==== 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 HYDROLASE 20-MAR-07 2P75 . COMPND 2 MOLECULE: ALPHA-RIBAZOLE-5'-PHOSPHATE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR M.SUGAHARA,Y.TANAKA,Y.MATSUURA,T.NAKAMOTO,N.KUNISHIMA,RIKEN . 341 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15136.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 237 69.5 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 . 27 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 26.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 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 1 1 0 0 2 3 3 0 0 1 1 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 80 0, 0.0 159,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 123.7 32.3 7.3 8.8 2 2 A E E +A 159 0A 80 157,-0.2 126,-1.0 155,-0.1 2,-0.4 -0.547 360.0 173.0 -71.0 118.2 30.0 9.6 6.8 3 3 A L E -Ab 158 128A 1 155,-2.6 155,-2.8 -2,-0.5 2,-0.6 -0.991 23.1-152.7-130.7 134.8 29.2 12.6 8.9 4 4 A W E -Ab 157 129A 39 124,-2.6 126,-3.9 -2,-0.4 2,-0.5 -0.931 13.7-163.4-108.0 117.3 27.3 15.8 7.9 5 5 A L E -Ab 156 130A 1 151,-3.3 151,-2.1 -2,-0.6 2,-0.5 -0.883 1.7-162.9-105.8 126.7 28.3 18.9 9.9 6 6 A V E -Ab 155 131A 0 124,-3.2 126,-3.0 -2,-0.5 2,-0.6 -0.904 12.5-144.3-110.0 129.0 26.0 21.9 9.8 7 7 A R E - b 0 132A 58 147,-2.7 146,-1.5 -2,-0.5 126,-0.2 -0.816 35.9-114.2 -88.8 125.5 27.2 25.4 10.9 8 8 A H - 0 0 16 124,-2.0 145,-1.0 -2,-0.6 146,-0.2 -0.045 36.6 -86.6 -57.4 160.2 24.2 27.0 12.6 9 9 A G - 0 0 0 45,-0.4 22,-0.2 143,-0.3 144,-0.1 -0.117 59.3 -75.8 -63.0 166.7 22.4 30.1 11.1 10 10 A E - 0 0 24 142,-0.1 18,-2.3 20,-0.1 21,-0.3 -0.247 39.7-165.7 -70.1 151.5 23.7 33.6 11.8 11 11 A T >> - 0 0 3 16,-0.3 3,-1.7 -3,-0.1 4,-0.8 -0.717 43.6 -92.4-122.1 173.0 23.2 35.6 15.0 12 12 A L H 3> S+ 0 0 89 14,-0.5 4,-2.1 1,-0.3 3,-0.4 0.861 122.7 63.1 -58.9 -36.9 23.7 39.3 15.5 13 13 A W H 34>S+ 0 0 53 1,-0.2 5,-2.4 2,-0.2 4,-0.5 0.611 93.4 65.4 -66.1 -9.7 27.4 38.8 16.6 14 14 A N H X45S+ 0 0 67 -3,-1.7 3,-0.5 3,-0.2 -1,-0.2 0.948 108.8 35.6 -75.1 -50.3 28.1 37.4 13.2 15 15 A R H 3<5S+ 0 0 156 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.1 0.830 118.7 53.1 -70.7 -31.6 27.4 40.7 11.4 16 16 A E T 3<5S- 0 0 89 -4,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.585 107.3-128.6 -79.3 -11.6 28.9 42.5 14.3 17 17 A G T < 5 + 0 0 32 -3,-0.5 68,-2.8 -4,-0.5 69,-0.4 0.917 54.3 147.5 65.4 45.3 32.1 40.5 14.2 18 18 A R B < -F 84 0B 88 -5,-2.4 2,-0.3 66,-0.2 66,-0.2 -0.892 56.6-102.4-113.2 144.5 32.2 39.4 17.9 19 19 A L - 0 0 17 64,-2.6 63,-3.1 -2,-0.4 2,-0.6 -0.484 38.3-166.5 -65.6 123.4 33.6 36.1 19.2 20 20 A L + 0 0 22 -2,-0.3 55,-0.1 61,-0.2 61,-0.1 -0.924 28.1 136.2-119.3 106.4 30.6 33.9 20.0 21 21 A G S S- 0 0 0 -2,-0.6 53,-0.3 57,-0.1 55,-0.2 0.550 79.8 -12.6-111.2-100.2 31.3 30.9 22.1 22 22 A W S S+ 0 0 89 51,-0.1 2,-0.3 53,-0.1 54,-0.1 0.436 96.5 117.8 -89.2 1.0 29.2 29.8 25.0 23 23 A T - 0 0 44 1,-0.1 2,-1.4 29,-0.0 59,-0.1 -0.564 69.3-131.8 -65.8 126.6 27.2 33.0 25.1 24 24 A D + 0 0 83 -2,-0.3 -1,-0.1 29,-0.1 -2,-0.1 -0.582 40.1 163.7 -90.3 81.7 23.7 31.8 24.3 25 25 A L - 0 0 38 -2,-1.4 29,-0.7 1,-0.1 2,-0.1 -0.607 32.2-121.3 -94.8 155.3 22.4 34.1 21.6 26 26 A P - 0 0 75 0, 0.0 -14,-0.5 0, 0.0 28,-0.1 -0.457 32.4 -94.1 -90.2 165.9 19.4 33.5 19.4 27 27 A L - 0 0 15 -16,-0.1 -16,-0.3 -2,-0.1 2,-0.1 -0.403 38.1-123.3 -73.2 156.6 19.3 33.3 15.6 28 28 A T > - 0 0 18 -18,-2.3 4,-2.0 -2,-0.1 5,-0.2 -0.390 35.7 -94.9 -88.8 176.2 18.4 36.4 13.6 29 29 A A H > S+ 0 0 83 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.911 131.3 47.3 -59.3 -41.5 15.5 36.4 11.2 30 30 A E H > S+ 0 0 84 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.845 106.8 57.9 -67.9 -34.2 18.0 35.7 8.4 31 31 A G H > S+ 0 0 0 -21,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.888 107.8 46.7 -63.0 -38.5 19.6 33.0 10.5 32 32 A E H X S+ 0 0 49 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.874 110.1 52.8 -70.6 -37.0 16.2 31.2 10.8 33 33 A A H X S+ 0 0 22 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.911 108.6 50.8 -63.8 -40.7 15.7 31.6 7.0 34 34 A Q H < S+ 0 0 31 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.908 109.9 50.6 -62.4 -41.7 19.1 30.0 6.5 35 35 A A H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 4,-0.5 0.900 107.4 52.3 -63.8 -42.1 18.0 27.1 8.7 36 36 A R H >< S+ 0 0 123 -4,-2.4 3,-1.0 1,-0.3 -1,-0.2 0.816 101.0 62.4 -64.9 -29.4 14.8 26.6 6.9 37 37 A R T 3< S+ 0 0 90 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.678 94.7 63.0 -69.9 -15.4 16.7 26.3 3.6 38 38 A L T X> S+ 0 0 3 -3,-1.3 3,-1.8 -4,-0.5 4,-1.4 0.705 75.6 107.6 -81.0 -20.6 18.5 23.3 5.0 39 39 A K T <4 S+ 0 0 146 -3,-1.0 24,-0.1 -4,-0.5 23,-0.1 -0.413 91.7 11.1 -62.1 122.4 15.2 21.3 5.2 40 40 A G T 34 S+ 0 0 80 22,-0.5 -1,-0.3 -2,-0.2 -2,-0.1 0.142 114.4 80.2 96.0 -20.4 15.3 18.7 2.5 41 41 A A T <4 S+ 0 0 37 -3,-1.8 -2,-0.2 21,-0.1 -3,-0.1 0.799 81.0 71.8 -86.9 -32.6 18.9 19.3 1.7 42 42 A M S < S- 0 0 14 -4,-1.4 -2,-0.2 20,-0.2 2,-0.1 -0.544 92.0-105.7 -84.5 148.8 20.3 17.2 4.5 43 43 A P - 0 0 35 0, 0.0 2,-2.3 0, 0.0 -1,-0.1 -0.376 34.0-106.2 -71.7 153.9 20.0 13.4 4.5 44 44 A S S S+ 0 0 125 -4,-0.1 3,-0.1 -2,-0.1 20,-0.0 -0.414 71.8 138.2 -79.7 66.0 17.5 11.7 6.8 45 45 A L - 0 0 44 -2,-2.3 83,-0.2 1,-0.1 84,-0.1 -0.628 66.1 -76.0-107.4 165.8 20.1 10.5 9.3 46 46 A P - 0 0 78 0, 0.0 83,-2.4 0, 0.0 2,-0.4 -0.342 57.1-139.5 -57.5 143.3 20.0 10.4 13.1 47 47 A A E -c 129 0A 15 18,-0.2 20,-2.2 81,-0.2 2,-0.3 -0.902 23.8-179.3-118.2 141.7 20.7 14.0 14.3 48 48 A F E -cd 130 67A 39 81,-2.3 83,-3.0 -2,-0.4 2,-0.3 -0.944 12.2-173.4-129.5 148.7 22.8 15.4 17.2 49 49 A S E -cd 131 68A 0 18,-2.3 20,-2.7 -2,-0.3 23,-0.2 -0.993 32.9-102.1-147.1 152.8 23.1 19.0 18.1 50 50 A S - 0 0 0 81,-2.2 6,-0.2 -2,-0.3 21,-0.0 -0.405 38.1-127.1 -63.0 149.8 25.0 21.4 20.3 51 51 A D S S+ 0 0 39 18,-0.3 -1,-0.1 4,-0.1 17,-0.1 0.562 74.9 113.4 -81.4 -6.6 22.6 22.3 23.2 52 52 A L S >> S- 0 0 7 1,-0.1 4,-2.3 18,-0.1 3,-0.9 -0.382 78.7-116.3 -66.9 142.6 23.1 26.0 22.6 53 53 A L H 3> S+ 0 0 51 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.859 110.5 53.4 -45.7 -52.1 20.0 27.8 21.3 54 54 A R H 3> S+ 0 0 1 -29,-0.7 4,-1.0 1,-0.2 -45,-0.4 0.841 113.1 45.4 -58.3 -33.8 21.3 28.9 17.9 55 55 A A H <> S+ 0 0 0 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.955 115.2 41.4 -77.6 -52.2 22.3 25.3 17.1 56 56 A R H X S+ 0 0 97 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.847 112.8 56.0 -72.2 -20.5 19.3 23.4 18.2 57 57 A R H X S+ 0 0 71 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.896 107.5 50.2 -70.0 -34.8 16.9 26.1 16.7 58 58 A T H X S+ 0 0 0 -4,-1.0 4,-1.5 -5,-0.3 -2,-0.2 0.928 109.8 50.5 -66.6 -43.1 18.8 25.5 13.4 59 59 A A H <>S+ 0 0 0 -4,-2.3 5,-2.6 1,-0.2 -2,-0.2 0.913 111.1 49.2 -60.4 -43.0 18.2 21.8 13.8 60 60 A E H ><5S+ 0 0 112 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.936 111.9 45.9 -63.0 -48.9 14.5 22.3 14.4 61 61 A L H 3<5S+ 0 0 26 -4,-2.3 -22,-0.3 1,-0.3 -1,-0.2 0.732 106.7 60.6 -67.6 -22.1 13.9 24.6 11.5 62 62 A A T 3<5S- 0 0 2 -4,-1.5 -22,-0.5 -5,-0.2 -1,-0.3 0.465 125.6-102.6 -82.9 -2.4 15.9 22.2 9.3 63 63 A G T < 5S+ 0 0 48 -3,-1.6 2,-0.2 1,-0.3 -3,-0.2 0.643 80.2 123.2 92.5 16.9 13.3 19.5 10.1 64 64 A F < - 0 0 39 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.1 -0.709 51.7-154.2-111.2 161.9 15.2 17.5 12.7 65 65 A S - 0 0 125 -2,-0.2 -18,-0.2 -18,-0.0 -5,-0.1 -0.724 36.8-173.1-130.1 75.2 14.6 16.5 16.4 66 66 A P - 0 0 27 0, 0.0 2,-0.4 0, 0.0 -18,-0.3 -0.207 27.5-116.1 -73.2 156.0 18.2 16.0 17.4 67 67 A R E -d 48 0A 161 -20,-2.2 -18,-2.3 2,-0.0 2,-0.4 -0.803 38.8-121.0 -86.6 136.3 19.6 14.7 20.7 68 68 A L E +d 49 0A 79 -2,-0.4 -18,-0.2 -20,-0.2 -17,-0.1 -0.661 33.0 174.8 -89.7 135.3 21.6 17.4 22.5 69 69 A Y > - 0 0 54 -20,-2.7 3,-1.8 -2,-0.4 -18,-0.3 -0.978 26.2-153.5-136.8 120.2 25.2 17.1 23.4 70 70 A P G > S+ 0 0 69 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 0.736 91.9 77.9 -63.2 -20.5 27.3 19.9 24.9 71 71 A E G 3 S+ 0 0 77 1,-0.3 49,-0.2 -22,-0.1 -21,-0.1 0.711 87.0 59.3 -60.9 -19.9 30.3 18.2 23.4 72 72 A L G < S+ 0 0 0 -3,-1.8 61,-0.4 -23,-0.2 -22,-0.3 0.315 82.9 122.4 -91.9 8.0 29.2 19.8 20.0 73 73 A R S < S- 0 0 51 -3,-2.1 3,-0.1 -24,-0.1 60,-0.1 -0.262 71.2-100.7 -69.3 157.9 29.5 23.3 21.4 74 74 A E - 0 0 17 -53,-0.3 -1,-0.1 1,-0.2 -53,-0.1 -0.208 59.8 -74.8 -65.5 166.2 31.6 26.1 19.9 75 75 A I - 0 0 5 -55,-0.1 2,-0.8 1,-0.1 -1,-0.2 -0.354 48.5-112.2 -65.5 147.8 34.9 26.6 21.8 76 76 A H - 0 0 47 -55,-0.2 32,-2.8 1,-0.1 -1,-0.1 -0.759 26.6-164.6 -84.0 111.2 34.6 28.5 25.1 77 77 A F > - 0 0 16 -2,-0.8 3,-2.5 1,-0.2 30,-0.2 0.511 17.1-166.3 -75.7 -3.5 36.2 31.9 24.5 78 78 A G G > S+ 0 0 12 1,-0.3 3,-2.1 28,-0.3 28,-0.2 -0.294 72.3 2.3 56.2-129.3 36.4 32.6 28.2 79 79 A A G 3 S+ 0 0 77 26,-3.3 -1,-0.3 1,-0.3 27,-0.1 0.674 130.6 65.3 -62.8 -16.7 37.2 36.3 28.9 80 80 A L G X + 0 0 21 -3,-2.5 3,-2.4 25,-0.3 -61,-0.3 0.457 68.5 127.7 -86.6 -0.4 37.2 36.8 25.1 81 81 A E T < S+ 0 0 40 -3,-2.1 -61,-0.2 1,-0.3 -5,-0.0 -0.353 83.5 8.7 -56.2 127.6 33.5 36.0 24.8 82 82 A G T 3 S+ 0 0 10 -63,-3.1 -1,-0.3 1,-0.3 2,-0.1 0.455 91.7 148.4 81.5 -1.5 31.9 38.9 22.9 83 83 A A < - 0 0 26 -3,-2.4 -64,-2.6 -64,-0.2 2,-0.3 -0.426 55.1-112.2 -68.9 139.4 35.2 40.5 22.0 84 84 A L B -F 18 0B 52 -66,-0.2 3,-0.5 1,-0.2 4,-0.3 -0.578 18.4-140.8 -70.7 130.4 35.3 42.3 18.7 85 85 A W S > S+ 0 0 86 -68,-2.8 3,-1.9 -2,-0.3 -1,-0.2 0.929 98.9 64.3 -56.4 -45.5 37.6 40.4 16.3 86 86 A E T 3 S+ 0 0 150 -69,-0.4 -1,-0.2 1,-0.3 -68,-0.1 0.838 109.1 36.4 -44.8 -46.5 38.9 43.7 15.0 87 87 A T T 3 S+ 0 0 100 -3,-0.5 -1,-0.3 2,-0.0 -2,-0.2 0.262 84.9 129.4 -98.5 12.3 40.4 44.7 18.4 88 88 A L S < S- 0 0 7 -3,-1.9 5,-0.1 -4,-0.3 -3,-0.0 -0.428 73.4 -93.8 -68.2 137.9 41.6 41.3 19.6 89 89 A D >> - 0 0 70 1,-0.1 4,-2.3 -2,-0.1 3,-1.5 -0.250 35.9-117.8 -51.8 135.6 45.2 41.2 20.7 90 90 A P H 3> S+ 0 0 98 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.775 113.9 59.1 -46.6 -34.1 47.5 40.1 17.7 91 91 A R H 3> S+ 0 0 154 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.874 109.4 42.2 -66.8 -37.8 48.5 37.0 19.6 92 92 A Y H <> S+ 0 0 35 -3,-1.5 4,-2.6 2,-0.2 5,-0.2 0.878 113.6 52.8 -75.3 -39.1 44.9 35.8 19.9 93 93 A K H X S+ 0 0 48 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.940 112.7 44.5 -59.7 -48.1 44.2 36.8 16.3 94 94 A E H X S+ 0 0 118 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.915 111.9 52.6 -63.2 -43.7 47.2 34.8 15.1 95 95 A A H <>S+ 0 0 6 -4,-2.0 5,-2.6 1,-0.2 4,-0.5 0.904 116.2 39.8 -59.1 -43.0 46.3 31.9 17.3 96 96 A L H <5S+ 0 0 13 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.883 115.6 50.6 -75.6 -38.9 42.8 31.8 15.9 97 97 A L H <5S+ 0 0 104 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.930 120.8 34.6 -64.0 -45.1 43.8 32.5 12.3 98 98 A R T <5S- 0 0 86 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.546 107.6-131.7 -85.3 -8.3 46.4 29.8 12.4 99 99 A F T 5 + 0 0 17 -4,-0.5 2,-0.3 -5,-0.3 -3,-0.2 0.956 67.4 103.2 55.6 57.0 44.2 27.7 14.6 100 100 A Q < + 0 0 30 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.2 -0.962 64.9 17.7-165.3 147.0 46.9 26.8 17.1 101 101 A G + 0 0 34 136,-0.4 2,-0.6 -2,-0.3 -6,-0.1 0.921 69.6 161.8 56.2 51.6 48.2 27.8 20.6 102 102 A F + 0 0 1 -7,-0.2 8,-1.6 135,-0.1 9,-0.3 -0.914 9.1 166.4-106.6 115.9 45.0 29.5 21.7 103 103 A H - 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