==== 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 22-DEC-03 1V7R . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PH1917; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR N.K.LOKANATH,N.KUNISHIMA,RIKEN STRUCTURAL GENOMICS/PROTEOMIC . 186 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9618.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 16.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 15 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 51 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 1 0 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 0 1 0 0 0 0 0 0 1 0 1 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 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 1 A M 0 0 65 0, 0.0 25,-2.7 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 130.4 29.1 47.7 6.0 2 2 A K E -a 26 0A 106 23,-0.2 2,-0.4 57,-0.1 25,-0.2 -0.760 360.0-170.1-103.5 148.3 25.8 48.5 4.5 3 3 A I E -a 27 0A 0 23,-2.6 25,-2.5 -2,-0.3 2,-0.5 -0.999 19.4-134.2-135.4 129.6 22.7 49.8 6.3 4 4 A F E -ab 28 61A 28 56,-2.5 58,-2.9 -2,-0.4 2,-0.7 -0.754 15.4-157.6 -88.4 125.2 19.2 50.1 4.8 5 5 A F E -ab 29 62A 0 23,-2.4 25,-2.4 -2,-0.5 2,-1.0 -0.899 5.5-152.6-106.5 107.3 17.5 53.4 5.6 6 6 A I E +a 30 0A 0 56,-2.5 58,-0.4 -2,-0.7 2,-0.3 -0.711 46.9 115.7 -83.6 104.4 13.8 53.0 5.3 7 7 A T - 0 0 19 23,-1.0 -2,-0.1 -2,-1.0 26,-0.1 -0.987 58.9-146.9-164.6 160.6 12.5 56.5 4.4 8 8 A S S S+ 0 0 82 -2,-0.3 23,-0.1 23,-0.1 -2,-0.0 0.185 74.5 100.6-116.1 10.5 10.8 58.6 1.7 9 9 A N > - 0 0 40 1,-0.2 4,-1.9 2,-0.0 3,-0.3 -0.839 50.0-171.6-104.1 101.1 12.8 61.8 2.6 10 10 A P H > S+ 0 0 69 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.840 85.9 57.4 -58.2 -36.2 15.7 62.3 0.1 11 11 A G H > S+ 0 0 8 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.898 106.6 47.8 -63.5 -41.2 17.1 65.1 2.1 12 12 A K H > S+ 0 0 14 -3,-0.3 4,-2.6 2,-0.2 5,-0.2 0.898 108.9 54.1 -67.2 -39.4 17.5 62.9 5.2 13 13 A V H X S+ 0 0 21 -4,-1.9 4,-3.2 1,-0.2 5,-0.3 0.939 108.1 50.4 -59.7 -45.7 19.1 60.2 3.2 14 14 A R H X S+ 0 0 147 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.879 111.4 47.4 -60.7 -39.6 21.7 62.6 1.9 15 15 A E H X S+ 0 0 5 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.922 116.0 43.8 -68.7 -43.0 22.5 63.9 5.4 16 16 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.4 0.925 115.1 48.5 -67.3 -43.5 22.8 60.4 6.8 17 17 A A H X S+ 0 0 38 -4,-3.2 4,-2.1 -5,-0.2 -2,-0.2 0.880 110.3 52.7 -64.3 -38.5 24.8 59.1 3.8 18 18 A N H X S+ 0 0 59 -4,-2.1 4,-0.7 -5,-0.3 -1,-0.2 0.934 114.1 41.3 -62.4 -48.3 27.2 62.1 4.0 19 19 A F H >< S+ 0 0 22 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.961 123.0 35.5 -66.6 -54.3 28.0 61.6 7.7 20 20 A L H ><>S+ 0 0 0 -4,-2.4 3,-2.1 1,-0.2 5,-1.4 0.784 104.5 70.6 -73.8 -28.0 28.3 57.8 7.7 21 21 A G H ><5S+ 0 0 40 -4,-2.1 3,-1.4 -5,-0.4 -1,-0.2 0.808 88.9 64.6 -58.9 -29.4 29.9 57.5 4.3 22 22 A T T <<5S+ 0 0 96 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.626 102.8 50.0 -69.3 -11.8 33.1 59.1 5.7 23 23 A F T < 5S- 0 0 81 -3,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.025 126.1 -92.9-116.2 26.9 33.4 56.0 7.9 24 24 A G T < 5S+ 0 0 55 -3,-1.4 2,-0.5 1,-0.2 -3,-0.2 0.764 81.7 136.2 71.6 25.8 33.0 53.2 5.4 25 25 A I < - 0 0 6 -5,-1.4 2,-0.6 -8,-0.1 -1,-0.2 -0.923 43.2-150.1-109.7 127.9 29.3 52.8 5.8 26 26 A E E -a 2 0A 127 -25,-2.7 -23,-2.6 -2,-0.5 2,-0.5 -0.862 8.0-154.5-100.7 118.4 27.1 52.5 2.8 27 27 A I E -a 3 0A 25 -2,-0.6 2,-0.6 -25,-0.2 -23,-0.2 -0.796 7.7-168.0 -93.7 126.8 23.5 53.8 3.2 28 28 A V E -a 4 0A 49 -25,-2.5 -23,-2.4 -2,-0.5 2,-0.2 -0.952 16.0-138.5-117.5 113.4 20.9 52.2 1.0 29 29 A Q E -a 5 0A 75 -2,-0.6 2,-0.5 -25,-0.2 -23,-0.2 -0.511 18.1-170.3 -71.8 134.7 17.5 53.9 0.8 30 30 A L E -a 6 0A 41 -25,-2.4 2,-1.6 -2,-0.2 -23,-1.0 -0.984 15.2-148.1-128.4 117.0 14.6 51.6 0.9 31 31 A K + 0 0 150 -2,-0.5 2,-0.6 -25,-0.2 -25,-0.1 -0.563 41.9 144.4 -87.9 75.4 11.1 53.1 0.2 32 32 A H - 0 0 59 -2,-1.6 -2,-0.1 -25,-0.0 -24,-0.0 -0.958 45.1-132.2-114.7 115.8 8.9 50.9 2.3 33 33 A E + 0 0 130 -2,-0.6 -26,-0.0 -26,-0.1 -2,-0.0 -0.341 29.3 174.8 -68.3 146.8 6.0 52.7 3.9 34 34 A Y - 0 0 39 -2,-0.0 2,-0.2 -28,-0.0 15,-0.1 -0.985 37.0 -92.3-148.1 152.1 5.3 52.2 7.6 35 35 A P - 0 0 49 0, 0.0 2,-0.7 0, 0.0 17,-0.1 -0.500 27.0-158.2 -72.5 133.8 2.8 53.7 10.0 36 36 A E - 0 0 121 -2,-0.2 9,-0.1 12,-0.1 10,-0.1 -0.946 22.7-145.7-108.2 106.0 4.0 56.7 11.9 37 37 A I - 0 0 58 -2,-0.7 2,-0.4 8,-0.2 12,-0.1 -0.287 17.6-106.1 -73.2 157.8 1.8 56.8 15.0 38 38 A Q + 0 0 166 6,-0.1 2,-0.3 7,-0.0 -1,-0.1 -0.710 60.4 147.6 -79.5 132.8 0.5 60.0 16.6 39 39 A A - 0 0 15 -2,-0.4 40,-0.2 -3,-0.0 3,-0.0 -0.979 59.2-117.3-161.0 165.0 2.5 60.3 19.9 40 40 A E S S+ 0 0 170 -2,-0.3 2,-0.4 1,-0.1 39,-0.1 0.457 98.2 50.5 -89.3 -1.4 4.0 62.8 22.3 41 41 A K S >> S- 0 0 112 1,-0.1 4,-1.2 37,-0.1 3,-0.9 -0.999 70.6-139.4-139.9 138.1 7.5 61.5 21.7 42 42 A L H 3> S+ 0 0 2 -2,-0.4 4,-2.2 1,-0.3 3,-0.3 0.864 106.1 63.4 -58.3 -35.7 9.6 60.9 18.6 43 43 A E H 3> S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.837 98.5 53.5 -59.0 -34.5 10.9 57.8 20.3 44 44 A D H <> S+ 0 0 56 -3,-0.9 4,-2.0 2,-0.2 -1,-0.2 0.863 107.5 50.7 -69.8 -35.6 7.4 56.3 20.4 45 45 A V H X S+ 0 0 2 -4,-1.2 4,-2.3 -3,-0.3 -8,-0.2 0.934 112.5 46.9 -66.0 -44.7 7.0 56.8 16.6 46 46 A V H X S+ 0 0 2 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.905 109.8 53.0 -64.3 -42.5 10.3 55.1 16.0 47 47 A D H X S+ 0 0 60 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.939 112.3 44.4 -58.9 -48.6 9.5 52.2 18.4 48 48 A F H X S+ 0 0 93 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.901 112.3 53.6 -63.9 -41.1 6.3 51.4 16.6 49 49 A G H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.929 109.5 46.2 -60.1 -47.5 7.9 51.8 13.2 50 50 A I H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.929 111.8 51.7 -61.6 -45.1 10.7 49.3 13.9 51 51 A S H < S+ 0 0 70 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.846 112.4 46.6 -60.9 -33.6 8.2 46.8 15.4 52 52 A W H < S+ 0 0 95 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.860 116.5 43.6 -76.9 -36.2 6.0 47.1 12.2 53 53 A L H >X S+ 0 0 0 -4,-2.2 3,-2.6 -5,-0.2 4,-0.7 0.807 81.2 110.4 -81.0 -34.7 9.0 46.8 9.8 54 54 A K T 3< S+ 0 0 92 -4,-2.5 5,-0.0 1,-0.3 -4,-0.0 -0.154 86.5 18.7 -50.3 132.3 11.0 44.0 11.2 55 55 A G T 34 S+ 0 0 72 2,-0.4 -1,-0.3 3,-0.0 -2,-0.1 0.244 114.9 75.1 91.5 -11.2 10.9 40.8 9.1 56 56 A K T <4 S+ 0 0 106 -3,-2.6 -2,-0.2 2,-0.1 -3,-0.1 0.648 94.1 41.1-104.9 -20.6 9.7 42.8 6.1 57 57 A V S < S- 0 0 12 -4,-0.7 -2,-0.4 1,-0.1 4,-0.1 -0.884 91.4 -89.8-128.0 158.6 12.9 44.6 5.0 58 58 A P - 0 0 64 0, 0.0 -54,-0.1 0, 0.0 -2,-0.1 -0.206 61.8 -75.6 -63.4 159.5 16.5 43.5 4.7 59 59 A E S S+ 0 0 84 1,-0.1 56,-0.1 -56,-0.1 2,-0.1 -0.837 98.0 32.2-122.9 158.2 18.8 44.0 7.7 60 60 A P S S+ 0 0 18 0, 0.0 -56,-2.5 0, 0.0 2,-0.3 0.567 80.9 169.9 -79.7 152.2 20.4 45.8 9.4 61 61 A F E -bC 4 114A 0 53,-1.7 53,-2.8 -58,-0.2 2,-0.3 -0.887 18.9-162.6-129.1 160.8 18.0 48.7 8.9 62 62 A M E -bC 5 113A 0 -58,-2.9 -56,-2.5 -2,-0.3 2,-0.3 -0.950 4.2-174.6-137.4 155.4 17.4 52.1 10.3 63 63 A I E - C 0 112A 0 49,-2.0 49,-2.7 -2,-0.3 2,-0.3 -0.887 11.4-156.8-138.9 168.6 14.6 54.7 10.4 64 64 A E E - C 0 111A 8 -58,-0.4 2,-0.3 -2,-0.3 47,-0.2 -0.998 10.7-171.0-151.6 147.7 14.5 58.2 11.8 65 65 A D E + C 0 110A 11 45,-2.1 45,-2.8 -2,-0.3 2,-0.3 -0.989 16.1 168.8-136.9 146.8 12.0 60.7 13.0 66 66 A S E + C 0 109A 12 -2,-0.3 2,-0.3 43,-0.2 16,-0.3 -0.965 5.8 176.2-151.2 165.5 12.7 64.3 13.9 67 67 A G E - C 0 108A 1 41,-1.8 41,-2.3 -2,-0.3 2,-0.5 -0.988 31.4-110.8-167.5 165.1 10.9 67.6 14.7 68 68 A L E - C 0 107A 0 10,-0.5 10,-2.4 -2,-0.3 2,-0.6 -0.917 27.9-162.1-104.7 127.6 11.2 71.2 15.6 69 69 A F E -DC 77 106A 23 37,-3.4 37,-2.2 -2,-0.5 2,-0.6 -0.936 4.0-158.0-117.5 109.1 10.0 72.1 19.2 70 70 A I E > > - C 0 105A 0 6,-2.1 5,-2.5 -2,-0.6 3,-1.3 -0.771 8.1-149.8 -93.3 120.1 9.3 75.8 19.8 71 71 A E G > 5S+ 0 0 73 33,-1.7 3,-1.7 -2,-0.6 -1,-0.1 0.901 95.6 49.8 -51.0 -53.8 9.3 76.9 23.4 72 72 A S G 3 5S+ 0 0 53 32,-0.5 -1,-0.3 30,-0.4 33,-0.1 0.624 111.6 52.7 -65.2 -12.1 6.8 79.7 23.2 73 73 A L G X 5S- 0 0 36 -3,-1.3 3,-1.8 3,-0.2 -1,-0.3 0.026 118.8-106.6-112.5 25.5 4.4 77.3 21.5 74 74 A K T < 5S- 0 0 201 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.1 0.794 82.0 -46.8 55.8 33.4 4.6 74.5 24.1 75 75 A G T > S+D 69 0A 5 0, 0.0 3,-2.2 0, 0.0 -1,-0.3 -0.996 89.0 132.2 -85.1 -11.0 5.0 71.5 15.9 78 78 A G G X S+ 0 0 4 -10,-2.4 3,-1.9 -3,-0.6 -10,-0.5 -0.052 79.0 12.5 45.7-123.9 7.2 68.7 17.4 79 79 A V G 3 S+ 0 0 22 1,-0.3 3,-0.3 -40,-0.2 -1,-0.3 0.757 133.1 51.9 -55.5 -24.9 6.3 65.2 16.3 80 80 A Y G <> + 0 0 84 -3,-2.2 4,-2.3 1,-0.2 -1,-0.3 0.046 70.0 123.3-104.7 27.4 4.0 66.7 13.6 81 81 A S H <> S+ 0 0 8 -3,-1.9 4,-2.4 -15,-0.2 -1,-0.2 0.852 71.3 53.5 -54.4 -41.4 6.6 69.0 12.1 82 82 A S H > S+ 0 0 63 -3,-0.3 4,-2.1 -16,-0.3 -1,-0.2 0.933 110.9 44.4 -63.2 -47.2 6.3 67.6 8.6 83 83 A Y H > S+ 0 0 140 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.913 114.3 49.3 -62.9 -45.0 2.5 68.0 8.4 84 84 A V H X>S+ 0 0 10 -4,-2.3 5,-1.9 1,-0.2 4,-1.3 0.906 110.1 51.8 -63.4 -40.0 2.7 71.6 9.8 85 85 A Y H <5S+ 0 0 92 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.908 109.5 49.7 -62.2 -42.8 5.4 72.5 7.3 86 86 A R H <5S+ 0 0 172 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.776 122.1 32.6 -67.9 -27.1 3.3 71.2 4.4 87 87 A T H <5S+ 0 0 74 -4,-1.5 -2,-0.2 -3,-0.2 -3,-0.2 0.917 137.3 10.5 -95.6 -70.8 0.2 73.2 5.5 88 88 A I T X5S- 0 0 73 -4,-1.3 4,-2.1 -5,-0.2 -3,-0.2 0.712 93.2-178.3 -85.2 -18.9 1.1 76.5 7.2 89 89 A G H >< - 0 0 12 -5,-1.9 4,-1.6 2,-0.2 5,-0.2 0.033 52.0 -35.3 58.0-162.1 4.8 76.3 6.3 90 90 A L H > S+ 0 0 25 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.901 138.3 57.0 -61.0 -41.9 7.5 78.8 7.2 91 91 A E H > S+ 0 0 164 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.890 104.8 52.2 -57.4 -41.6 5.0 81.7 6.9 92 92 A G H X S+ 0 0 12 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.894 109.2 47.4 -64.5 -42.5 2.8 80.1 9.5 93 93 A I H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.939 113.1 48.7 -65.6 -44.3 5.5 79.6 12.1 94 94 A L H < S+ 0 0 33 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.891 110.7 51.9 -62.9 -36.7 6.7 83.2 11.6 95 95 A K H >< S+ 0 0 135 -4,-2.3 3,-1.4 -5,-0.2 -1,-0.2 0.940 109.5 48.9 -63.5 -47.4 3.1 84.4 11.9 96 96 A L H 3< S+ 0 0 91 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.811 112.0 51.0 -61.1 -31.0 2.6 82.5 15.2 97 97 A M T >< S+ 0 0 0 -4,-1.8 3,-2.3 -5,-0.2 -1,-0.3 0.405 75.9 128.4 -90.1 1.4 5.9 83.9 16.5 98 98 A E T < S+ 0 0 137 -3,-1.4 3,-0.1 -4,-0.4 -3,-0.0 -0.391 84.8 7.5 -60.7 128.0 5.2 87.6 15.7 99 99 A G T 3 S+ 0 0 87 1,-0.3 -1,-0.3 -2,-0.1 2,-0.2 0.473 91.3 157.9 80.4 1.2 5.8 89.6 18.9 100 100 A A < - 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