==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 11-JUN-10 2XHA . COMPND 2 MOLECULE: TRANSCRIPTION ANTITERMINATION PROTEIN NUSG; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR C.M.STEGMANN,A.MANDAL,M.C.WAHL . 386 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22221.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 242 62.7 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 . 148 38.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 2 0.5 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 . 38 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.5 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+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 0 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 12 0 2 2 2 4 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 2 0 0 0 0 0 0 0 1 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 42 A P 0 0 100 0, 0.0 2,-1.8 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 21.5 -54.5 21.9 -59.3 2 43 A E + 0 0 134 188,-0.1 187,-2.8 186,-0.0 2,-0.4 -0.190 360.0 54.3 72.2 -44.0 -52.9 22.0 -62.8 3 44 A E E S-A 188 0A 72 -2,-1.8 2,-0.3 185,-0.2 185,-0.2 -0.943 72.8-176.0-117.4 143.5 -50.6 19.1 -61.7 4 45 A V E -A 187 0A 39 183,-2.6 183,-3.1 -2,-0.4 2,-0.5 -0.899 25.2-124.9-133.1 162.9 -51.9 15.9 -60.2 5 46 A V - 0 0 46 -2,-0.3 2,-0.2 181,-0.2 181,-0.1 -0.949 29.2-130.7-107.2 128.0 -50.5 12.6 -58.7 6 47 A L > - 0 0 71 -2,-0.5 3,-1.9 179,-0.3 179,-0.0 -0.546 14.6-126.7 -75.5 141.1 -51.7 9.4 -60.4 7 48 A D T 3 S+ 0 0 173 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.728 111.2 58.3 -58.8 -21.6 -53.0 6.8 -58.1 8 49 A A T 3 S+ 0 0 100 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.584 82.7 107.9 -82.9 -11.2 -50.5 4.4 -59.8 9 50 A T < - 0 0 36 -3,-1.9 3,-0.0 176,-0.1 -4,-0.0 -0.495 59.3-147.8 -73.6 130.9 -47.5 6.5 -58.9 10 51 A S - 0 0 90 -2,-0.2 175,-0.4 1,-0.1 -4,-0.1 -0.710 34.1 -89.5 -95.0 152.6 -45.2 5.2 -56.2 11 52 A P - 0 0 36 0, 0.0 173,-0.3 0, 0.0 3,-0.1 -0.278 20.4-151.2 -62.9 142.8 -43.4 7.7 -53.9 12 53 A S S S+ 0 0 60 171,-2.8 2,-0.3 1,-0.3 172,-0.2 0.622 90.4 21.8 -83.0 -19.3 -40.0 9.1 -55.0 13 54 A E E -B 183 0B 14 170,-1.2 170,-2.4 2,-0.0 2,-0.5 -0.971 62.3-173.4-144.1 137.0 -39.1 9.5 -51.3 14 55 A R E -B 182 0B 50 -2,-0.3 2,-0.5 168,-0.2 168,-0.2 -0.908 14.6-165.2-128.7 102.1 -40.6 7.8 -48.3 15 56 A L E -B 181 0B 22 166,-3.2 166,-2.1 -2,-0.5 2,-0.4 -0.796 4.7-154.8 -96.1 124.6 -39.2 9.3 -45.1 16 57 A I E +B 180 0B 18 -2,-0.5 2,-0.3 164,-0.2 164,-0.2 -0.852 21.5 178.4-100.7 131.0 -39.7 7.4 -41.9 17 58 A L E -B 179 0B 5 162,-3.1 162,-2.2 -2,-0.4 23,-0.0 -0.889 33.1 -93.3-135.6 159.8 -39.7 9.4 -38.7 18 59 A S > - 0 0 35 -2,-0.3 3,-2.0 160,-0.2 160,-0.2 -0.334 39.3-115.7 -65.9 149.3 -40.1 9.2 -34.9 19 60 A P T 3 S+ 0 0 38 0, 0.0 159,-0.1 0, 0.0 -1,-0.1 0.646 117.1 60.4 -61.4 -13.0 -43.6 9.8 -33.6 20 61 A K T 3 S+ 0 0 126 2,-0.1 -2,-0.0 159,-0.1 158,-0.0 0.491 79.4 123.8 -89.5 -3.3 -42.1 12.9 -31.9 21 62 A A < - 0 0 2 -3,-2.0 2,-0.6 19,-0.1 19,-0.2 -0.243 61.0-132.3 -63.4 141.3 -41.1 14.5 -35.1 22 63 A K E -E 39 0C 132 17,-3.2 17,-2.4 2,-0.0 2,-0.3 -0.850 22.3-144.3 -90.9 122.4 -42.3 18.0 -36.0 23 64 A L E -E 38 0C 31 -2,-0.6 15,-0.3 15,-0.2 14,-0.0 -0.692 16.2-169.4 -90.1 140.1 -43.6 18.0 -39.6 24 65 A H S S+ 0 0 65 13,-3.1 2,-0.3 -2,-0.3 14,-0.2 0.217 70.4 53.7-111.4 13.3 -43.1 21.1 -41.7 25 66 A V - 0 0 14 12,-0.5 2,-0.3 6,-0.0 -2,-0.0 -0.913 67.0-148.2-137.5 165.0 -45.5 20.1 -44.5 26 67 A N > - 0 0 102 -2,-0.3 3,-2.2 1,-0.1 144,-0.2 -0.884 41.7 -64.5-131.9 166.0 -49.1 19.0 -44.8 27 68 A N T 3 S+ 0 0 105 -2,-0.3 144,-0.2 1,-0.3 -1,-0.1 -0.200 119.6 12.7 -47.6 124.7 -51.1 16.6 -47.0 28 69 A G T 3 S+ 0 0 44 142,-3.2 -1,-0.3 1,-0.3 2,-0.2 0.366 89.1 140.0 92.7 -6.6 -51.2 17.9 -50.6 29 70 A K < - 0 0 84 -3,-2.2 141,-3.2 141,-0.2 2,-0.4 -0.507 48.6-133.4 -73.4 137.1 -48.5 20.4 -50.3 30 71 A D E -C 169 0B 88 139,-0.2 2,-0.3 -2,-0.2 139,-0.2 -0.759 28.1-172.2 -84.8 134.9 -46.0 20.8 -53.2 31 72 A V E -C 168 0B 4 137,-3.2 137,-2.5 -2,-0.4 2,-0.4 -0.911 17.3-131.6-126.6 157.6 -42.4 20.9 -52.1 32 73 A N > - 0 0 105 -2,-0.3 3,-2.5 135,-0.2 132,-0.3 -0.829 41.0 -88.7-103.4 143.1 -39.1 21.6 -53.9 33 74 A K T 3 S+ 0 0 149 -2,-0.4 132,-0.2 1,-0.3 134,-0.1 -0.238 117.9 27.0 -43.2 129.8 -36.0 19.5 -53.6 34 75 A G T 3 S+ 0 0 45 130,-2.9 -1,-0.3 1,-0.3 2,-0.1 0.306 86.8 133.9 94.1 -9.5 -34.1 20.9 -50.6 35 76 A D < - 0 0 64 -3,-2.5 129,-2.7 1,-0.1 -1,-0.3 -0.480 66.2-104.7 -71.4 144.4 -37.1 22.4 -48.7 36 77 A L E + F 0 163C 55 127,-0.2 127,-0.3 1,-0.1 -1,-0.1 -0.517 47.0 165.8 -62.7 130.1 -37.2 21.7 -45.0 37 78 A I E - 0 0 0 125,-3.1 -13,-3.1 1,-0.4 -12,-0.5 0.602 55.8 -0.7-121.1 -19.8 -39.9 19.0 -44.4 38 79 A A E -EF 23 162C 0 124,-1.5 124,-2.9 -15,-0.3 -1,-0.4 -0.991 48.6-153.0-163.4 162.5 -39.4 17.7 -40.8 39 80 A E E -EF 22 161C 57 -17,-2.4 -17,-3.2 -2,-0.3 122,-0.2 -0.982 12.3-145.8-142.6 130.0 -37.4 18.0 -37.6 40 81 A E E - F 0 160C 38 120,-2.7 120,-1.9 -2,-0.3 -19,-0.1 -0.809 37.2-108.8 -89.5 138.7 -36.7 15.4 -34.9 41 82 A P - 0 0 46 0, 0.0 119,-0.2 0, 0.0 -1,-0.1 -0.132 40.8 -84.2 -65.7 161.6 -36.4 16.9 -31.5 42 83 A P - 0 0 30 0, 0.0 2,-0.6 0, 0.0 116,-0.2 -0.130 42.0-116.4 -57.8 158.9 -33.1 17.2 -29.6 43 84 A I E -G 157 0D 39 114,-2.4 113,-2.7 -3,-0.1 114,-1.6 -0.922 34.1-168.1-104.2 121.0 -32.0 14.2 -27.5 44 85 A Y E -G 155 0D 122 -2,-0.6 2,-0.2 111,-0.3 111,-0.2 -0.879 27.4-106.6-110.8 145.6 -31.8 14.9 -23.8 45 86 A A - 0 0 3 109,-2.6 108,-2.7 -2,-0.3 109,-0.1 -0.452 21.7-159.1 -65.0 124.9 -30.2 12.9 -20.9 46 87 A R S S+ 0 0 89 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.825 75.7 14.0 -74.8 -30.7 -32.9 11.3 -18.9 47 88 A R S S- 0 0 55 104,-0.1 -1,-0.2 105,-0.1 2,-0.1 -0.986 84.7-102.3-143.5 150.2 -30.6 10.8 -15.8 48 89 A S + 0 0 52 -2,-0.3 2,-0.3 -3,-0.1 103,-0.2 -0.413 64.0 109.4 -70.0 151.2 -27.3 12.1 -14.7 49 90 A G E -H 150 0E 9 101,-2.3 101,-3.3 75,-0.2 2,-0.4 -0.977 62.6 -70.9 172.2-164.2 -24.3 9.7 -15.1 50 91 A V E -HI 149 123E 41 73,-2.4 73,-2.6 -2,-0.3 2,-0.5 -0.947 41.5-112.9-120.0 141.5 -21.2 9.0 -17.0 51 92 A I E + I 0 122E 2 97,-2.8 96,-3.4 -2,-0.4 71,-0.2 -0.596 37.0 172.0 -72.8 119.5 -20.8 7.9 -20.6 52 93 A V E + 0 0 50 69,-2.7 2,-0.3 -2,-0.5 -1,-0.2 0.561 61.1 21.6-107.2 -12.4 -19.5 4.3 -20.4 53 94 A D E - I 0 121E 36 68,-1.1 68,-2.5 92,-0.1 2,-0.4 -0.969 46.2-177.2-156.9 140.9 -19.7 3.3 -24.1 54 95 A V E + I 0 120E 31 -2,-0.3 2,-0.4 66,-0.2 66,-0.2 -0.956 25.2 175.1-135.0 117.0 -20.0 4.9 -27.5 55 96 A K E - I 0 119E 68 64,-2.4 64,-3.1 -2,-0.4 2,-0.4 -0.971 33.2-118.3-132.3 139.5 -20.4 2.3 -30.3 56 97 A N E + I 0 118E 83 -2,-0.4 21,-2.4 62,-0.2 22,-0.5 -0.591 44.0 166.5 -75.3 125.8 -21.0 2.5 -34.1 57 98 A V E -JI 76 117E 2 60,-2.7 60,-3.0 -2,-0.4 2,-0.5 -0.897 31.8-135.4-134.9 162.8 -24.3 0.8 -35.0 58 99 A R E -JI 75 116E 20 17,-2.8 17,-2.7 -2,-0.3 2,-0.6 -0.985 14.9-147.7-117.7 124.9 -26.6 0.6 -38.0 59 100 A K E -JI 74 115E 35 56,-2.9 56,-2.2 -2,-0.5 2,-0.5 -0.820 19.7-175.2 -90.0 125.6 -30.3 0.9 -37.5 60 101 A I E -JI 73 114E 0 13,-2.6 13,-2.9 -2,-0.6 2,-0.5 -0.986 8.3-167.2-124.8 123.9 -32.2 -1.2 -40.0 61 102 A V E -JI 72 113E 11 52,-2.6 51,-2.9 -2,-0.5 52,-1.3 -0.935 7.0-169.1-110.4 128.3 -36.0 -1.1 -40.3 62 103 A V E -JI 71 111E 0 9,-2.8 9,-2.3 -2,-0.5 2,-0.4 -0.900 1.4-169.4-118.9 144.3 -37.6 -3.8 -42.3 63 104 A E E -JI 70 110E 9 47,-2.4 47,-2.3 -2,-0.4 7,-0.2 -0.995 24.9-115.2-136.1 136.6 -41.3 -3.9 -43.4 64 105 A T > - 0 0 16 5,-2.4 3,-1.4 -2,-0.4 45,-0.2 -0.292 34.2-110.8 -63.7 154.8 -43.4 -6.7 -45.0 65 106 A I T 3 S+ 0 0 116 43,-0.4 -1,-0.1 1,-0.3 44,-0.1 0.877 121.4 50.2 -56.8 -37.0 -44.7 -6.0 -48.5 66 107 A D T 3 S- 0 0 89 1,-0.1 -1,-0.3 3,-0.0 -2,-0.1 0.597 108.5-130.0 -79.3 -8.9 -48.3 -5.7 -47.2 67 108 A R S < S+ 0 0 113 -3,-1.4 -2,-0.1 2,-0.2 -1,-0.1 0.536 73.5 121.8 74.1 8.5 -47.0 -3.3 -44.6 68 109 A K S S+ 0 0 146 1,-0.1 2,-0.4 -5,-0.0 -1,-0.1 0.846 73.0 33.8 -66.8 -34.1 -48.7 -5.1 -41.8 69 110 A Y + 0 0 148 2,-0.0 -5,-2.4 0, 0.0 2,-0.3 -0.953 58.4 179.5-130.9 144.6 -45.4 -5.7 -39.9 70 111 A T E -J 63 0E 51 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.953 7.3-163.6-132.6 156.1 -42.1 -4.0 -39.2 71 112 A K E -J 62 0E 84 -9,-2.3 -9,-2.8 -2,-0.3 2,-0.5 -0.992 7.6-152.4-135.3 145.4 -39.0 -4.9 -37.2 72 113 A T E -J 61 0E 31 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.979 12.3-170.3-119.8 127.4 -36.2 -2.5 -36.2 73 114 A Y E -J 60 0E 20 -13,-2.9 -13,-2.6 -2,-0.5 2,-0.7 -0.940 15.4-158.0-118.4 137.2 -32.7 -3.8 -35.6 74 115 A Y E -J 59 0E 25 -2,-0.4 -15,-0.2 -15,-0.2 -2,-0.0 -0.931 23.9-174.8-112.0 106.2 -29.7 -2.0 -34.1 75 116 A I E -J 58 0E 0 -17,-2.7 -17,-2.8 -2,-0.7 5,-0.1 -0.901 25.5-123.1-111.1 124.7 -26.7 -3.9 -35.4 76 117 A P E > -J 57 0E 24 0, 0.0 3,-1.8 0, 0.0 4,-0.3 -0.361 19.2-131.5 -58.6 135.4 -23.1 -3.1 -34.2 77 118 A E G > S+ 0 0 53 -21,-2.4 3,-1.8 1,-0.3 4,-0.4 0.811 106.2 68.1 -60.5 -27.6 -20.9 -2.3 -37.3 78 119 A S G 3 S+ 0 0 107 -22,-0.5 -1,-0.3 1,-0.3 -21,-0.1 0.731 85.9 67.0 -66.2 -19.4 -18.5 -4.8 -35.9 79 120 A A G < S- 0 0 6 -3,-1.8 21,-2.1 20,-0.1 -1,-0.3 0.643 117.4-109.7 -75.2 -13.2 -20.9 -7.6 -36.6 80 121 A G < - 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