==== 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 02-APR-07 2PE3 . COMPND 2 MOLECULE: 354AA LONG HYPOTHETICAL OPERON PROTEIN FRV; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR J.JEYAKANTHAN,S.P.KANAUJIA,Z.A.RAFI,K.SEKAR,E.INAGAKAI,A.EBI . 1318 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46227.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 923 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 120 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 208 15.8 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 . 12 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 . 111 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 286 21.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.1 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 6 0 0 5 7 0 0 2 2 3 1 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 8 0 0 4 0 4 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 . 4 20 5 7 5 5 2 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 4 0 0 4 4 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 11 A D > 0 0 86 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 85.4 35.5 -32.3 21.2 2 12 A W H > + 0 0 66 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.752 360.0 61.1 -70.5 -25.4 32.4 -34.1 22.4 3 13 A K H > S+ 0 0 127 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.985 110.7 36.0 -64.4 -60.5 30.6 -30.8 23.2 4 14 A L H > S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.909 114.9 57.0 -59.9 -45.6 30.6 -29.4 19.6 5 15 A M H X S+ 0 0 7 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.876 107.5 47.4 -56.2 -40.6 30.1 -32.9 18.1 6 16 A Q H X S+ 0 0 67 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.861 109.6 54.4 -70.6 -34.4 26.9 -33.5 20.1 7 17 A E H X S+ 0 0 92 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.940 107.9 47.8 -63.1 -49.2 25.5 -30.0 19.2 8 18 A I H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.895 114.4 50.0 -57.3 -42.3 25.9 -30.6 15.4 9 19 A I H < S+ 0 0 1 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.886 116.1 37.1 -66.2 -44.4 24.2 -34.0 15.9 10 20 A E H < S+ 0 0 46 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.505 85.3 119.3 -90.9 -3.8 21.2 -32.9 17.8 11 21 A A S < S- 0 0 10 -4,-1.4 10,-0.2 -3,-0.2 11,-0.1 -0.414 73.4-105.5 -63.4 131.7 20.6 -29.6 16.0 12 22 A P + 0 0 16 0, 0.0 10,-3.3 0, 0.0 11,-0.2 -0.104 65.6 121.0 -55.7 154.6 17.2 -29.5 14.3 13 23 A G - 0 0 0 8,-0.2 51,-1.4 7,-0.2 5,-0.3 0.377 28.0-177.1 146.9 72.8 17.0 -29.9 10.6 14 24 A V B > -a 64 0A 0 3,-0.3 3,-3.4 49,-0.2 51,-0.2 -0.431 59.3 -59.3 -80.8 162.8 15.1 -32.6 8.7 15 25 A S T 3 S+ 0 0 0 49,-2.0 -1,-0.2 1,-0.3 175,-0.1 -0.160 131.3 10.9 -45.3 116.7 15.3 -32.7 4.8 16 26 A G T 3 S+ 0 0 10 -3,-0.1 -1,-0.3 26,-0.1 555,-0.1 0.365 121.8 70.2 93.4 -4.6 14.0 -29.4 3.6 17 27 A Y X + 0 0 39 -3,-3.4 3,-2.0 1,-0.1 -3,-0.3 -0.085 50.1 129.1-133.2 31.2 13.9 -27.8 7.1 18 28 A E G > > + 0 0 5 1,-0.3 5,-2.8 -5,-0.3 3,-0.9 0.612 64.1 72.7 -65.2 -11.4 17.7 -27.4 7.7 19 29 A H G 3 5S+ 0 0 51 1,-0.2 -1,-0.3 3,-0.2 5,-0.1 0.564 73.9 84.1 -79.7 -8.5 17.0 -23.8 8.6 20 30 A L G < 5S- 0 0 69 -3,-2.0 -1,-0.2 -6,-0.2 -7,-0.2 0.609 124.2 -49.6 -69.2 -12.8 15.4 -24.9 11.9 21 31 A G T X>5S+ 0 0 13 -3,-0.9 4,-1.5 -9,-0.2 3,-0.5 0.027 124.6 71.8 175.8 -56.2 18.8 -25.1 13.5 22 32 A I H 3>5S+ 0 0 0 -10,-3.3 4,-2.2 1,-0.2 5,-0.2 0.862 93.1 62.6 -55.2 -39.4 21.6 -27.0 11.8 23 33 A R H 3> S+ 0 0 78 -3,-0.5 4,-2.5 -6,-0.2 5,-0.3 0.867 109.5 55.6 -66.1 -40.6 23.1 -21.6 11.5 25 35 A I H X S+ 0 0 54 -4,-1.5 4,-2.7 1,-0.2 5,-0.2 0.983 110.9 45.2 -54.8 -58.4 25.4 -23.8 13.5 26 36 A V H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.903 113.1 49.8 -51.5 -50.6 27.3 -24.7 10.4 27 37 A V H >X S+ 0 0 14 -4,-2.2 4,-2.5 -5,-0.2 3,-0.8 0.965 113.6 44.4 -54.9 -58.2 27.5 -21.1 9.1 28 38 A D H 3X S+ 0 0 96 -4,-2.5 4,-1.1 1,-0.3 3,-0.4 0.953 110.8 53.3 -51.5 -58.2 28.7 -19.6 12.4 29 39 A V H 3< S+ 0 0 15 -4,-2.7 4,-0.3 -5,-0.3 -1,-0.3 0.768 117.6 39.4 -50.1 -29.4 31.3 -22.3 13.0 30 40 A L H XX S+ 0 0 2 -4,-1.4 4,-3.2 -3,-0.8 3,-0.8 0.729 97.6 70.7 -96.6 -26.0 32.6 -21.6 9.5 31 41 A K H 3< S+ 0 0 119 -4,-2.5 -2,-0.2 -3,-0.4 -3,-0.1 0.809 90.1 70.7 -60.6 -24.1 32.5 -17.8 9.2 32 42 A E T 3< S+ 0 0 127 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.911 121.0 7.3 -57.5 -46.5 35.3 -17.9 11.8 33 43 A V T <4 S+ 0 0 63 -3,-0.8 -2,-0.2 -4,-0.3 -1,-0.2 0.581 106.0 99.7-115.0 -15.1 37.8 -19.3 9.2 34 44 A A < - 0 0 14 -4,-3.2 15,-0.2 1,-0.1 3,-0.1 -0.484 65.8-139.2 -77.2 145.6 36.1 -19.2 5.9 35 45 A D S S- 0 0 102 13,-2.2 2,-0.3 1,-0.3 14,-0.2 0.792 87.2 -0.7 -71.2 -28.5 36.8 -16.3 3.4 36 46 A E E -B 48 0B 97 12,-0.9 12,-2.9 -6,-0.1 2,-0.4 -0.974 61.2-165.6-161.4 147.0 33.1 -16.2 2.6 37 47 A V E +B 47 0B 19 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -1.000 16.9 159.3-139.8 136.0 29.8 -18.0 3.5 38 48 A K E -B 46 0B 89 8,-1.7 8,-3.0 -2,-0.4 2,-0.4 -0.939 27.5-136.9-148.2 168.8 26.5 -17.9 1.8 39 49 A V E -B 45 0B 29 -2,-0.3 6,-0.2 6,-0.2 621,-0.1 -0.983 18.9-144.0-136.0 122.4 23.2 -19.9 1.5 40 50 A D > - 0 0 24 4,-1.2 3,-1.7 -2,-0.4 575,-0.1 -0.107 41.0 -84.5 -76.9 178.8 21.3 -20.6 -1.8 41 51 A K T 3 S+ 0 0 52 1,-0.3 -1,-0.1 573,-0.3 574,-0.1 0.511 130.1 50.4 -62.9 -4.9 17.6 -20.7 -2.4 42 52 A L T 3 S- 0 0 10 2,-0.1 -1,-0.3 618,-0.1 -26,-0.1 0.544 120.6-104.5-107.6 -12.9 17.6 -24.4 -1.3 43 53 A G < + 0 0 1 -3,-1.7 2,-0.2 1,-0.3 -2,-0.1 0.540 62.6 155.6 102.4 7.3 19.5 -23.8 1.9 44 54 A N - 0 0 0 154,-0.1 -4,-1.2 146,-0.1 2,-0.6 -0.488 37.8-140.1 -67.1 135.4 23.0 -25.1 1.0 45 55 A V E -BC 39 188B 0 143,-2.2 143,-3.3 -6,-0.2 2,-0.5 -0.901 21.3-169.1 -98.5 121.0 25.6 -23.5 3.1 46 56 A I E -BC 38 187B 3 -8,-3.0 -8,-1.7 -2,-0.6 2,-0.5 -0.949 4.9-172.2-118.5 113.9 28.6 -22.7 0.9 47 57 A A E -BC 37 186B 0 139,-3.0 139,-2.6 -2,-0.5 2,-0.4 -0.893 11.7-147.4-106.9 132.5 31.9 -21.7 2.5 48 58 A H E -BC 36 185B 16 -12,-2.9 -13,-2.2 -2,-0.5 -12,-0.9 -0.833 16.9-177.6-104.9 135.3 34.8 -20.5 0.3 49 59 A F E - C 0 184B 9 135,-3.7 135,-2.6 -2,-0.4 -15,-0.1 -0.768 33.3-134.6-127.0 81.6 38.5 -21.0 1.1 50 60 A K + 0 0 116 -2,-0.4 2,-0.3 133,-0.2 130,-0.2 0.020 40.3 149.1 -41.4 131.3 40.2 -19.2 -1.8 51 61 A G - 0 0 31 1,-0.2 132,-0.3 0, 0.0 131,-0.2 -0.874 48.6-111.0-151.7-179.1 43.1 -21.0 -3.4 52 62 A S S S+ 0 0 85 129,-2.6 -1,-0.2 1,-0.3 130,-0.2 0.895 76.4 30.5 -85.5 -82.8 44.7 -21.3 -6.8 53 63 A S S S+ 0 0 37 128,-0.7 -1,-0.3 129,-0.1 2,-0.1 -0.988 96.1 19.0-152.8 156.3 44.0 -24.8 -8.3 54 64 A P S S- 0 0 0 0, 0.0 129,-2.1 0, 0.0 2,-0.7 0.628 70.4-129.7 -83.0 175.5 42.4 -27.1 -8.6 55 65 A R E -d 183 0B 72 127,-0.2 154,-2.2 -2,-0.1 155,-2.1 -0.792 31.8-168.6 -88.2 121.2 38.9 -26.1 -7.6 56 66 A I E -de 184 210B 3 127,-3.2 129,-2.5 -2,-0.7 2,-0.5 -0.925 16.0-159.7-118.8 137.2 37.6 -28.6 -5.1 57 67 A M E -de 185 211B 0 153,-2.7 155,-2.7 -2,-0.4 2,-0.4 -0.947 10.0-176.9-112.0 127.1 34.1 -29.1 -3.6 58 68 A V E -de 186 212B 7 127,-2.5 129,-3.2 -2,-0.5 2,-0.3 -0.993 12.5-175.5-122.8 127.9 33.8 -31.1 -0.4 59 69 A A E +de 187 213B 1 153,-2.1 155,-2.5 -2,-0.4 2,-0.3 -0.944 23.2 175.7-134.5 153.2 30.3 -31.8 1.0 60 70 A A E -d 188 0B 0 127,-1.7 129,-0.6 -2,-0.3 155,-0.1 -0.936 35.1-121.0-148.9 119.9 28.4 -33.3 3.9 61 71 A H E -d 189 0B 0 -2,-0.3 106,-0.2 127,-0.2 129,-0.2 -0.383 12.4-160.1 -70.2 141.6 24.6 -33.1 4.1 62 72 A M + 0 0 0 127,-3.2 2,-0.2 -2,-0.1 128,-0.2 0.481 57.5 107.3 -95.1 -7.6 22.9 -31.4 7.1 63 73 A D - 0 0 0 126,-0.5 2,-0.3 100,-0.1 -49,-0.2 -0.505 51.8-156.0 -84.4 146.1 19.6 -33.1 6.7 64 74 A K B -a 14 0A 1 -51,-1.4 -49,-2.0 -2,-0.2 2,-0.1 -0.785 23.4-114.7-109.9 154.0 18.1 -35.8 8.9 65 75 A I + 0 0 4 -2,-0.3 79,-0.4 -51,-0.2 2,-0.3 -0.503 55.6 137.9 -80.9 160.0 15.4 -38.3 8.0 66 76 A G E -I 83 0C 1 17,-3.4 17,-3.2 -2,-0.1 2,-0.3 -0.861 43.1 -83.6-170.9-153.5 12.2 -37.8 10.0 67 77 A V E -IJ 82 142C 3 75,-2.6 75,-2.5 15,-0.3 2,-0.3 -0.890 21.0-154.5-136.7 167.2 8.5 -37.7 9.9 68 78 A M E -IJ 81 141C 0 13,-2.2 13,-2.5 -2,-0.3 2,-0.6 -0.991 29.2-107.3-141.4 146.5 5.6 -35.3 9.1 69 79 A V E -I 80 0C 0 71,-3.0 70,-3.1 -2,-0.3 11,-0.3 -0.648 28.1-178.9 -80.9 121.4 2.0 -35.1 10.3 70 80 A N E - 0 0 21 9,-3.2 2,-0.3 -2,-0.6 10,-0.2 0.887 66.8 -26.5 -81.4 -45.7 -0.4 -36.1 7.6 71 81 A H E -I 79 0C 44 8,-1.6 8,-2.4 67,-0.1 2,-0.5 -0.987 52.0-121.7-166.5 162.4 -3.5 -35.5 9.7 72 82 A I E -I 78 0C 9 -2,-0.3 6,-0.2 6,-0.2 56,-0.1 -0.950 29.2-143.5-112.6 123.6 -4.9 -35.3 13.2 73 83 A D > - 0 0 36 4,-2.3 3,-1.9 -2,-0.5 6,-0.0 -0.252 32.5 -94.7 -82.4 174.4 -7.8 -37.5 14.2 74 84 A K T 3 S+ 0 0 168 1,-0.3 54,-1.1 2,-0.1 55,-0.2 0.792 122.5 55.4 -58.4 -30.4 -10.8 -36.7 16.4 75 85 A D T 3 S- 0 0 68 52,-0.3 -1,-0.3 53,-0.1 52,-0.2 0.360 120.7-104.1 -86.9 6.7 -9.1 -38.1 19.5 76 86 A G S < S+ 0 0 1 -3,-1.9 47,-0.4 1,-0.3 49,-0.4 0.586 73.7 140.1 85.1 10.6 -6.1 -36.0 19.1 77 87 A Y - 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