==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 26-MAR-07 2EKZ . COMPND 2 MOLECULE: ALPHA-RIBAZOLE-5'-PHOSPHATE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR Y.ASADA,Y.MATSUURA,N.ONO,T.NAKAMOTO,N.KUNISHIMA,RIKEN STRUCT . 341 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15346.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 244 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 8.8 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 0.6 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-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 . 28 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 2 0 0 0 4 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 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 PARALLEL BRIDGES PER LADDER . 2 0 0 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 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 82 0, 0.0 159,-2.4 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 121.0 32.4 7.3 8.8 2 2 A E E +A 159 0A 80 157,-0.2 126,-0.9 155,-0.1 2,-0.4 -0.513 360.0 172.7 -68.8 116.8 30.2 9.6 6.8 3 3 A L E -Ab 158 128A 1 155,-2.7 155,-2.7 -2,-0.5 2,-0.6 -0.990 22.7-153.2-130.2 133.9 29.4 12.7 9.0 4 4 A W E -Ab 157 129A 39 124,-2.6 126,-4.1 -2,-0.4 2,-0.5 -0.930 12.7-164.6-107.7 116.5 27.6 15.8 8.0 5 5 A L E -Ab 156 130A 0 151,-3.1 151,-2.3 -2,-0.6 2,-0.5 -0.878 3.5-164.6-103.7 130.4 28.6 18.9 10.0 6 6 A V E -Ab 155 131A 0 124,-3.3 126,-3.1 -2,-0.5 2,-0.5 -0.947 13.9-142.1-117.9 130.2 26.3 21.9 9.8 7 7 A R E - b 0 132A 57 147,-2.7 146,-1.4 -2,-0.5 126,-0.2 -0.798 34.7-114.2 -88.7 127.2 27.3 25.4 10.9 8 8 A H - 0 0 13 124,-2.0 145,-1.1 -2,-0.5 146,-0.2 -0.071 39.1 -86.1 -57.0 159.2 24.3 27.1 12.6 9 9 A G - 0 0 0 45,-0.4 22,-0.2 143,-0.3 144,-0.1 -0.090 59.7 -74.6 -61.7 168.5 22.6 30.1 11.0 10 10 A E - 0 0 22 142,-0.2 18,-2.3 20,-0.1 21,-0.3 -0.254 39.1-164.6 -70.4 151.6 23.9 33.6 11.6 11 11 A T >> - 0 0 3 16,-0.3 3,-1.7 -3,-0.1 4,-0.7 -0.682 45.1 -90.5-119.9 174.9 23.4 35.7 14.8 12 12 A L H 3> S+ 0 0 85 14,-0.5 4,-1.9 1,-0.3 3,-0.4 0.835 121.6 66.1 -60.4 -32.1 23.9 39.4 15.1 13 13 A W H 3>>S+ 0 0 55 1,-0.2 5,-2.1 2,-0.2 4,-0.5 0.565 88.3 67.2 -69.3 -7.4 27.5 38.9 16.1 14 14 A N H X45S+ 0 0 70 -3,-1.7 3,-0.5 2,-0.2 -1,-0.2 0.950 109.5 35.2 -74.7 -50.4 28.4 37.5 12.7 15 15 A R H 3<5S+ 0 0 156 -4,-0.7 -2,-0.2 -3,-0.4 -1,-0.1 0.838 119.4 52.4 -70.1 -32.9 27.8 40.9 11.0 16 16 A E H 3<5S- 0 0 91 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.582 106.2-129.6 -79.2 -11.7 29.2 42.7 14.0 17 17 A G T <<5 + 0 0 32 -4,-0.5 68,-2.8 -3,-0.5 69,-0.4 0.926 53.7 145.8 63.8 47.5 32.4 40.6 14.0 18 18 A R B < -F 84 0B 91 -5,-2.1 2,-0.3 66,-0.3 66,-0.2 -0.914 56.4-104.3-116.4 144.0 32.4 39.6 17.7 19 19 A L - 0 0 19 64,-2.7 63,-3.0 -2,-0.4 2,-0.5 -0.506 37.3-168.3 -67.8 126.7 33.6 36.2 19.0 20 20 A L + 0 0 22 -2,-0.3 55,-0.1 61,-0.2 61,-0.1 -0.934 28.2 133.1-122.9 107.0 30.7 34.1 19.9 21 21 A G S S- 0 0 0 -2,-0.5 53,-0.4 57,-0.1 55,-0.2 0.548 81.1 -7.5-114.4 -95.8 31.4 30.9 21.9 22 22 A W S S+ 0 0 93 53,-0.1 2,-0.3 51,-0.1 54,-0.1 0.429 100.4 113.0 -88.2 0.3 29.4 29.9 24.9 23 23 A T S S- 0 0 44 1,-0.1 2,-1.0 29,-0.0 59,-0.1 -0.576 70.5-131.9 -69.8 133.4 27.5 33.2 24.9 24 24 A D + 0 0 83 -2,-0.3 -1,-0.1 29,-0.1 -2,-0.1 -0.736 38.7 161.2 -98.1 95.1 23.9 32.2 24.0 25 25 A L - 0 0 40 -2,-1.0 29,-0.4 1,-0.0 2,-0.1 -0.818 33.8-118.6-110.1 149.5 22.5 34.5 21.2 26 26 A P - 0 0 77 0, 0.0 -14,-0.5 0, 0.0 2,-0.1 -0.352 32.6 -95.3 -82.8 164.4 19.5 33.8 19.0 27 27 A L - 0 0 16 -16,-0.1 -16,-0.3 26,-0.1 2,-0.1 -0.397 38.2-124.9 -72.3 155.0 19.5 33.4 15.2 28 28 A T > - 0 0 16 -18,-2.3 4,-2.0 -2,-0.1 5,-0.2 -0.373 34.8 -94.1 -89.6 178.3 18.6 36.5 13.2 29 29 A A H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 3,-0.1 0.925 131.6 47.4 -59.6 -44.2 15.8 36.4 10.7 30 30 A E H > S+ 0 0 83 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.843 107.4 57.9 -65.5 -33.3 18.3 35.6 7.9 31 31 A G H > S+ 0 0 0 -21,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.877 107.9 45.0 -64.4 -38.3 19.7 32.9 10.2 32 32 A E H X S+ 0 0 55 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.858 111.5 54.5 -72.3 -33.9 16.4 31.2 10.4 33 33 A A H X S+ 0 0 23 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.934 108.0 48.5 -63.3 -45.4 16.1 31.7 6.6 34 34 A Q H X S+ 0 0 29 -4,-2.9 4,-0.6 1,-0.2 -2,-0.2 0.915 110.9 51.9 -60.6 -42.4 19.4 29.9 6.2 35 35 A A H >X S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.2 4,-0.5 0.907 106.4 52.3 -62.0 -44.2 18.3 27.1 8.4 36 36 A R H >< S+ 0 0 127 -4,-2.4 3,-1.2 1,-0.3 -1,-0.2 0.865 101.3 61.5 -62.2 -34.9 15.0 26.5 6.6 37 37 A R H 3< S+ 0 0 91 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.699 94.8 64.2 -65.4 -16.7 16.9 26.2 3.3 38 38 A L H XX S+ 0 0 0 -3,-1.3 3,-2.5 -4,-0.6 4,-0.8 0.744 75.8 103.9 -78.5 -23.5 18.7 23.2 4.7 39 39 A K T << S+ 0 0 145 -3,-1.2 24,-0.1 -4,-0.5 23,-0.1 -0.399 93.4 13.0 -61.3 127.8 15.5 21.2 5.0 40 40 A G T 34 S+ 0 0 82 22,-0.4 -1,-0.3 2,-0.3 -2,-0.1 0.416 115.5 79.9 85.4 -3.0 15.5 18.6 2.2 41 41 A A T <4 S+ 0 0 35 -3,-2.5 -2,-0.2 21,-0.2 -3,-0.1 0.480 82.2 67.9-110.8 -9.8 19.2 19.3 1.5 42 42 A L S < S- 0 0 16 -4,-0.8 -2,-0.3 20,-0.2 87,-0.0 -0.852 91.4-101.9-111.6 148.2 20.6 17.2 4.3 43 43 A P - 0 0 33 0, 0.0 2,-2.1 0, 0.0 -2,-0.1 -0.315 33.7-110.5 -67.0 151.2 20.4 13.4 4.5 44 44 A S + 0 0 125 -4,-0.1 3,-0.1 84,-0.0 20,-0.0 -0.413 69.6 137.7 -81.6 64.7 17.8 11.8 6.8 45 45 A L - 0 0 45 -2,-2.1 83,-0.2 1,-0.1 84,-0.1 -0.608 66.7 -74.8-105.3 166.5 20.4 10.5 9.3 46 46 A P - 0 0 79 0, 0.0 83,-2.4 0, 0.0 2,-0.4 -0.330 57.2-138.6 -57.9 144.3 20.3 10.5 13.1 47 47 A A E -c 129 0A 13 18,-0.2 20,-2.0 81,-0.2 2,-0.3 -0.893 23.3-178.4-117.2 143.1 20.9 14.1 14.3 48 48 A F E -cd 130 67A 40 81,-2.3 83,-2.9 -2,-0.4 2,-0.3 -0.963 12.2-172.1-131.3 146.8 23.0 15.5 17.2 49 49 A S E -cd 131 68A 0 18,-2.4 20,-2.8 -2,-0.3 23,-0.2 -0.980 31.8-104.5-144.7 155.0 23.3 19.1 18.1 50 50 A S - 0 0 0 81,-2.1 6,-0.1 -2,-0.3 81,-0.0 -0.413 39.6-123.8 -65.4 153.6 25.2 21.5 20.3 51 51 A D S S+ 0 0 36 18,-0.3 -1,-0.1 4,-0.1 17,-0.1 0.543 75.2 117.4 -82.3 -5.2 22.8 22.5 23.1 52 52 A M S >> S- 0 0 5 1,-0.1 4,-2.4 4,-0.1 3,-0.8 -0.359 75.6-120.9 -62.3 140.4 23.2 26.2 22.3 53 53 A L H 3> S+ 0 0 66 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.861 110.0 54.7 -50.4 -45.7 19.9 27.8 21.2 54 54 A R H 3> S+ 0 0 0 -29,-0.4 4,-1.3 1,-0.2 -45,-0.4 0.846 111.6 45.1 -61.5 -34.1 21.1 28.9 17.8 55 55 A A H <> S+ 0 0 0 -3,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.942 113.7 48.0 -73.7 -50.4 22.2 25.3 16.9 56 56 A R H X S+ 0 0 98 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.889 112.3 50.4 -57.1 -41.0 19.1 23.7 18.2 57 57 A R H X S+ 0 0 76 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.865 108.5 52.0 -67.1 -36.7 16.9 26.2 16.3 58 58 A T H X S+ 0 0 0 -4,-1.3 4,-1.6 -5,-0.2 -2,-0.2 0.937 110.0 49.0 -64.9 -44.4 18.9 25.5 13.1 59 59 A A H <>S+ 0 0 0 -4,-2.4 5,-2.8 2,-0.2 4,-0.3 0.926 112.0 49.5 -59.8 -45.7 18.3 21.8 13.5 60 60 A E H ><5S+ 0 0 111 -4,-2.3 3,-2.1 1,-0.2 -2,-0.2 0.959 112.4 44.9 -59.2 -54.5 14.6 22.3 14.1 61 61 A L H 3<5S+ 0 0 25 -4,-2.6 -22,-0.3 1,-0.3 -1,-0.2 0.757 108.2 60.2 -63.2 -22.7 14.1 24.5 11.1 62 62 A A T 3<5S- 0 0 2 -4,-1.6 -22,-0.4 -5,-0.2 -1,-0.3 0.507 125.3-103.1 -82.0 -4.8 16.1 22.1 9.1 63 63 A G T < 5S+ 0 0 48 -3,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.675 80.1 123.2 92.7 21.0 13.6 19.4 9.9 64 64 A F < - 0 0 29 -5,-2.8 -1,-0.3 -6,-0.2 -2,-0.1 -0.768 51.0-155.6-115.8 160.6 15.5 17.5 12.6 65 65 A S - 0 0 125 -2,-0.3 -18,-0.2 -18,-0.0 -5,-0.0 -0.723 35.4-170.0-131.3 76.0 14.9 16.6 16.2 66 66 A P - 0 0 28 0, 0.0 2,-0.4 0, 0.0 -18,-0.3 -0.207 25.9-118.6 -72.5 157.0 18.5 16.1 17.5 67 67 A R E -d 48 0A 163 -20,-2.0 -18,-2.4 1,-0.0 2,-0.3 -0.780 40.5-119.1 -90.4 139.4 19.8 14.7 20.7 68 68 A L E +d 49 0A 73 -2,-0.4 -18,-0.2 -20,-0.2 -17,-0.1 -0.666 34.5 173.1 -90.3 136.4 21.7 17.5 22.5 69 69 A Y > - 0 0 55 -20,-2.8 3,-1.8 -2,-0.3 -18,-0.3 -0.967 26.4-154.7-141.3 118.6 25.4 17.3 23.4 70 70 A P G > S+ 0 0 65 0, 0.0 3,-2.0 0, 0.0 -20,-0.1 0.704 91.4 78.7 -65.0 -16.9 27.5 20.1 24.9 71 71 A E G 3 S+ 0 0 79 1,-0.3 49,-0.2 -22,-0.1 -21,-0.1 0.683 86.1 59.8 -64.8 -16.1 30.5 18.5 23.3 72 72 A L G < S+ 0 0 0 -3,-1.8 61,-0.5 -23,-0.2 -22,-0.3 0.355 82.8 120.2 -93.0 5.4 29.4 20.0 20.0 73 73 A R S < S- 0 0 53 -3,-2.0 60,-0.1 -24,-0.1 3,-0.1 -0.213 72.3 -99.7 -67.5 160.2 29.6 23.5 21.4 74 74 A E - 0 0 19 -53,-0.4 -1,-0.1 1,-0.2 -53,-0.1 -0.220 59.0 -74.7 -68.1 167.8 31.9 26.2 19.9 75 75 A I - 0 0 5 -55,-0.1 2,-0.8 1,-0.1 -1,-0.2 -0.361 50.2-111.7 -64.8 148.9 35.2 26.8 21.8 76 76 A H - 0 0 47 -55,-0.2 32,-2.9 1,-0.1 -1,-0.1 -0.774 27.0-165.1 -86.3 109.1 34.7 28.7 25.1 77 77 A F > - 0 0 16 -2,-0.8 3,-2.5 1,-0.2 30,-0.2 0.486 17.1-165.1 -74.5 -2.0 36.4 32.0 24.5 78 78 A G G > S+ 0 0 11 28,-0.3 3,-2.2 1,-0.3 28,-0.2 -0.274 72.6 0.9 54.8-131.2 36.5 32.8 28.2 79 79 A A G 3 S+ 0 0 79 26,-2.9 -1,-0.3 1,-0.3 27,-0.1 0.662 130.5 66.0 -62.4 -15.6 37.2 36.5 28.7 80 80 A L G X + 0 0 22 -3,-2.5 3,-2.3 25,-0.3 -61,-0.3 0.475 69.7 125.7 -85.9 -1.6 37.3 37.0 24.9 81 81 A E T < S+ 0 0 37 -3,-2.2 -61,-0.2 1,-0.3 3,-0.1 -0.367 83.9 8.0 -56.2 130.4 33.6 36.1 24.6 82 82 A G T 3 S+ 0 0 10 -63,-3.0 -1,-0.3 1,-0.2 -62,-0.1 0.401 93.5 144.5 78.9 -4.6 32.0 39.0 22.7 83 83 A A < - 0 0 28 -3,-2.3 -64,-2.7 -64,-0.1 2,-0.3 -0.416 56.9-109.2 -69.4 142.3 35.3 40.7 21.9 84 84 A L B -F 18 0B 48 -66,-0.2 4,-0.3 1,-0.2 -66,-0.3 -0.544 16.2-140.7 -71.7 133.7 35.5 42.4 18.5 85 85 A W S > S+ 0 0 91 -68,-2.8 3,-1.9 -2,-0.3 -1,-0.2 0.934 99.8 62.7 -58.7 -45.3 37.8 40.5 16.1 86 86 A E T 3 S+ 0 0 152 -69,-0.4 -1,-0.2 1,-0.3 -68,-0.1 0.863 109.5 36.8 -46.4 -49.3 39.1 43.9 14.9 87 87 A T T 3 S+ 0 0 98 -3,-0.2 -1,-0.3 2,-0.0 -2,-0.2 0.270 86.3 129.3 -93.1 11.9 40.5 44.9 18.2 88 88 A L S < S- 0 0 8 -3,-1.9 5,-0.1 -4,-0.3 -3,-0.0 -0.467 72.7 -97.8 -68.7 134.7 41.7 41.5 19.2 89 89 A D >> - 0 0 75 -2,-0.2 4,-2.4 1,-0.1 3,-0.9 -0.250 31.9-118.7 -52.7 135.6 45.3 41.4 20.3 90 90 A P H 3> S+ 0 0 98 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.800 113.7 59.1 -47.2 -35.1 47.6 40.3 17.4 91 91 A R H 3> S+ 0 0 152 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.930 109.4 42.1 -62.8 -45.4 48.7 37.3 19.5 92 92 A Y H <> S+ 0 0 32 -3,-0.9 4,-2.5 2,-0.2 5,-0.2 0.892 113.8 52.6 -68.2 -40.4 45.2 36.0 19.8 93 93 A K H X S+ 0 0 47 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.950 112.2 45.3 -59.2 -49.8 44.4 36.8 16.1 94 94 A E H X S+ 0 0 114 -4,-2.9 4,-3.1 2,-0.2 5,-0.3 0.909 111.1 52.7 -60.7 -43.9 47.5 34.9 15.1 95 95 A A H X>S+ 0 0 8 -4,-2.3 5,-2.3 -5,-0.2 4,-0.7 0.927 114.5 42.1 -58.8 -46.2 46.7 31.9 17.4 96 96 A L H <5S+ 0 0 16 -4,-2.5 -2,-0.2 3,-0.2 -1,-0.2 0.906 115.3 50.0 -68.7 -40.6 43.2 31.7 15.9 97 97 A L H <5S+ 0 0 98 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.928 119.4 35.8 -64.2 -45.3 44.3 32.2 12.3 98 98 A R H <5S- 0 0 84 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.532 108.2-130.8 -84.5 -6.0 47.0 29.6 12.5 99 99 A F T <5 + 0 0 20 -4,-0.7 2,-0.3 -5,-0.3 -3,-0.2 0.956 67.9 99.7 55.1 58.5 44.7 27.5 14.8 100 100 A Q < + 0 0 32 -5,-2.3 -2,-0.2 -6,-0.1 -1,-0.2 -0.957 65.0 20.3-168.6 149.2 47.3 26.8 17.5 101 101 A G S S+ 0 0 49 136,-0.5 2,-0.6 -2,-0.3 -6,-0.1 0.916 71.9 151.4 55.2 50.3 48.5 28.0 20.9 102 102 A F + 0 0 3 -7,-0.2 8,-2.2 -8,-0.1 9,-0.3 -0.955 8.6 157.4-114.9 115.6 45.2 29.7 21.9 103 103 A H - 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