==== 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 TRANSCRIPTION/DNA 10-MAR-08 2K1N . COMPND 2 MOLECULE: TRANSITION STATE REGULATORY PROTEIN ABRB; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR J.CAVANAGH,B.G.BOBAY,D.M.SULLIVAN,R.J.THOMPSON . 220 4 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14564.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 65.5 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 . 63 28.6 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 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 2.3 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 . 1 0.5 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 . 43 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 1 3 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 . 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 . 4 0 2 3 4 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 ANTIPARALLEL 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 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 0 213 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 132.1 9.0 -21.8 -12.3 2 2 A K - 0 0 171 2,-0.1 2,-1.7 3,-0.0 0, 0.0 -0.728 360.0 -52.2-140.1-171.5 12.5 -20.4 -12.4 3 3 A S S S+ 0 0 80 -2,-0.2 2,-0.3 2,-0.0 0, 0.0 -0.542 91.9 109.1 -73.0 88.2 14.7 -18.0 -10.5 4 4 A T + 0 0 44 -2,-1.7 2,-0.2 88,-0.0 -2,-0.1 -0.985 34.1 165.9-159.7 153.7 12.5 -15.0 -10.5 5 5 A G - 0 0 18 -2,-0.3 2,-0.4 88,-0.1 88,-0.2 -0.581 50.5 -31.7-144.8-151.3 10.3 -12.9 -8.1 6 6 A I E -A 92 0A 82 86,-2.4 86,-3.3 -2,-0.2 2,-0.7 -0.659 57.0-128.0 -82.4 127.5 8.5 -9.7 -7.7 7 7 A V E -A 91 0A 68 -2,-0.4 2,-0.4 84,-0.2 84,-0.2 -0.658 30.6-170.7 -78.8 113.5 10.0 -6.8 -9.6 8 8 A R E -A 90 0A 40 82,-2.8 82,-2.4 -2,-0.7 2,-0.6 -0.900 13.3-150.0-110.6 134.9 10.5 -3.9 -7.2 9 9 A K E +A 89 0A 118 -2,-0.4 80,-0.3 80,-0.2 2,-0.1 -0.904 26.0 164.3-105.5 119.2 11.5 -0.4 -8.1 10 10 A V - 0 0 9 78,-2.8 2,-0.3 -2,-0.6 6,-0.2 -0.227 48.8 -46.8-112.2-157.8 13.5 1.6 -5.5 11 11 A D B > -F 14 0B 55 4,-1.3 3,-1.4 3,-1.1 -1,-0.2 -0.591 41.5-136.3 -79.8 139.9 15.6 4.7 -5.7 12 12 A E T 3 S+ 0 0 136 -2,-0.3 75,-0.3 1,-0.3 -1,-0.1 0.479 108.7 44.8 -73.2 -2.1 18.1 4.9 -8.5 13 13 A L T 3 S- 0 0 124 1,-0.2 2,-0.4 75,-0.1 -1,-0.3 0.298 130.6 -80.1-120.0 3.3 20.6 6.2 -6.0 14 14 A G B < S+F 11 0B 11 -3,-1.4 -3,-1.1 1,-0.2 3,-0.3 -0.993 70.6 137.0 140.3-131.9 19.9 3.7 -3.3 15 15 A R - 0 0 79 -2,-0.4 2,-1.8 1,-0.2 -4,-1.3 0.946 43.5-146.8 44.9 83.0 17.1 3.5 -0.7 16 16 A V B -G 72 0C 10 56,-2.4 56,-2.2 -6,-0.2 2,-1.0 -0.573 19.6-173.5 -79.9 84.3 16.0 -0.1 -0.7 17 17 A V - 0 0 33 -2,-1.8 3,-0.2 -3,-0.3 54,-0.1 -0.733 16.9-139.8 -85.0 103.6 12.4 0.4 -0.0 18 18 A I - 0 0 9 -2,-1.0 5,-0.1 1,-0.2 -9,-0.0 -0.191 44.3 -62.9 -59.9 154.9 10.9 -3.1 0.4 19 19 A P > - 0 0 2 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 -0.105 39.1-147.9 -44.3 124.2 7.4 -3.9 -1.1 20 20 A I H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.852 97.9 60.6 -63.2 -34.7 4.8 -1.7 0.5 21 21 A E H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.941 108.9 39.7 -58.1 -51.4 2.3 -4.6 -0.0 22 22 A L H >>S+ 0 0 28 1,-0.2 4,-2.9 2,-0.2 5,-0.6 0.856 109.8 63.0 -68.6 -34.6 4.4 -7.0 2.2 23 23 A R H X>S+ 0 0 40 -4,-2.1 5,-2.2 1,-0.2 4,-1.1 0.919 115.5 29.1 -56.4 -48.0 5.1 -4.2 4.6 24 24 A R H <5S+ 0 0 115 -4,-2.1 -1,-0.2 3,-0.2 -2,-0.2 0.802 119.3 56.3 -84.7 -31.1 1.4 -3.7 5.5 25 25 A T H <5S+ 0 0 59 -4,-2.3 145,-0.2 -5,-0.3 -2,-0.2 0.943 121.9 26.6 -65.6 -48.0 0.4 -7.3 4.8 26 26 A L H <5S- 0 0 70 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.769 107.7-124.3 -85.6 -28.1 2.9 -8.8 7.3 27 27 A G T << - 0 0 56 -4,-1.1 2,-0.8 -5,-0.6 -3,-0.2 0.958 34.3-173.4 80.9 58.8 3.1 -5.7 9.5 28 28 A I < - 0 0 18 -5,-2.2 2,-0.4 -6,-0.2 -1,-0.2 -0.789 18.2-140.1 -91.5 106.8 6.8 -4.9 9.4 29 29 A A > - 0 0 34 -2,-0.8 2,-0.9 1,-0.1 3,-0.6 -0.530 6.8-154.0 -67.8 119.8 7.6 -2.1 11.8 30 30 A E T 3 S+ 0 0 66 -2,-0.4 40,-0.4 1,-0.2 41,-0.2 -0.325 75.2 83.0 -93.3 53.9 10.2 0.1 10.1 31 31 A K T 3 S+ 0 0 155 -2,-0.9 -1,-0.2 38,-0.1 2,-0.2 0.235 82.9 57.5-136.2 10.5 11.7 1.5 13.3 32 32 A D S < S- 0 0 48 -3,-0.6 34,-2.5 35,-0.1 2,-0.4 -0.482 90.8 -75.2-126.4-164.7 14.1 -1.3 14.2 33 33 A A E -B 65 0A 22 32,-0.3 2,-0.4 -2,-0.2 15,-0.3 -0.855 36.6-157.7-105.1 136.0 17.1 -3.1 12.8 34 34 A L E -B 64 0A 3 30,-2.6 30,-2.3 -2,-0.4 2,-0.3 -0.886 24.4-111.0-112.9 142.1 16.8 -5.8 10.0 35 35 A E E -BC 63 46A 61 11,-2.8 11,-2.0 -2,-0.4 2,-0.5 -0.522 31.4-170.7 -72.2 131.5 19.3 -8.5 9.3 36 36 A I E -BC 62 45A 2 26,-1.1 26,-1.3 -2,-0.3 2,-0.5 -0.919 4.0-177.6-129.3 103.5 21.1 -8.0 6.0 37 37 A Y E - C 0 44A 142 7,-2.0 7,-2.9 -2,-0.5 2,-0.5 -0.891 19.4-139.6-104.1 129.2 23.3 -10.8 4.7 38 38 A V E - C 0 43A 43 -2,-0.5 2,-0.5 5,-0.2 5,-0.2 -0.761 20.0-179.8 -91.0 124.0 25.2 -10.4 1.5 39 39 A D E > - C 0 42A 68 3,-3.7 3,-2.3 -2,-0.5 2,-1.7 -0.816 60.5 -71.4-127.1 89.7 25.3 -13.5 -0.8 40 40 A D T 3 S- 0 0 138 -2,-0.5 44,-0.0 1,-0.3 -2,-0.0 -0.429 119.8 -12.2 65.8 -83.9 27.3 -12.8 -4.0 41 41 A E T 3 S+ 0 0 49 -2,-1.7 2,-0.3 62,-0.0 -1,-0.3 0.245 126.8 74.9-129.3 7.4 24.9 -10.4 -5.7 42 42 A K E < -C 39 0A 44 -3,-2.3 -3,-3.7 60,-0.1 2,-0.4 -0.904 63.1-148.5-123.4 151.2 21.8 -11.0 -3.5 43 43 A I E -CD 38 101A 21 58,-2.7 58,-3.3 -2,-0.3 2,-0.8 -0.980 9.7-141.3-124.3 129.2 21.0 -9.7 -0.1 44 44 A I E -CD 37 100A 42 -7,-2.9 -7,-2.0 -2,-0.4 2,-0.6 -0.798 19.3-168.9 -91.5 110.2 18.9 -11.5 2.5 45 45 A L E +CD 36 99A 1 54,-2.8 54,-3.2 -2,-0.8 2,-0.3 -0.892 27.1 128.3-102.5 120.7 16.7 -9.1 4.4 46 46 A K E -C 35 0A 53 -11,-2.0 -11,-2.8 -2,-0.6 2,-0.2 -0.942 49.5-104.4-157.6 175.3 14.9 -10.5 7.5 47 47 A K - 0 0 42 50,-0.4 -13,-0.1 -2,-0.3 50,-0.0 -0.478 45.1 -93.0-101.3 177.7 14.3 -9.9 11.1 48 48 A Y S S- 0 0 145 -15,-0.3 -1,-0.1 1,-0.3 -14,-0.0 0.890 114.3 -9.0 -57.7 -42.4 15.7 -11.7 14.2 49 49 A K > + 0 0 114 48,-0.0 3,-1.0 1,-0.0 -1,-0.3 -0.508 67.2 162.5-160.0 81.5 12.8 -14.1 14.2 50 50 A P T 3 S+ 0 0 11 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.539 77.3 65.7 -80.1 -7.2 9.9 -13.3 11.8 51 51 A N T 3 S+ 0 0 71 1,-0.2 47,-0.0 2,-0.1 46,-0.0 0.190 106.9 40.8 -98.4 14.8 8.6 -16.8 12.1 52 52 A M S < S+ 0 0 146 -3,-1.0 -1,-0.2 2,-0.0 -3,-0.0 -0.069 96.2 79.7-150.9 35.5 7.8 -16.4 15.8 53 53 A T S S+ 0 0 100 -3,-0.5 -2,-0.1 0, 0.0 0, 0.0 0.785 109.6 12.8-108.9 -59.2 6.4 -12.9 15.9 54 54 A a 0 0 54 -4,-0.4 -3,-0.1 -28,-0.0 -2,-0.0 0.537 360.0 360.0 -97.1 -10.1 2.7 -13.1 14.8 55 55 A Q 0 0 143 -5,-0.1 -4,-0.0 0, 0.0 0, 0.0 -0.467 360.0 360.0 -70.8 360.0 2.7 -16.8 15.1 56 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 57 1 B M 0 0 229 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -23.4 36.2 -6.4 8.4 58 2 B K - 0 0 149 1,-0.1 2,-1.8 19,-0.0 3,-0.4 0.052 360.0 -55.9 -92.5-156.6 33.7 -3.7 9.2 59 3 B S S S+ 0 0 63 1,-0.2 19,-0.4 3,-0.0 18,-0.2 -0.458 79.8 138.9 -86.2 64.9 29.9 -3.8 9.1 60 4 B T S S- 0 0 49 -2,-1.8 2,-0.3 1,-0.3 -1,-0.2 0.825 76.1 -0.4 -77.1 -33.6 29.8 -5.0 5.4 61 5 B G S S+ 0 0 30 -3,-0.4 -1,-0.3 -24,-0.1 -24,-0.2 -0.867 97.1 77.0-162.1 124.5 27.0 -7.5 6.0 62 6 B I E S-B 36 0A 99 -26,-1.3 -26,-1.1 -2,-0.3 2,-0.3 -0.176 91.0 -19.7 175.1 -66.2 25.0 -8.4 9.1 63 7 B V E -B 35 0A 50 -28,-0.3 2,-0.3 -18,-0.0 -28,-0.2 -0.966 49.7-177.9-166.8 146.7 22.3 -6.0 10.2 64 8 B R E -B 34 0A 65 -30,-2.3 -30,-2.6 -2,-0.3 2,-0.2 -0.991 33.2-102.0-149.7 152.1 21.3 -2.3 9.8 65 9 B K E -B 33 0A 106 -2,-0.3 8,-0.4 -32,-0.3 2,-0.3 -0.537 35.2-127.4 -76.6 138.4 18.6 0.0 11.0 66 10 B V - 0 0 6 -34,-2.5 6,-0.2 -2,-0.2 -1,-0.1 -0.634 31.7-101.7 -85.5 143.4 15.7 0.8 8.7 67 11 B D B >> -H 71 0D 19 4,-3.4 3,-2.5 -2,-0.3 4,-0.7 -0.303 24.7-117.6 -64.3 149.4 14.9 4.4 8.0 68 12 B E T 34 S+ 0 0 143 1,-0.3 -1,-0.1 2,-0.2 -38,-0.1 0.656 116.0 62.1 -60.9 -16.6 11.9 6.0 9.8 69 13 B L T 34 S- 0 0 130 2,-0.1 -1,-0.3 -38,-0.0 -2,-0.1 0.332 127.4 -98.4 -91.4 5.6 10.4 6.5 6.3 70 14 B G T <4 S+ 0 0 3 -3,-2.5 2,-0.4 -40,-0.4 -2,-0.2 0.942 78.9 135.7 77.9 50.5 10.4 2.8 5.7 71 15 B R B < -H 67 0D 83 -4,-0.7 -4,-3.4 -41,-0.2 2,-0.4 -0.996 44.4-146.6-134.3 129.3 13.6 2.4 3.7 72 16 B V B -G 16 0C 2 -56,-2.2 -56,-2.4 -2,-0.4 2,-0.4 -0.759 20.6-156.4 -92.3 139.1 16.3 -0.2 4.1 73 17 B V - 0 0 21 -2,-0.4 3,-0.1 -8,-0.4 -59,-0.0 -0.903 16.5-116.2-121.7 150.1 19.8 1.0 3.3 74 18 B I - 0 0 50 -2,-0.4 -59,-0.1 1,-0.1 -13,-0.1 -0.605 47.3 -92.6 -80.5 135.3 23.0 -0.7 2.2 75 19 B P > - 0 0 3 0, 0.0 4,-2.1 0, 0.0 3,-0.4 -0.215 29.7-132.5 -48.7 132.7 25.9 -0.6 4.7 76 20 B I H > S+ 0 0 94 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.932 105.5 52.8 -53.4 -53.3 28.2 2.4 4.0 77 21 B E H > S+ 0 0 41 -18,-0.2 4,-1.0 1,-0.2 5,-0.3 0.822 109.5 51.1 -54.6 -34.7 31.4 0.3 4.2 78 22 B L H > S+ 0 0 23 -3,-0.4 4,-3.0 -19,-0.4 3,-0.4 0.982 117.3 34.8 -69.3 -56.3 30.0 -2.2 1.7 79 23 B R H < S+ 0 0 83 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.819 116.6 55.5 -69.3 -32.4 28.9 0.3 -1.0 80 24 B R H < S+ 0 0 210 -4,-3.1 -1,-0.2 -5,-0.3 -2,-0.2 0.760 119.6 31.2 -73.2 -25.1 31.9 2.6 -0.4 81 25 B T H < S+ 0 0 99 -4,-1.0 2,-0.5 -3,-0.4 -2,-0.2 0.853 131.6 22.6 -99.2 -45.5 34.4 -0.2 -0.8 82 26 B L < - 0 0 95 -4,-3.0 2,-1.7 -5,-0.3 -1,-0.2 -0.888 55.1-169.0-131.3 103.8 32.8 -2.5 -3.4 83 27 B G + 0 0 52 -2,-0.5 -4,-0.1 1,-0.2 3,-0.0 -0.334 43.6 133.3 -84.2 56.1 30.1 -1.1 -5.7 84 28 B I + 0 0 107 -2,-1.7 2,-0.4 -6,-0.2 -1,-0.2 0.316 61.4 59.7 -88.2 7.3 29.2 -4.7 -6.8 85 29 B A S S- 0 0 58 -3,-0.2 -1,-0.2 -6,-0.1 -43,-0.0 -0.918 73.9-152.0-141.7 110.3 25.5 -4.0 -6.4 86 30 B E - 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