==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 04-JAN-11 2Y3Y . COMPND 2 MOLECULE: PUTATIVE NICKEL-RESPONSIVE REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI G27; . AUTHOR S.BENINI,M.CIANCI,S.CIURLI . 339 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15756.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 287 84.7 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 . 131 38.6 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 . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 . 42 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 24.5 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 1 0 0 0 4 3 1 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 2 0 0 0 4 2 5 1 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 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 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 60 A N 0 0 99 0, 0.0 56,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-166.8 21.9 42.0 35.9 2 61 A D + 0 0 139 54,-0.1 2,-0.1 57,-0.0 55,-0.0 0.180 360.0 111.6-130.2 -26.6 18.7 41.4 34.0 3 62 A E - 0 0 89 1,-0.1 55,-0.5 54,-0.0 2,-0.4 -0.195 68.2-130.0 -55.3 113.8 20.3 39.3 31.2 4 63 A S E +A 57 0A 103 53,-0.2 2,-0.3 -3,-0.1 53,-0.2 -0.561 35.9 173.5 -74.4 121.8 19.2 35.6 31.4 5 64 A K E -A 56 0A 69 51,-2.3 51,-2.3 -2,-0.4 2,-0.4 -0.865 29.4-136.3-133.5 155.1 22.0 33.0 31.3 6 65 A I E +A 55 0A 11 -2,-0.3 76,-2.2 49,-0.2 77,-0.7 -0.900 30.6 170.3-106.3 144.1 22.9 29.4 31.6 7 66 A A E -AB 54 81A 3 47,-3.1 47,-3.1 -2,-0.4 2,-0.4 -0.994 26.8-138.8-147.6 160.2 25.9 28.1 33.5 8 67 A V E -AB 53 80A 2 72,-2.8 72,-3.3 -2,-0.3 2,-0.5 -0.978 10.3-161.4-122.7 131.6 27.6 25.0 34.9 9 68 A L E -AB 52 79A 0 43,-2.5 43,-3.2 -2,-0.4 2,-0.6 -0.944 10.3-157.8-109.4 122.8 29.3 24.9 38.4 10 69 A V E -AB 51 78A 0 68,-2.6 68,-2.6 -2,-0.5 2,-0.4 -0.923 15.7-173.5-107.7 126.2 31.7 22.0 38.7 11 70 A V E -AB 50 77A 0 39,-3.2 39,-2.2 -2,-0.6 2,-0.4 -0.919 19.6-169.7-126.1 139.5 32.4 20.9 42.2 12 71 A I E +AB 49 76A 3 64,-3.0 63,-1.9 -2,-0.4 64,-1.9 -1.000 27.9 145.8-125.0 133.4 34.7 18.5 44.0 13 72 A Y E -AB 48 74A 0 35,-1.8 35,-3.2 -2,-0.4 2,-0.6 -0.926 47.8-108.4-154.4 170.5 34.2 17.8 47.6 14 73 A D > - 0 0 30 59,-1.4 3,-1.0 -2,-0.3 6,-0.1 -0.951 17.1-154.2-109.0 121.5 34.4 15.1 50.2 15 74 A H T 3 S+ 0 0 0 -2,-0.6 6,-0.3 1,-0.2 5,-0.1 0.623 89.0 72.9 -76.6 -7.8 31.1 13.8 51.3 16 75 A H T 3 + 0 0 81 29,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.811 69.5 111.9 -71.4 -26.6 32.6 12.7 54.7 17 76 A Q S X S- 0 0 40 -3,-1.0 3,-1.6 56,-0.1 4,-0.5 -0.185 85.5-103.5 -44.5 119.3 32.8 16.4 55.6 18 77 A R T 3 S- 0 0 192 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.264 93.4 -10.7 -55.6 124.2 30.3 16.9 58.4 19 78 A E T 3> S+ 0 0 54 -4,-0.1 4,-2.0 -3,-0.1 -1,-0.2 0.488 95.5 122.2 69.4 8.6 27.0 18.5 57.2 20 79 A L H <> S+ 0 0 3 -3,-1.6 4,-2.9 1,-0.2 5,-0.2 0.943 74.3 47.3 -68.6 -48.2 28.4 19.5 53.7 21 80 A N H > S+ 0 0 1 -4,-0.5 4,-2.3 -6,-0.3 5,-0.3 0.899 109.6 54.6 -61.6 -39.7 25.8 17.7 51.7 22 81 A Q H > S+ 0 0 13 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.941 111.9 44.5 -60.2 -48.7 23.0 19.1 53.9 23 82 A R H X S+ 0 0 138 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.920 112.4 49.5 -57.4 -53.9 24.3 22.7 53.2 24 83 A M H X S+ 0 0 1 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.932 115.8 42.9 -54.9 -47.2 24.8 22.3 49.4 25 84 A I H X S+ 0 0 6 -4,-2.3 4,-3.4 -5,-0.2 5,-0.2 0.867 113.1 51.8 -71.6 -37.5 21.4 20.8 48.9 26 85 A D H X S+ 0 0 59 -4,-2.3 4,-2.7 -5,-0.3 -1,-0.2 0.942 109.2 51.4 -65.2 -45.3 19.6 23.3 51.2 27 86 A I H X S+ 0 0 30 -4,-2.9 4,-0.9 2,-0.2 -2,-0.2 0.953 113.9 44.0 -50.9 -46.0 21.3 26.1 49.3 28 87 A Q H >< S+ 0 0 2 -4,-2.0 3,-0.6 1,-0.2 7,-0.3 0.901 113.8 49.1 -74.0 -38.7 20.0 24.6 45.9 29 88 A H H >< S+ 0 0 26 -4,-3.4 3,-0.8 1,-0.2 -1,-0.2 0.909 111.4 49.2 -65.7 -38.8 16.5 23.9 47.2 30 89 A A H 3< S+ 0 0 91 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.647 96.0 76.2 -72.7 -13.5 16.2 27.5 48.7 31 90 A S T X< S- 0 0 27 -4,-0.9 3,-1.7 -3,-0.6 -1,-0.2 0.108 86.5-147.4 -86.8 20.0 17.4 29.0 45.3 32 91 A G G X - 0 0 59 -3,-0.8 3,-0.7 1,-0.2 -1,-0.2 -0.172 68.6 -12.0 56.9-129.1 14.0 28.5 43.3 33 92 A T G 3 S+ 0 0 105 1,-0.2 -1,-0.2 21,-0.0 22,-0.1 0.431 109.0 98.9 -90.5 -0.0 14.4 27.8 39.6 34 93 A H G < S+ 0 0 40 -3,-1.7 21,-2.8 20,-0.1 2,-0.6 0.770 75.8 62.0 -53.0 -28.3 18.1 28.8 39.6 35 94 A V E < +C 54 0A 15 -3,-0.7 19,-0.3 -7,-0.3 91,-0.2 -0.893 56.3 178.1-110.6 117.8 19.2 25.2 39.7 36 95 A L E - 0 0 48 17,-2.4 2,-0.3 -2,-0.6 90,-0.2 0.953 62.8 -44.1 -81.8 -52.7 18.2 22.9 36.8 37 96 A C E -C 53 0A 1 16,-0.7 16,-3.1 88,-0.1 -1,-0.4 -0.952 45.2-130.8-167.6 167.9 19.8 19.7 37.9 38 97 A T E -CD 52 124A 5 86,-1.6 86,-2.4 -2,-0.3 2,-0.4 -0.984 10.7-155.7-128.4 141.4 23.0 18.1 39.4 39 98 A T E -CD 51 123A 0 12,-2.1 12,-2.4 -2,-0.3 2,-0.4 -0.980 16.5-156.5-118.3 134.7 24.9 15.1 38.1 40 99 A H E -CD 50 122A 5 82,-3.6 82,-1.8 -2,-0.4 2,-0.5 -0.915 12.1-168.4-120.0 135.5 27.1 13.3 40.6 41 100 A I E -C 49 0A 7 8,-3.5 8,-2.9 -2,-0.4 2,-1.2 -0.970 17.0-146.0-125.8 118.7 30.1 11.1 40.2 42 101 A H E +C 48 0A 31 -2,-0.5 6,-0.2 77,-0.3 77,-0.1 -0.713 25.9 175.9 -80.7 97.7 31.4 9.1 43.1 43 102 A M E - 0 0 56 4,-1.9 2,-0.2 -2,-1.2 -1,-0.2 0.979 55.4 -39.6 -74.5 -60.5 35.1 9.3 42.3 44 103 A D E > S-C 47 0A 66 3,-1.2 3,-1.5 0, 0.0 -1,-0.2 -0.783 83.0 -60.1-147.7-164.3 36.7 7.5 45.2 45 104 A E T 3 S+ 0 0 131 1,-0.3 -30,-0.1 -2,-0.2 -29,-0.1 0.768 133.5 25.9 -59.7 -34.5 36.2 7.2 49.0 46 105 A H T 3 S+ 0 0 88 -32,-0.1 2,-0.4 1,-0.1 -1,-0.3 0.117 109.8 75.9-121.5 26.3 36.8 10.9 49.6 47 106 A N E < + C 0 44A 30 -3,-1.5 -4,-1.9 -33,-0.1 -3,-1.2 -0.955 42.0 174.7-142.5 125.9 35.8 12.6 46.3 48 107 A C E -AC 13 42A 0 -35,-3.2 -35,-1.8 -2,-0.4 2,-0.4 -0.967 16.1-154.7-113.0 140.0 32.6 13.4 44.8 49 108 A L E -AC 12 41A 0 -8,-2.9 -8,-3.5 -2,-0.4 2,-0.4 -0.970 14.6-175.3-111.5 136.9 32.3 15.4 41.5 50 109 A E E -AC 11 40A 10 -39,-2.2 -39,-3.2 -2,-0.4 2,-0.6 -0.990 18.8-158.6-126.6 135.7 29.1 17.3 40.8 51 110 A T E -AC 10 39A 0 -12,-2.4 -12,-2.1 -2,-0.4 2,-0.6 -0.981 16.6-166.0-109.5 117.8 28.1 19.3 37.8 52 111 A I E -AC 9 38A 0 -43,-3.2 -43,-2.5 -2,-0.6 2,-0.4 -0.926 9.6-146.8-110.3 112.9 25.4 21.7 38.9 53 112 A I E -AC 8 37A 1 -16,-3.1 -17,-2.4 -2,-0.6 -16,-0.7 -0.725 23.4-174.7 -86.9 135.1 23.4 23.3 36.0 54 113 A L E -AC 7 35A 0 -47,-3.1 -47,-3.1 -2,-0.4 2,-0.4 -0.918 14.2-170.1-135.3 153.7 22.3 26.8 36.8 55 114 A Q E +A 6 0A 71 -21,-2.8 2,-0.3 -2,-0.3 -49,-0.2 -0.985 37.6 75.7-148.6 141.2 20.3 29.5 35.2 56 115 A G E S-A 5 0A 10 -51,-2.3 -51,-2.3 -2,-0.4 2,-0.1 -0.911 79.4 -34.7 147.1-168.2 19.6 33.2 35.9 57 116 A N E > -A 4 0A 20 -2,-0.3 4,-2.4 -53,-0.2 5,-0.2 -0.376 63.5-101.4 -79.8 166.8 21.4 36.5 35.5 58 117 A S H > S+ 0 0 40 -55,-0.5 4,-1.9 1,-0.2 5,-0.1 0.770 120.7 49.0 -56.4 -31.1 25.1 36.8 36.0 59 118 A F H > S+ 0 0 117 2,-0.2 4,-2.1 3,-0.1 -1,-0.2 0.955 110.0 48.0 -79.3 -51.5 24.8 38.2 39.5 60 119 A E H > S+ 0 0 76 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.906 115.5 49.5 -49.5 -41.0 22.3 35.5 40.9 61 120 A I H X S+ 0 0 7 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.889 108.4 47.5 -74.3 -45.4 24.6 32.9 39.4 62 121 A Q H X S+ 0 0 59 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.855 111.7 54.8 -65.4 -29.1 28.0 34.2 40.7 63 122 A R H X S+ 0 0 144 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.906 107.4 47.5 -70.5 -36.1 26.2 34.4 44.1 64 123 A L H X S+ 0 0 12 -4,-2.0 4,-2.4 1,-0.2 5,-0.3 0.917 110.9 54.1 -64.0 -41.3 25.2 30.8 44.0 65 124 A Q H X S+ 0 0 32 -4,-2.4 4,-3.5 1,-0.2 -2,-0.2 0.929 108.9 45.9 -56.7 -53.5 28.6 30.0 43.0 66 125 A L H X S+ 0 0 103 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.872 111.5 53.6 -62.3 -39.5 30.2 31.8 46.0 67 126 A E H >X S+ 0 0 119 -4,-2.3 4,-0.6 2,-0.2 3,-0.5 0.974 119.8 31.1 -54.6 -60.1 27.7 30.2 48.4 68 127 A I H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.938 119.2 55.7 -67.2 -45.3 28.3 26.6 47.3 69 128 A G H 3< S+ 0 0 25 -4,-3.5 -1,-0.2 -5,-0.3 -2,-0.2 0.586 105.6 51.1 -66.5 -16.0 32.0 27.2 46.5 70 129 A G H << S+ 0 0 63 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.595 80.6 116.9 -95.7 -13.7 32.9 28.6 49.9 71 130 A L S X< S- 0 0 29 -3,-1.2 3,-1.4 -4,-0.6 2,-0.2 -0.182 76.8 -97.2 -58.9 146.9 31.5 25.8 52.0 72 131 A R T 3 S+ 0 0 193 1,-0.2 -1,-0.1 -59,-0.0 3,-0.1 -0.490 108.7 28.5 -67.0 133.8 34.0 23.8 54.1 73 132 A G T 3 S+ 0 0 23 1,-0.3 -59,-1.4 -2,-0.2 2,-0.8 0.426 83.1 129.7 89.6 3.4 35.2 20.6 52.5 74 133 A V E < -B 13 0A 25 -3,-1.4 -1,-0.3 -61,-0.2 -61,-0.3 -0.838 33.4-178.1 -82.5 115.8 34.7 21.9 49.0 75 134 A K E + 0 0 113 -63,-1.9 2,-0.3 -2,-0.8 -62,-0.2 0.826 66.3 11.8 -78.1 -35.0 38.0 21.2 47.3 76 135 A F E +B 12 0A 60 -64,-1.9 -64,-3.0 2,-0.0 -1,-0.3 -0.991 56.1 174.1-155.4 131.3 37.2 22.7 43.9 77 136 A A E +B 11 0A 25 -2,-0.3 2,-0.5 -66,-0.2 -66,-0.2 -0.695 12.3 171.4-143.2 90.2 34.4 24.9 42.6 78 137 A K E -B 10 0A 79 -68,-2.6 -68,-2.6 -2,-0.2 2,-0.3 -0.858 19.9-146.6-119.0 129.1 34.6 26.3 39.0 79 138 A L E -B 9 0A 11 -2,-0.5 2,-0.5 -70,-0.2 -70,-0.2 -0.625 4.0-163.5 -80.6 131.3 31.9 28.2 37.1 80 139 A T E -B 8 0A 4 -72,-3.3 -72,-2.8 -2,-0.3 2,-0.5 -0.982 13.7-156.7-111.5 117.9 31.6 27.8 33.3 81 140 A K E +B 7 0A 123 -2,-0.5 -74,-0.2 -74,-0.2 -2,-0.0 -0.831 24.7 157.7 -96.8 125.1 29.4 30.7 32.1 82 141 A A 0 0 23 -76,-2.2 -75,-0.2 -2,-0.5 -1,-0.1 0.868 360.0 360.0-114.7 -79.1 27.7 29.9 28.8 83 142 A S 0 0 77 -77,-0.7 -76,-0.1 0, 0.0 -1,-0.1 -0.200 360.0 360.0 99.0 360.0 24.5 31.7 27.3 84 !* 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 85 60 B N 0 0 189 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-179.9 28.8 -16.7 32.0 86 61 B D - 0 0 130 1,-0.1 2,-0.4 55,-0.0 55,-0.0 -0.606 360.0-150.7 -74.8 137.7 29.7 -13.8 34.3 87 62 B E + 0 0 142 -2,-0.3 2,-0.4 2,-0.0 55,-0.3 -0.579 27.0 165.0-130.1 59.0 26.8 -11.3 34.5 88 63 B S - 0 0 87 -2,-0.4 2,-0.2 53,-0.1 53,-0.2 -0.717 27.4-179.8 -74.6 129.0 27.5 -7.6 35.1 89 64 B K E -E 140 0A 57 51,-2.9 51,-2.0 -2,-0.4 2,-0.4 -0.804 25.5-109.0-134.6 163.1 24.2 -5.8 34.1 90 65 B I E +E 139 0A 13 -2,-0.2 76,-2.7 49,-0.2 2,-0.3 -0.809 34.7 168.5-103.4 135.2 22.6 -2.2 34.0 91 66 B A E -EF 138 165A 0 47,-2.4 47,-3.3 -2,-0.4 2,-0.5 -0.998 26.3-142.6-143.2 155.8 19.9 -0.8 36.1 92 67 B V E -EF 137 164A 0 72,-3.1 72,-3.8 -2,-0.3 2,-0.6 -0.956 12.4-164.5-115.6 119.2 18.2 2.4 37.0 93 68 B L E -EF 136 163A 1 43,-3.2 43,-3.1 -2,-0.5 2,-0.5 -0.885 8.1-160.2-102.7 123.8 17.1 3.1 40.5 94 69 B V E -EF 135 162A 1 68,-2.9 68,-0.8 -2,-0.6 2,-0.4 -0.916 12.7-176.4-111.0 132.3 14.6 5.9 40.9 95 70 B V E -EF 134 161A 0 39,-2.3 39,-2.6 -2,-0.5 2,-0.4 -0.995 19.1-168.4-140.0 130.5 14.3 7.6 44.3 96 71 B I E +EF 133 160A 12 64,-1.6 63,-3.3 -2,-0.4 64,-1.2 -0.980 28.8 162.2-111.6 125.9 12.0 10.3 45.8 97 72 B Y E -EF 132 158A 0 35,-2.6 35,-2.1 -2,-0.4 2,-0.6 -0.968 43.7-108.2-148.3 165.4 13.1 11.6 49.1 98 73 B D > - 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