==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 06-MAR-09 2WC2 . COMPND 2 MOLECULE: CATABOLITE GENE ACTIVATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR N.POPOVYCH,S.R.TZENG,C.G.KALODIMOS . 418 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21293.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 283 67.7 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 . 66 15.8 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 51 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 20.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 3 0 2 2 2 0 2 0 0 0 0 0 2 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 . 6 2 2 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 4 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 V 0 0 69 0, 0.0 3,-0.4 0, 0.0 6,-0.3 0.000 360.0 360.0 360.0 150.8 -23.4 -17.2 -0.7 2 2 A L + 0 0 154 1,-0.2 0, 0.0 4,-0.1 0, 0.0 -0.547 360.0 54.1 -96.9 165.2 -26.2 -18.4 -3.0 3 3 A G S S+ 0 0 75 1,-0.3 -1,-0.2 -2,-0.2 0, 0.0 0.350 99.5 77.2 95.2 -9.8 -28.7 -16.4 -4.9 4 4 A K S S- 0 0 150 -3,-0.4 2,-1.7 0, 0.0 3,-0.4 -0.964 95.5 -98.6-130.3 151.5 -26.0 -14.5 -6.6 5 5 A P S S+ 0 0 135 0, 0.0 -3,-0.1 0, 0.0 0, 0.0 -0.514 79.1 116.6 -70.4 86.5 -23.5 -15.3 -9.5 6 6 A Q - 0 0 63 -2,-1.7 -4,-0.1 -5,-0.2 0, 0.0 0.713 43.0-170.3-113.7 -65.2 -20.5 -16.3 -7.4 7 7 A T + 0 0 130 -3,-0.4 -5,-0.1 -6,-0.3 0, 0.0 0.971 31.4 144.4 65.4 58.1 -19.6 -19.9 -8.0 8 8 A D >> + 0 0 31 1,-0.2 4,-1.5 -7,-0.1 3,-0.6 -0.697 18.6 170.6-128.5 79.1 -17.1 -20.2 -5.2 9 9 A P H >> S+ 0 0 89 0, 0.0 3,-0.9 0, 0.0 4,-0.7 0.947 79.1 55.7 -51.5 -59.2 -17.2 -23.7 -3.5 10 10 A T H 34 S+ 0 0 41 1,-0.3 4,-0.4 2,-0.2 -2,-0.0 0.780 107.9 49.6 -43.1 -36.3 -14.0 -23.2 -1.4 11 11 A L H <> S+ 0 0 8 -3,-0.6 4,-3.5 2,-0.3 -1,-0.3 0.839 107.9 51.7 -74.6 -34.2 -15.5 -20.0 0.1 12 12 A E H << S+ 0 0 64 -4,-1.5 -1,-0.2 -3,-0.9 -2,-0.2 0.498 108.8 53.2 -78.0 -8.4 -18.7 -21.9 0.9 13 13 A W T < S+ 0 0 167 -4,-0.7 -1,-0.3 -5,-0.2 -2,-0.3 0.582 114.9 40.7 -93.4 -23.1 -16.3 -24.3 2.4 14 14 A F T >> S+ 0 0 1 -4,-0.4 3,-1.4 -5,-0.3 4,-0.7 0.794 111.2 53.5 -90.0 -34.9 -14.9 -21.2 4.4 15 15 A L T 3< S+ 0 0 23 -4,-3.5 5,-0.4 1,-0.3 -3,-0.2 0.575 104.8 56.6 -81.9 -11.3 -18.2 -19.5 5.2 16 16 A S T 34 S+ 0 0 78 -5,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.347 109.5 48.5 -95.8 -0.2 -19.4 -22.7 6.7 17 17 A H T <4 S+ 0 0 91 -3,-1.4 -2,-0.2 78,-0.0 -1,-0.1 0.535 113.2 43.1-112.9 -13.2 -16.3 -22.5 8.9 18 18 A C S < S- 0 0 24 -4,-0.7 2,-0.2 79,-0.1 79,-0.2 0.114 90.9 -90.4-108.3-141.8 -16.6 -18.9 10.1 19 19 A H - 0 0 101 22,-0.0 77,-2.8 -2,-0.0 2,-0.4 -0.731 32.8-167.7-141.6 89.4 -19.4 -16.6 11.4 20 20 A I B +A 95 0A 56 -5,-0.4 75,-0.3 75,-0.3 22,-0.1 -0.712 49.1 92.8 -79.2 125.4 -21.2 -14.4 8.6 21 21 A H + 0 0 118 73,-1.1 72,-0.2 -2,-0.4 75,-0.1 0.119 40.5 164.9 151.3 111.5 -23.3 -11.7 10.3 22 22 A K - 0 0 13 70,-0.5 71,-0.2 22,-0.1 69,-0.1 0.375 27.4-110.3-101.3-130.6 -22.2 -8.3 11.0 23 23 A Y - 0 0 100 67,-0.2 69,-1.8 69,-0.1 67,-0.1 -0.950 40.0 -68.4-163.2 165.2 -24.0 -5.0 11.9 24 24 A P S S- 0 0 98 0, 0.0 3,-0.3 0, 0.0 67,-0.2 -0.295 74.4 -76.4 -60.9 161.5 -24.9 -1.6 10.4 25 25 A S S S+ 0 0 51 1,-0.2 66,-0.1 64,-0.1 64,-0.1 -0.199 102.8 67.1 -79.7 156.1 -22.0 0.6 10.0 26 26 A K S S+ 0 0 180 64,-0.2 2,-1.5 -3,-0.1 -1,-0.2 -0.083 70.6 128.6 113.7 -7.6 -19.7 2.7 12.1 27 27 A S - 0 0 14 -3,-0.3 61,-0.3 63,-0.2 2,-0.3 -0.591 37.3-179.2 -80.6 87.3 -18.7 -0.6 13.5 28 28 A T - 0 0 66 -2,-1.5 59,-0.2 59,-0.3 3,-0.1 -0.644 8.7-173.2 -89.9 151.5 -15.0 -0.5 13.2 29 29 A L + 0 0 18 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.634 62.2 7.1-121.8 -32.1 -13.3 -3.5 14.3 30 30 A I S S+ 0 0 6 56,-0.4 56,-1.1 1,-0.1 55,-0.4 -0.738 78.5 96.5-174.7 106.6 -9.5 -3.0 14.3 31 31 A H + 0 0 9 -2,-0.2 -1,-0.1 53,-0.2 52,-0.0 0.137 69.8 74.1 179.6 47.8 -7.5 0.2 13.7 32 32 A Q S S- 0 0 120 2,-0.1 50,-0.1 -3,-0.1 -2,-0.0 0.492 121.3 -68.5-142.4 -6.1 -6.7 1.6 17.1 33 33 A G S S+ 0 0 35 1,-0.3 2,-0.5 0, 0.0 49,-0.2 0.557 83.9 143.3 119.7 22.0 -4.0 -0.8 18.3 34 34 A E - 0 0 77 47,-0.1 48,-1.4 1,-0.1 47,-0.4 -0.819 61.1-106.2 -94.9 126.3 -6.0 -4.0 18.9 35 35 A K - 0 0 112 -2,-0.5 2,-2.4 46,-0.3 3,-0.2 -0.285 28.9-135.7 -50.7 113.3 -4.1 -7.2 18.0 36 36 A A + 0 0 1 1,-0.2 44,-0.2 37,-0.1 -1,-0.2 -0.441 56.8 138.1 -77.5 70.4 -5.8 -8.3 14.8 37 37 A E + 0 0 93 -2,-2.4 62,-1.0 43,-0.1 2,-0.4 0.389 57.9 68.8 -94.2 1.8 -6.1 -12.0 15.8 38 38 A T E S-B 98 0A 37 -3,-0.2 2,-0.3 60,-0.2 60,-0.3 -0.960 71.0-150.0-123.6 138.6 -9.6 -12.2 14.4 39 39 A L E -B 97 0A 0 58,-3.4 58,-2.2 -2,-0.4 2,-0.5 -0.842 2.8-158.4-110.1 147.0 -10.5 -12.0 10.7 40 40 A Y E -BC 96 70A 22 30,-2.5 2,-1.1 -2,-0.3 30,-0.5 -0.946 5.0-155.6-127.9 112.7 -13.8 -10.7 9.2 41 41 A Y E -B 95 0A 7 54,-1.4 54,-3.3 -2,-0.5 2,-0.8 -0.720 15.7-143.5 -87.8 98.3 -14.9 -11.7 5.7 42 42 A I E +B 94 0A 0 -2,-1.1 25,-1.6 52,-0.3 26,-1.0 -0.478 30.3 168.7 -61.8 104.8 -17.2 -8.9 4.5 43 43 A V E S+ 0 0 16 50,-2.6 2,-0.3 -2,-0.8 -1,-0.2 0.654 70.5 1.4 -93.7 -18.3 -19.7 -11.2 2.7 44 44 A K E S+B 93 0A 95 49,-0.8 49,-2.5 -3,-0.1 -1,-0.5 -0.892 114.2 46.7-167.1 148.4 -22.2 -8.4 2.1 45 45 A G S S- 0 0 1 47,-0.3 2,-0.3 -2,-0.3 22,-0.2 -0.231 73.7-122.4 91.0 172.0 -21.9 -4.8 3.2 46 46 A S - 0 0 13 20,-0.1 43,-0.8 -2,-0.1 44,-0.5 -0.988 20.6-153.7-155.2 147.4 -18.8 -2.8 2.5 47 47 A V B -D 88 0B 0 -2,-0.3 17,-1.2 42,-0.3 2,-0.7 -0.585 21.1-111.2-120.8 179.6 -16.4 -0.9 4.7 48 48 A A E -E 63 0C 0 39,-3.2 2,-0.3 15,-0.2 15,-0.3 -0.897 27.2-150.4-119.1 99.8 -14.0 1.9 4.8 49 49 A V E -E 62 0C 0 13,-1.4 13,-3.3 -2,-0.7 12,-2.4 -0.519 23.5-177.2 -68.6 127.7 -10.5 0.8 5.1 50 50 A L E -E 60 0C 13 10,-0.3 36,-0.3 -2,-0.3 10,-0.3 -0.970 10.7-154.1-136.0 148.8 -8.5 3.5 7.0 51 51 A I E -E 59 0C 5 8,-2.3 8,-1.3 -2,-0.3 2,-0.4 -0.748 14.6-123.0-122.4 165.8 -4.9 4.0 8.0 52 52 A K E -E 58 0C 40 31,-0.4 6,-0.3 -2,-0.3 289,-0.1 -0.896 25.5-152.0-109.0 137.9 -2.8 5.7 10.5 53 53 A D - 0 0 11 4,-1.5 3,-0.3 -2,-0.4 287,-0.1 0.114 36.7 -92.0 -91.5-161.2 0.0 8.1 9.6 54 54 A E S S+ 0 0 87 1,-0.2 286,-0.1 2,-0.1 285,-0.1 0.461 128.6 44.8 -92.1 -3.1 3.2 9.2 11.3 55 55 A E S S- 0 0 78 2,-0.1 -1,-0.2 0, 0.0 284,-0.0 0.060 127.2 -95.6-123.4 20.4 1.4 12.1 12.9 56 56 A G + 0 0 44 -3,-0.3 2,-0.6 1,-0.2 -2,-0.1 0.664 69.4 153.0 81.3 16.9 -1.7 10.0 13.9 57 57 A K - 0 0 44 1,-0.1 -4,-1.5 282,-0.1 2,-0.7 -0.726 21.4-172.9 -86.4 122.2 -4.0 10.8 11.0 58 58 A E E +E 52 0C 86 -2,-0.6 -6,-0.3 -6,-0.3 2,-0.2 -0.845 23.5 154.9-113.5 89.0 -6.3 7.8 10.7 59 59 A M E -E 51 0C 42 -8,-1.3 -8,-2.3 -2,-0.7 2,-0.4 -0.694 51.4 -87.6-116.3 168.2 -8.1 8.6 7.5 60 60 A I E +E 50 0C 9 -10,-0.3 -10,-0.3 -2,-0.2 -11,-0.1 -0.592 45.8 163.1 -82.6 133.3 -9.8 6.3 5.1 61 61 A L E + 0 0 40 -12,-2.4 2,-0.3 -2,-0.4 -11,-0.2 0.530 63.0 11.0-119.7 -16.9 -7.4 5.1 2.4 62 62 A S E -E 49 0C 3 -13,-3.3 -13,-1.4 23,-0.0 2,-0.3 -0.934 55.1-155.9-156.7 168.1 -9.4 2.2 1.0 63 63 A Y E -E 48 0C 62 -15,-0.3 -15,-0.2 -2,-0.3 2,-0.1 -0.966 12.0-140.7-156.4 157.3 -12.8 0.4 0.9 64 64 A L - 0 0 5 -17,-1.2 2,-0.3 -2,-0.3 -18,-0.0 -0.043 10.7-123.9-101.5-175.3 -14.1 -3.0 0.2 65 65 A N > - 0 0 77 -23,-0.1 2,-1.8 -2,-0.1 3,-1.6 -0.871 44.4 -77.5-134.1 168.3 -16.9 -4.8 -1.5 66 66 A Q T 3 S+ 0 0 129 -2,-0.3 -23,-0.2 1,-0.3 -20,-0.1 -0.574 126.9 30.9 -63.8 81.7 -19.6 -7.3 -0.6 67 67 A G T 3 S+ 0 0 36 -2,-1.8 -1,-0.3 -25,-1.6 -24,-0.2 0.484 94.3 114.0 135.7 21.3 -17.3 -10.3 -0.7 68 68 A D < - 0 0 10 -3,-1.6 2,-0.3 -26,-1.0 -26,-0.1 -0.171 61.9 -99.8-100.8-163.6 -13.9 -8.9 0.3 69 69 A F - 0 0 4 -28,-0.2 2,-0.3 47,-0.1 -28,-0.2 -0.840 24.2-165.0-124.2 160.1 -11.8 -9.6 3.4 70 70 A I B S+C 40 0A 0 -30,-0.5 -30,-2.5 -2,-0.3 16,-0.1 -0.994 71.4 23.8-143.4 142.8 -11.1 -7.8 6.7 71 71 A G S >> S+ 0 0 2 -2,-0.3 4,-1.4 -32,-0.2 3,-1.1 0.593 78.5 119.1 78.9 12.5 -8.4 -8.3 9.3 72 72 A E H 3>> + 0 0 0 1,-0.3 4,-3.2 2,-0.2 5,-2.0 0.840 66.3 69.3 -73.8 -31.2 -6.1 -9.8 6.7 73 73 A L H 345S+ 0 0 2 1,-0.2 -1,-0.3 3,-0.2 6,-0.2 0.388 108.6 35.5 -65.1 1.4 -3.9 -6.8 7.6 74 74 A G H <45S+ 0 0 0 -3,-1.1 6,-0.5 5,-0.2 -1,-0.2 0.590 124.9 35.5-126.4 -27.3 -3.4 -8.5 10.9 75 75 A L H <5S+ 0 0 27 -4,-1.4 -2,-0.2 3,-0.1 -3,-0.2 0.767 134.8 22.9 -98.0 -30.4 -3.4 -12.2 10.1 76 76 A F T <5S+ 0 0 7 -4,-3.2 -3,-0.2 -5,-0.2 255,-0.2 0.701 118.1 58.6-108.5 -31.8 -1.6 -12.0 6.9 77 77 A E S > - B 0 38A 61 -2,-0.3 4,-2.3 -60,-0.3 3,-0.9 -0.737 29.6-137.7 -91.6 131.5 -10.3 -16.4 14.3 99 99 A Y H 3> S+ 0 0 48 -62,-1.0 4,-1.1 -2,-0.5 -61,-0.1 0.438 97.9 74.5 -65.8 -2.5 -7.2 -16.9 12.1 100 100 A K H 34 S+ 0 0 165 -63,-0.4 4,-0.4 2,-0.1 -1,-0.3 0.967 112.4 24.6 -70.7 -49.6 -6.0 -19.6 14.4 101 101 A K H <> S+ 0 0 120 -3,-0.9 4,-0.6 2,-0.2 3,-0.4 0.847 126.5 51.1 -75.9 -37.2 -8.7 -21.9 13.0 102 102 A F H >X S+ 0 0 4 -4,-2.3 4,-3.9 1,-0.2 3,-2.1 0.946 100.7 60.3 -67.4 -50.5 -9.0 -20.1 9.7 103 103 A R H 3< S+ 0 0 129 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.737 104.9 53.7 -47.4 -27.4 -5.3 -20.1 8.9 104 104 A Q H 34 S+ 0 0 93 -4,-0.4 -1,-0.3 -3,-0.4 -2,-0.2 0.645 109.4 43.0 -88.7 -18.4 -5.6 -23.9 9.1 105 105 A L H XX S+ 0 0 11 -3,-2.1 3,-1.4 -4,-0.6 4,-1.3 0.775 113.1 54.9 -85.5 -40.9 -8.4 -24.1 6.5 106 106 A I T 3< S+ 0 0 17 -4,-3.9 7,-0.6 1,-0.3 -2,-0.2 0.663 110.2 48.9 -61.2 -9.2 -6.4 -21.4 4.5 107 107 A Q T 34 S+ 0 0 104 -5,-0.4 -1,-0.3 1,-0.1 -2,-0.2 0.554 103.1 57.8-102.3 -14.2 -3.7 -24.0 4.8 108 108 A V T <4 S+ 0 0 103 -3,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.682 112.8 43.4 -86.2 -20.7 -5.9 -26.9 3.7 109 109 A N >X - 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