92 79.3 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 . 30 25.9 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 . 2 1.7 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 . 24 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.7 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 1 0 0 0 2 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 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 1 A M 0 0 105 0, 0.0 2,-2.5 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -8.1 11.5 -0.6 9.6 2 2 A T + 0 0 82 1,-0.1 61,-1.4 60,-0.1 2,-1.2 -0.174 360.0 98.4 72.5 -48.5 8.6 -3.0 10.2 3 3 A L E -A 62 0A 49 -2,-2.5 36,-0.4 59,-0.3 2,-0.3 -0.610 61.9-170.1 -69.6 96.1 6.2 -0.3 9.0 4 4 A I E -A 61 0A 1 57,-2.5 57,-2.6 -2,-1.2 2,-0.3 -0.707 6.8-144.6 -92.2 147.3 5.7 -1.4 5.4 5 5 A Y E -AB 60 37A 33 32,-3.1 32,-2.3 -2,-0.3 2,-0.4 -0.832 14.7-163.2-119.8 147.4 3.8 0.9 2.9 6 6 A K E -A 59 0A 7 53,-1.3 53,-2.5 -2,-0.3 2,-0.5 -0.988 14.9-150.9-126.8 123.6 1.4 0.6 -0.0 7 7 A I E +A 58 0A 15 -2,-0.4 2,-0.3 51,-0.2 51,-0.2 -0.795 29.4 147.1 -96.6 130.1 0.9 3.6 -2.4 8 8 A L E -A 57 0A 9 49,-1.4 49,-2.6 -2,-0.5 2,-0.2 -0.917 49.7 -77.7-147.7 174.6 -2.4 4.0 -4.2 9 9 A S E >> -A 56 0A 33 -2,-0.3 4,-2.0 47,-0.2 3,-0.8 -0.545 34.9-126.7 -79.8 144.0 -4.7 6.8 -5.6 10 10 A R H 3> S+ 0 0 60 45,-2.6 4,-2.8 1,-0.3 5,-0.3 0.897 109.9 59.5 -55.9 -44.1 -7.0 8.7 -3.1 11 11 A A H 3> S+ 0 0 75 1,-0.2 4,-1.1 44,-0.2 -1,-0.3 0.851 108.7 45.5 -52.5 -37.7 -10.1 7.9 -5.1 12 12 A E H <> S+ 0 0 85 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.895 112.3 51.0 -72.6 -41.6 -9.3 4.2 -4.7 13 13 A W H X S+ 0 0 4 -4,-2.0 4,-3.0 2,-0.2 5,-0.2 0.931 107.7 50.3 -64.5 -49.4 -8.6 4.5 -0.9 14 14 A D H X S+ 0 0 74 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.884 111.5 50.5 -58.0 -39.5 -11.8 6.4 -0.0 15 15 A A H X S+ 0 0 46 -4,-1.1 4,-1.8 -5,-0.3 3,-0.2 0.949 112.6 45.0 -61.9 -50.6 -13.8 3.7 -1.9 16 16 A A H X>S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 5,-1.0 0.901 111.4 53.9 -59.2 -41.7 -12.1 0.9 0.0 17 17 A K H <5S+ 0 0 84 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.803 106.1 53.7 -63.5 -31.1 -12.5 2.9 3.3 18 18 A A H <5S+ 0 0 86 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.891 115.9 38.1 -69.1 -40.7 -16.3 3.1 2.5 19 19 A Q H <5S- 0 0 104 -4,-1.8 -2,-0.2 2,-0.3 -1,-0.2 0.788 104.2-129.4 -76.4 -30.5 -16.5 -0.7 2.1 20 20 A G T <5S+ 0 0 27 -4,-2.6 70,-1.5 1,-0.2 71,-0.8 0.403 81.2 81.2 87.9 1.1 -14.0 -1.4 5.0 21 21 A R E < -D 89 0B 122 -5,-1.0 2,-0.4 68,-0.3 -2,-0.3 -0.982 58.7-160.1-141.1 146.6 -12.1 -3.6 2.6 22 22 A F E -D 88 0B 14 66,-1.6 66,-2.5 -2,-0.3 3,-0.1 -0.882 19.2-161.2-128.0 99.8 -9.5 -3.4 -0.2 23 23 A E - 0 0 78 -2,-0.4 2,-0.5 64,-0.2 -7,-0.0 -0.275 42.0 -73.7 -71.8 163.9 -9.4 -6.4 -2.5 24 24 A G - 0 0 22 4,-0.1 -1,-0.1 1,-0.1 9,-0.0 -0.461 52.8-140.0 -64.7 111.5 -6.4 -7.1 -4.8 25 25 A S > - 0 0 36 -2,-0.5 4,-2.9 1,-0.1 5,-0.3 -0.273 26.2-103.3 -67.2 158.4 -6.4 -4.7 -7.7 26 26 A A H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.837 123.5 55.1 -51.1 -37.1 -5.5 -5.8 -11.2 27 27 A V H > S+ 0 0 97 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.939 110.9 42.9 -62.9 -49.0 -2.1 -4.1 -10.8 28 28 A D H > S+ 0 0 5 -3,-0.3 4,-3.3 1,-0.2 3,-0.3 0.931 116.5 47.5 -62.7 -46.2 -1.3 -6.1 -7.6 29 29 A L H < S+ 0 0 102 -4,-2.9 -2,-0.2 3,-0.3 -1,-0.2 0.835 107.1 58.4 -64.6 -33.2 -2.7 -9.3 -9.1 30 30 A A H < S+ 0 0 88 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.853 116.1 34.3 -64.3 -37.1 -0.6 -8.6 -12.3 31 31 A D H < S- 0 0 52 -4,-1.5 45,-0.2 -3,-0.3 -2,-0.2 0.917 137.5 -69.6 -81.4 -51.6 2.6 -8.6 -10.2 32 32 A G S < S- 0 0 24 -4,-3.3 -3,-0.3 1,-0.4 -2,-0.1 0.234 81.5 -52.3 153.5 71.4 1.7 -11.2 -7.6 33 33 A F S S- 0 0 93 -5,-0.2 2,-0.7 -8,-0.1 -1,-0.4 -0.056 106.8 -14.6 68.6-176.7 -1.1 -10.4 -5.0 34 34 A I E S-E 84 0C 4 50,-1.3 50,-3.0 52,-0.1 2,-0.9 -0.367 72.4-152.7 -61.7 103.1 -1.1 -7.2 -2.8 35 35 A H E -E 83 0C 51 -2,-0.7 48,-0.2 48,-0.2 2,-0.2 -0.698 16.0-177.8 -86.5 106.5 2.5 -5.9 -3.2 36 36 A L - 0 0 6 46,-2.4 2,-0.3 -2,-0.9 -30,-0.2 -0.552 11.3-148.0 -91.5 166.3 3.6 -3.9 -0.1 37 37 A S B -B 5 0A 17 -32,-2.3 -32,-3.1 -2,-0.2 44,-0.1 -0.998 12.7-116.8-142.7 140.6 7.0 -2.2 0.1 38 38 A A > - 0 0 8 -2,-0.3 4,-3.1 -34,-0.2 5,-0.3 -0.326 44.0 -97.7 -68.0 157.6 9.6 -1.4 2.8 39 39 A G H > S+ 0 0 6 -36,-0.4 4,-2.0 1,-0.2 5,-0.2 0.851 125.5 43.7 -44.6 -48.3 10.4 2.3 3.5 40 40 A E H > S+ 0 0 163 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.907 116.0 47.6 -66.0 -42.7 13.5 2.3 1.3 41 41 A Q H > S+ 0 0 38 -3,-0.2 4,-2.5 2,-0.2 5,-0.2 0.881 110.7 52.4 -65.9 -40.7 11.8 0.3 -1.5 42 42 A A H X S+ 0 0 1 -4,-3.1 4,-2.4 2,-0.2 -2,-0.2 0.935 108.2 49.6 -61.8 -49.4 8.8 2.6 -1.5 43 43 A Q H X S+ 0 0 48 -4,-2.0 4,-2.0 -5,-0.3 -2,-0.2 0.937 114.2 45.5 -56.6 -50.3 10.8 5.8 -1.8 44 44 A E H X S+ 0 0 101 -4,-1.8 4,-1.8 2,-0.2 3,-0.2 0.962 115.0 45.1 -58.1 -56.8 12.8 4.4 -4.8 45 45 A T H X>S+ 0 0 33 -4,-2.5 4,-3.0 1,-0.2 5,-1.2 0.826 110.3 58.0 -59.8 -31.2 9.8 3.0 -6.6 46 46 A A H <5S+ 0 0 0 -4,-2.4 5,-0.4 -5,-0.2 -1,-0.2 0.925 106.7 46.7 -62.7 -45.2 8.0 6.3 -5.9 47 47 A A H <5S+ 0 0 35 -4,-2.0 -2,-0.2 -3,-0.2 -1,-0.2 0.836 120.1 40.7 -66.0 -33.7 10.8 8.3 -7.7 48 48 A K H <5S+ 0 0 109 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.946 135.8 5.0 -79.7 -54.0 10.7 5.8 -10.7 49 49 A W T <5S+ 0 0 168 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.822 125.3 53.2-106.8 -40.7 7.0 5.1 -11.2 50 50 A F S > > + 0 0 66 -2,-0.8 4,-2.7 -3,-0.2 3,-1.9 -0.366 26.1 159.2 -90.8 59.4 2.3 -13.7 9.9 67 67 A G T 34 + 0 0 41 -2,-1.3 -1,-0.2 1,-0.3 -3,-0.0 0.590 62.9 76.9 -58.8 -11.5 4.9 -14.7 7.2 68 68 A E T 34 S+ 0 0 145 -3,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.894 115.9 14.1 -62.8 -42.3 2.3 -17.2 6.0 69 69 A D T <4 S+ 0 0 26 -3,-1.9 16,-2.5 1,-0.2 2,-0.7 0.705 127.8 58.1-105.6 -30.9 0.2 -14.5 4.3 70 70 A L E < S+F 84 0C 10 -4,-2.7 2,-0.5 14,-0.2 14,-0.2 -0.867 70.8 175.3-104.7 101.8 2.8 -11.6 4.3 71 71 A K E -F 83 0C 84 12,-2.4 12,-3.2 -2,-0.7 2,-2.2 -0.920 36.2-137.3-114.0 124.0 5.9 -12.8 2.5 72 72 A W E +F 82 0C 117 -2,-0.5 2,-0.4 10,-0.3 9,-0.1 -0.533 46.5 180.0 -70.0 80.1 9.0 -10.7 1.7 73 73 A E E -F 81 0C 94 -2,-2.2 8,-2.5 8,-2.1 2,-1.2 -0.730 35.0-118.9-100.5 137.4 9.0 -12.2 -1.8 74 74 A A E > -F 80 0C 37 -2,-0.4 3,-1.1 6,-0.3 6,-0.3 -0.555 34.2-157.7 -74.8 95.1 11.5 -11.4 -4.6 75 75 A S G > S+ 0 0 14 4,-1.6 3,-1.4 -2,-1.2 4,-0.4 -0.461 74.4 8.0 -72.7 146.4 9.3 -9.9 -7.4 76 76 A R G 3 S- 0 0 202 1,-0.3 -1,-0.2 -45,-0.2 -2,-0.0 0.691 129.7 -71.2 57.2 20.2 10.7 -10.1 -11.0 77 77 A G G < S+ 0 0 77 -3,-1.1 -1,-0.3 2,-0.1 -2,-0.2 0.899 122.4 70.8 63.0 42.3 13.5 -12.2 -9.6 78 78 A G S < S+ 0 0 47 -3,-1.4 2,-0.2 1,-0.4 -2,-0.1 0.120 80.3 32.0-143.0 -99.7 15.1 -9.2 -7.8 79 79 A A S S- 0 0 43 -4,-0.4 -4,-1.6 -5,-0.1 2,-1.1 -0.474 71.8-117.8 -80.1 145.1 14.0 -7.2 -4.7 80 80 A R E - F 0 74C 164 -6,-0.3 -6,-0.3 -2,-0.2 -7,-0.1 -0.681 35.7-177.4 -86.3 96.0 12.1 -8.8 -1.8 81 81 A F E - F 0 73C 37 -8,-2.5 -8,-2.1 -2,-1.1 2,-0.9 -0.818 33.3-115.5 -93.7 129.1 8.7 -7.0 -1.6 82 82 A P E - F 0 72C 0 0, 0.0 -46,-2.4 0, 0.0 2,-0.5 -0.491 37.2-165.3 -64.8 100.3 6.3 -8.0 1.2 83 83 A H E -EF 35 71C 5 -12,-3.2 -12,-2.4 -2,-0.9 2,-0.7 -0.798 11.8-146.9 -93.4 126.9 3.3 -9.5 -0.7 84 84 A L E -EF 34 70C 21 -50,-3.0 -50,-1.3 -2,-0.5 -14,-0.2 -0.841 3.0-158.1 -92.5 116.0 0.0 -10.0 1.1 85 85 A Y S S+ 0 0 77 -16,-2.5 -15,-0.1 -2,-0.7 -1,-0.1 0.160 72.0 54.5 -84.2 22.3 -1.7 -13.1 -0.3 86 86 A R S S- 0 0 133 -17,-0.2 -52,-0.1 -52,-0.1 -2,-0.1 -0.985 100.2 -72.3-149.8 156.9 -5.2 -12.0 1.0 87 87 A P - 0 0 79 0, 0.0 2,-1.0 0, 0.0 -64,-0.2 -0.127 47.5-119.1 -50.2 140.9 -7.5 -8.9 0.7 88 88 A L E -D 22 0B 4 -66,-2.5 -66,-1.6 -4,-0.1 2,-0.3 -0.716 25.7-151.9 -89.5 98.1 -6.3 -5.8 2.6 89 89 A L E >> -D 21 0B 88 -2,-1.0 3,-1.7 -68,-0.2 4,-0.9 -0.525 12.0-138.1 -68.6 132.6 -9.1 -4.9 5.2 90 90 A V G >4 S+ 0 0 20 -70,-1.5 3,-0.8 1,-0.3 -69,-0.2 0.888 105.1 57.3 -59.7 -39.2 -9.1 -1.2 6.0 91 91 A S G 34 S+ 0 0 118 -71,-0.8 -1,-0.3 1,-0.2 -70,-0.1 0.585 102.1 58.5 -68.3 -9.0 -9.7 -2.0 9.7 92 92 A E G <4 S+ 0 0 133 -3,-1.7 -1,-0.2 -31,-0.0 -2,-0.2 0.751 85.7 95.9 -88.7 -28.2 -6.4 -4.0 9.5 93 93 A V << - 0 0 21 -4,-0.9 -32,-0.2 -3,-0.8 3,-0.1 -0.311 65.8-147.1 -66.4 143.4 -4.3 -1.0 8.4 94 94 A T - 0 0 56 -34,-1.4 2,-0.3 1,-0.3 -33,-0.2 0.986 67.6 -24.6 -74.1 -65.1 -2.3 0.9 11.0 95 95 A R E -C 60 0A 186 -35,-1.6 -35,-2.9 2,-0.0 -1,-0.3 -0.978 53.7-135.1-148.1 159.6 -2.4 4.5 9.6 96 96 A E E -C 59 0A 60 -2,-0.3 2,-0.2 -37,-0.2 -37,-0.2 -0.751 12.1-168.0-110.4 162.1 -2.7 6.4 6.3 97 97 A A E -C 58 0A 27 -39,-0.6 -39,-2.7 -2,-0.3 2,-0.3 -0.784 21.4-133.7-153.9 107.8 -0.8 9.4 5.0 98 98 A D E -C 57 0A 108 -2,-0.2 2,-0.4 -41,-0.2 -41,-0.2 -0.454 31.2-155.1 -60.2 120.1 -1.7 11.5 1.9 99 99 A L E +C 56 0A 12 -43,-2.1 -43,-1.1 -2,-0.3 2,-0.2 -0.861 15.3 179.3-111.3 132.9 1.5 11.8 -0.1 100 100 A D - 0 0 99 -2,-0.4 8,-1.6 8,-0.2 2,-0.1 -0.632 26.9 -91.1-124.3-179.3 2.4 14.7 -2.5 101 101 A L B -G 107 0D 43 6,-0.2 2,-0.1 -2,-0.2 -1,-0.1 -0.404 26.9-141.4 -94.7 165.8 5.3 15.8 -4.8 102 102 A D > - 0 0 49 4,-1.2 3,-1.5 -2,-0.1 -1,-0.1 -0.303 49.6 -67.8-106.3-163.0 8.4 18.0 -4.3 103 103 A A T 3 S+ 0 0 106 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.798 135.6 48.4 -59.5 -30.6 10.2 20.5 -6.5 104 104 A D T 3 S- 0 0 137 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.476 119.0-110.5 -89.7 -3.3 11.4 17.7 -8.9 105 105 A G S < S+ 0 0 22 -3,-1.5 -53,-2.6 1,-0.3 -52,-0.2 0.691 74.3 137.1 80.8 19.2 7.8 16.3 -9.1 106 106 A V S S- 0 0 31 -55,-0.2 -4,-1.2 -54,-0.1 2,-0.7 -0.793 70.6 -99.7 -99.8 137.8 8.9 13.2 -7.1 107 107 A P B -G 101 0D 0 0, 0.0 2,-1.8 0, 0.0 -6,-0.2 -0.409 46.4-135.9 -51.7 101.3 6.8 11.6 -4.2 108 108 A Q > + 0 0 49 -8,-1.6 4,-0.7 -2,-0.7 -8,-0.2 -0.446 53.1 144.7 -79.3 82.8 8.8 13.2 -1.4 109 109 A L H > + 0 0 0 -2,-1.8 4,-2.2 2,-0.2 6,-0.4 0.599 62.1 80.9 -84.0 -14.0 9.4 10.5 1.2 110 110 A G H 4 S+ 0 0 9 -3,-0.2 6,-0.4 1,-0.2 5,-0.3 0.886 103.8 31.4 -57.1 -41.5 12.8 12.1 1.8 111 111 A D H 4 S+ 0 0 129 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.763 118.4 56.4 -83.2 -29.1 11.1 14.7 4.0 112 112 A H H < S+ 0 0 91 -4,-0.7 -2,-0.2 2,-0.0 2,-0.2 0.709 112.7 43.8 -76.1 -21.1 8.4 12.3 5.2 113 113 A L S >< S- 0 0 35 -4,-2.2 3,-0.7 -74,-0.0 -5,-0.0 -0.463 105.4 -84.2-113.6-171.8 11.0 9.7 6.4 114 114 A A T 3 S+ 0 0 101 1,-0.2 -4,-0.1 -2,-0.2 -3,-0.1 0.240 89.7 111.6 -83.4 16.9 14.3 9.9 8.4 115 115 A L T 3 0 0 108 -6,-0.4 -1,-0.2 -5,-0.3 -4,-0.1 0.722 360.0 360.0 -64.6 -20.1 16.4 10.7 5.3 116 116 A E < 0 0 211 -3,-0.7 -1,-0.3 -6,-0.4 -2,-0.1 0.793 360.0 360.0 -64.5 360.0 16.9 14.2 6.8