==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 15-MAY-07 2Z1T . COMPND 2 MOLECULE: HYDROGENASE EXPRESSION/FORMATION PROTEIN HYPE; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO VULGARIS SUBSP. VULGARIS . AUTHOR Y.SHOMURA,Y.HIGUCHI . 321 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14426.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 217 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 22 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 24.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.2 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 1 0 0 0 2 1 0 1 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 0 0 0 0 1 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 1 1 3 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 0 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 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 21 A I 0 0 209 0, 0.0 2,-1.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -58.3 25.2 4.9 2.7 2 22 A S + 0 0 23 1,-0.1 3,-0.2 2,-0.1 0, 0.0 -0.685 360.0 145.3 -87.9 91.5 24.1 6.8 -0.4 3 23 A D + 0 0 87 -2,-1.2 4,-0.3 1,-0.1 3,-0.2 -0.242 29.4 113.8-128.8 47.8 27.0 9.0 -1.4 4 24 A L > + 0 0 15 1,-0.1 4,-0.7 2,-0.1 5,-0.2 0.384 64.4 90.1 -69.7 -7.5 26.9 9.1 -5.1 5 25 A F H >> S+ 0 0 28 2,-0.2 4,-3.5 1,-0.2 3,-0.7 0.927 90.5 35.1 -61.3 -50.1 26.1 12.7 -4.1 6 26 A L H 3> S+ 0 0 96 -3,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.732 112.9 63.0 -74.6 -23.7 29.7 13.9 -4.1 7 27 A R H 34 S+ 0 0 211 -4,-0.3 -1,-0.2 1,-0.1 -2,-0.2 0.621 124.2 16.1 -71.9 -13.5 30.2 11.5 -7.1 8 28 A H H << S+ 0 0 38 -3,-0.7 -2,-0.2 -4,-0.7 -3,-0.2 0.598 137.7 31.2-129.4 -26.0 27.7 13.6 -9.1 9 29 A F H < S+ 0 0 18 -4,-3.5 -3,-0.2 -5,-0.2 94,-0.2 0.562 77.4 158.9-108.5 -15.0 27.2 17.0 -7.3 10 30 A D < + 0 0 119 -4,-0.6 -4,-0.1 -5,-0.4 94,-0.0 0.314 7.5 134.7 -36.5 127.4 30.7 17.6 -5.7 11 31 A N > - 0 0 13 93,-0.1 4,-2.9 92,-0.1 3,-0.3 -0.931 63.6-105.4-162.3 159.7 31.7 21.2 -4.7 12 32 A P T 4 S+ 0 0 117 0, 0.0 -2,-0.1 0, 0.0 92,-0.0 0.707 116.7 58.3 -70.5 -19.8 33.3 22.7 -1.5 13 33 A I T 4 S+ 0 0 44 2,-0.1 3,-0.5 1,-0.1 9,-0.2 0.893 116.9 32.9 -70.7 -45.0 30.0 24.2 -0.3 14 34 A L T >4 S+ 0 0 24 -3,-0.3 3,-1.6 1,-0.2 -1,-0.1 0.864 112.6 63.6 -73.5 -39.3 28.2 20.8 -0.3 15 35 A G T 3< S+ 0 0 62 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.1 0.075 85.8 73.2 -81.7 24.8 31.4 18.9 0.7 16 36 A T T 3 S- 0 0 85 -3,-0.5 -1,-0.3 -5,-0.1 -2,-0.1 0.571 86.1-155.9-105.1 -24.5 31.7 20.7 4.0 17 37 A L < + 0 0 141 -3,-1.6 2,-0.2 -4,-0.2 -2,-0.1 0.771 34.0 143.8 52.0 48.6 28.7 18.6 5.3 18 38 A N - 0 0 120 2,-0.3 -1,-0.2 -4,-0.1 -2,-0.1 -0.481 69.5 -89.1 -95.5 173.9 27.3 20.8 8.1 19 39 A D S S+ 0 0 175 -2,-0.2 2,-0.3 1,-0.1 -2,-0.1 0.757 113.2 18.2 -53.8 -29.9 23.6 21.4 9.2 20 40 A A S S- 0 0 70 85,-0.0 2,-0.3 84,-0.0 -2,-0.3 -0.980 78.0-121.8-142.3 156.6 23.5 24.3 6.7 21 41 A A - 0 0 26 -2,-0.3 2,-0.4 -4,-0.1 -7,-0.1 -0.782 25.2-125.8 -98.7 141.0 25.5 25.5 3.6 22 42 A R - 0 0 194 -2,-0.3 2,-0.4 -9,-0.2 -1,-0.0 -0.719 28.4-170.5 -88.3 136.5 27.1 28.9 3.4 23 43 A L - 0 0 63 -2,-0.4 2,-0.7 2,-0.1 46,-0.0 -0.966 19.4-149.5-129.6 137.9 26.2 31.1 0.5 24 44 A D + 0 0 106 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.896 37.5 155.4-107.4 102.3 27.6 34.3 -0.8 25 45 A L - 0 0 45 -2,-0.7 2,-0.8 102,-0.0 4,-0.1 -0.981 41.2-115.4-135.0 144.4 24.8 36.3 -2.5 26 46 A T - 0 0 98 -2,-0.3 103,-0.3 2,-0.1 -2,-0.0 -0.666 48.0 -89.5 -80.9 105.1 23.9 39.9 -3.3 27 47 A G S S+ 0 0 66 -2,-0.8 2,-0.5 101,-0.1 -2,-0.0 -0.011 102.6 54.7 56.0-108.8 20.9 41.5 -1.7 28 48 A P S S+ 0 0 92 0, 0.0 101,-2.5 0, 0.0 2,-0.3 -0.573 73.3 174.9 -76.8 122.2 17.6 41.1 -3.6 29 49 A L E -A 128 0A 67 -2,-0.5 2,-0.4 99,-0.2 99,-0.3 -0.856 29.1-134.5-127.5 157.5 17.1 37.4 -4.2 30 50 A A E -A 127 0A 3 97,-2.4 97,-2.0 -2,-0.3 2,-0.4 -0.907 22.2-169.4-110.9 138.4 14.5 35.1 -5.7 31 51 A M E +A 126 0A 142 -2,-0.4 2,-0.3 95,-0.2 95,-0.2 -0.986 9.0 169.0-131.1 138.2 13.5 31.9 -3.8 32 52 A S E -A 125 0A 20 93,-1.9 93,-2.8 -2,-0.4 2,-0.3 -0.996 12.8-163.0-148.6 149.2 11.4 29.0 -5.0 33 53 A T E +A 124 0A 82 -2,-0.3 2,-0.3 91,-0.2 91,-0.2 -0.983 10.2 172.4-134.5 146.2 10.5 25.4 -3.9 34 54 A D E -A 123 0A 52 89,-2.4 89,-2.7 -2,-0.3 2,-0.3 -0.994 19.5-147.6-149.8 144.5 9.0 22.4 -5.7 35 55 A S E -A 122 0A 71 -2,-0.3 2,-0.5 87,-0.2 87,-0.3 -0.846 16.5-146.1-109.8 151.3 8.3 18.8 -5.0 36 56 A Y E +A 121 0A 4 85,-2.5 85,-1.6 -2,-0.3 12,-0.0 -0.974 30.9 156.0-127.4 119.0 8.5 16.3 -7.7 37 57 A T + 0 0 45 284,-1.6 -1,-0.1 -2,-0.5 82,-0.1 0.232 19.9 160.9-124.9 8.3 6.2 13.3 -7.7 38 58 A V - 0 0 0 282,-0.1 282,-0.2 10,-0.1 281,-0.1 0.051 34.5-126.7 -42.1 137.5 6.1 12.4 -11.4 39 59 A D S S+ 0 0 41 280,-2.5 2,-0.2 279,-0.2 124,-0.2 -0.972 89.7 34.0-135.8 117.8 4.9 8.8 -12.2 40 60 A P S S- 0 0 31 0, 0.0 3,-0.1 0, 0.0 123,-0.1 0.472 80.0-146.4 -78.6-175.5 6.6 7.0 -13.9 41 61 A I S S+ 0 0 7 1,-0.2 7,-1.5 -2,-0.2 2,-0.4 0.797 82.0 43.7 -97.1 -33.3 10.2 8.1 -12.9 42 62 A F E +D 47 0B 52 5,-0.2 5,-0.2 6,-0.1 -1,-0.2 -0.962 69.9 154.0-113.8 135.5 11.9 7.6 -16.3 43 63 A F E > -D 46 0B 16 3,-1.9 3,-1.8 -2,-0.4 2,-0.1 -0.941 53.3 -66.5-149.2 163.1 10.2 8.7 -19.5 44 64 A P T 3 S+ 0 0 53 0, 0.0 130,-2.1 0, 0.0 118,-0.1 -0.391 119.2 12.5 -57.2 124.3 11.3 9.8 -23.0 45 65 A G T 3 S- 0 0 52 128,-0.2 2,-0.3 -2,-0.1 131,-0.1 0.406 128.0 -5.6 92.3 -0.7 13.2 13.1 -22.8 46 66 A G E < -D 43 0B 14 -3,-1.8 -3,-1.9 129,-0.1 2,-0.3 -0.983 55.6-132.2 172.6-174.8 13.8 13.3 -19.0 47 67 A D E > -D 42 0B 13 -2,-0.3 4,-2.9 -5,-0.2 5,-0.3 -0.941 46.6 -81.3-152.9 175.5 13.3 12.0 -15.5 48 68 A I H > S+ 0 0 0 -7,-1.5 4,-2.9 -2,-0.3 5,-0.1 0.846 130.8 51.7 -49.2 -38.8 12.4 13.1 -11.9 49 69 A G H > S+ 0 0 0 -8,-0.2 4,-2.2 2,-0.2 5,-0.3 0.954 110.2 50.0 -60.5 -49.3 16.1 14.2 -11.5 50 70 A T H > S+ 0 0 19 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.945 114.8 40.9 -54.2 -56.2 15.7 16.2 -14.7 51 71 A L H X>S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.6 0.939 110.0 61.6 -56.6 -47.6 12.4 17.9 -13.6 52 72 A A H <5S+ 0 0 0 -4,-2.9 4,-0.5 -5,-0.3 -1,-0.2 0.846 116.4 28.6 -53.4 -42.9 13.8 18.4 -10.1 53 73 A V H X5S+ 0 0 0 -4,-2.2 4,-2.6 -3,-0.2 3,-0.5 0.961 124.4 45.6 -78.4 -58.5 16.7 20.5 -11.3 54 74 A H H X5S+ 0 0 12 -4,-2.5 4,-2.6 -5,-0.3 125,-0.3 0.910 112.0 49.5 -56.1 -50.9 15.2 22.1 -14.4 55 75 A G H X5S+ 0 0 1 -4,-3.0 4,-2.4 -5,-0.3 -1,-0.2 0.815 114.1 45.3 -63.5 -30.5 11.8 23.1 -13.0 56 76 A T H >< S+ 0 0 1 -4,-1.9 3,-1.8 1,-0.2 5,-0.3 0.952 109.1 52.8 -70.0 -47.9 13.7 31.0 -9.8 61 81 A S H >X S+ 0 0 0 -4,-2.2 3,-2.5 1,-0.3 4,-0.7 0.791 89.3 79.4 -57.6 -31.2 14.3 32.7 -13.2 62 82 A M T 3< S+ 0 0 13 -4,-2.0 134,-0.4 1,-0.3 -1,-0.3 0.737 87.5 58.7 -56.1 -18.9 10.6 33.7 -13.5 63 83 A L T <4 S- 0 0 76 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.1 0.130 128.8-101.3 -89.1 22.5 11.4 36.5 -11.1 64 84 A G T <4 S+ 0 0 0 -3,-2.5 66,-2.6 1,-0.2 67,-0.6 0.959 81.4 141.8 54.8 49.7 14.0 37.7 -13.7 65 85 A A E < -B 129 0A 1 -4,-0.7 64,-0.3 -5,-0.3 -1,-0.2 -0.861 58.9-123.1-123.9 155.7 16.7 36.2 -11.5 66 86 A R E -B 128 0A 82 62,-3.2 62,-2.1 -2,-0.3 2,-0.2 -0.883 31.0-138.7 -93.8 107.1 19.9 34.3 -12.0 67 87 A P E +B 127 0A 4 0, 0.0 60,-0.3 0, 0.0 3,-0.1 -0.481 34.2 160.7 -66.8 132.6 19.7 30.9 -10.1 68 88 A R E + 0 0 74 58,-2.9 34,-2.4 1,-0.3 2,-0.4 0.734 54.9 35.0-118.4 -45.5 22.9 30.1 -8.3 69 89 A Y E -Bc 126 102A 25 57,-2.4 57,-2.5 32,-0.2 2,-0.4 -0.939 51.3-172.1-131.8 136.9 22.1 27.5 -5.6 70 90 A L E -Bc 125 103A 1 32,-2.7 34,-2.6 -2,-0.4 35,-0.7 -0.909 6.7-161.6-117.7 144.0 19.8 24.5 -5.2 71 91 A S E -Bc 124 105A 33 53,-2.3 53,-1.8 -2,-0.4 2,-0.4 -0.857 17.3-155.3-111.6 158.2 19.2 22.5 -2.1 72 92 A C E -Bc 123 106A 9 33,-1.9 35,-1.5 -2,-0.3 2,-0.4 -0.992 16.3-168.4-150.8 145.9 17.6 19.1 -2.4 73 93 A G E -Bc 122 107A 19 49,-3.1 49,-2.0 -2,-0.4 2,-0.3 -0.895 9.3-161.5-137.1 105.5 15.6 16.6 -0.3 74 94 A F E -Bc 121 108A 3 33,-1.7 35,-2.9 -2,-0.4 2,-0.5 -0.632 8.2-167.9 -85.7 137.1 14.9 13.0 -1.2 75 95 A I E -Bc 120 109A 74 45,-2.8 45,-2.4 -2,-0.3 2,-0.3 -0.984 25.5-175.6-117.0 114.0 12.2 10.8 0.2 76 96 A L E -Bc 119 110A 12 33,-2.6 35,-2.3 -2,-0.5 2,-0.3 -0.852 24.5-118.6-116.0 148.3 13.0 7.3 -0.8 77 97 A E E > - 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0 0 5 -5,-2.6 2,-0.5 -6,-0.2 -1,-0.3 -0.918 49.0-141.4-127.6 137.9 23.9 25.9 -10.7 102 122 A F E -c 69 0A 104 -34,-2.4 -32,-2.7 -2,-0.4 2,-0.9 -0.878 9.4-142.7-106.9 127.9 25.2 24.2 -7.6 103 123 A I E +c 70 0A 3 -2,-0.5 -32,-0.2 -94,-0.2 -89,-0.2 -0.787 31.7 172.6 -77.3 108.5 23.4 21.8 -5.4 104 124 A V E + 0 0 6 -34,-2.6 2,-0.3 -2,-0.9 -33,-0.2 0.670 52.8 12.8-101.7 -20.8 24.8 23.0 -2.1 105 125 A T E +c 71 0A 42 -35,-0.7 -33,-1.9 -84,-0.1 2,-0.3 -0.972 63.1 169.4-153.7 160.2 22.9 21.2 0.7 106 126 A G E -c 72 0A 46 -2,-0.3 2,-0.3 -35,-0.2 -33,-0.2 -0.891 20.1-146.1-155.5-176.9 20.5 18.3 1.0 107 127 A D E -c 73 0A 86 -35,-1.5 -33,-1.7 -2,-0.3 2,-0.3 -0.934 10.3-157.0-151.4 163.7 18.7 15.8 3.2 108 128 A T E -c 74 0A 46 -2,-0.3 2,-0.4 -35,-0.2 -33,-0.2 -0.887 7.5-175.3-149.3 116.3 17.6 12.2 2.7 109 129 A K E -c 75 0A 115 -35,-2.9 -33,-2.6 -2,-0.3 2,-0.4 -0.912 8.5-158.5-108.2 139.0 14.8 10.4 4.4 110 130 A V E -c 76 0A 95 -2,-0.4 -33,-0.2 -35,-0.2 9,-0.0 -0.948 12.0-167.9-112.7 138.9 14.1 6.6 3.9 111 131 A V E -c 77 0A 36 -35,-2.3 -33,-2.5 -2,-0.4 5,-0.2 -0.931 28.3 -93.5-128.7 149.7 10.6 5.2 4.7 112 132 A P >> - 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