==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-OCT-09 3KF2 . COMPND 2 MOLECULE: POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS; . AUTHOR J.D.LINDBERG,S.NYSTROM,M.D.CUMMINGS . 372 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16370.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 244 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 138 37.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.9 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 . 21 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 2 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 3 8 1 10 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 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 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 28 A Q 0 0 177 0, 0.0 2,-0.2 0, 0.0 62,-0.1 0.000 360.0 360.0 360.0 122.3 27.6 -2.6 27.8 2 29 A V - 0 0 17 169,-0.1 2,-0.3 167,-0.1 169,-0.1 -0.525 360.0-139.1 -72.4 141.9 28.9 -5.9 26.4 3 30 A E - 0 0 89 -2,-0.2 2,-0.3 61,-0.0 61,-0.3 -0.699 6.3-142.6-101.9 152.4 30.9 -8.0 28.9 4 31 A G B -a 64 0A 0 59,-2.0 61,-1.3 -2,-0.3 161,-0.3 -0.885 9.7-157.9-113.7 147.8 34.1 -10.1 28.4 5 32 A E S S+ 0 0 2 159,-1.1 15,-2.8 -2,-0.3 2,-0.4 0.716 83.6 55.2 -89.4 -24.6 35.0 -13.4 29.9 6 33 A V E S-BC 19 164B 0 158,-1.8 158,-3.0 13,-0.2 2,-0.4 -0.910 70.5-158.1-112.5 131.2 38.7 -12.9 29.3 7 34 A Q E -BC 18 163B 1 11,-2.4 11,-2.3 -2,-0.4 2,-0.5 -0.906 15.8-134.5-111.7 141.1 40.7 -9.9 30.6 8 35 A I E -BC 17 162B 9 154,-3.2 153,-2.5 -2,-0.4 154,-1.4 -0.826 37.7-168.6 -88.1 129.5 44.0 -8.6 29.3 9 36 A V E -BC 16 160B 0 7,-2.7 7,-2.4 -2,-0.5 2,-0.3 -0.854 13.1-167.6-136.0 147.6 46.1 -7.9 32.3 10 37 A S E -BC 15 159B 19 149,-2.3 149,-2.6 -2,-0.3 2,-0.3 -0.990 13.5-176.7-143.9 149.0 49.4 -6.2 33.3 11 38 A T - 0 0 15 3,-2.3 147,-0.1 -2,-0.3 146,-0.0 -0.717 56.1 -87.5-121.0 177.5 52.0 -5.7 35.9 12 39 A A S S+ 0 0 108 -2,-0.3 3,-0.0 1,-0.2 146,-0.0 0.826 126.3 31.3 -52.8 -34.9 55.0 -3.4 35.7 13 40 A T S S+ 0 0 114 1,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.643 122.5 15.2-106.9 -22.7 57.1 -6.2 34.0 14 41 A Q - 0 0 89 17,-0.1 -3,-2.3 96,-0.0 2,-0.3 -0.863 53.1-139.8-143.9-179.7 54.7 -8.4 32.0 15 42 A T E +B 10 0B 53 -2,-0.3 -5,-0.2 -5,-0.2 2,-0.2 -0.987 32.9 142.2-145.5 139.5 51.3 -8.7 30.4 16 43 A F E -B 9 0B 3 -7,-2.4 -7,-2.7 -2,-0.3 2,-0.3 -0.735 41.0 -80.3-155.4-160.4 49.2 -11.8 30.3 17 44 A L E -B 8 0B 0 95,-2.7 11,-0.5 -9,-0.2 2,-0.3 -0.867 21.9-163.7-121.7 155.1 45.5 -13.0 30.5 18 45 A A E -B 7 0B 0 -11,-2.3 -11,-2.4 -2,-0.3 2,-0.4 -0.949 10.9-154.0-128.4 157.6 42.9 -13.7 33.2 19 46 A T E -BD 6 26B 0 7,-2.9 7,-2.9 -2,-0.3 2,-0.6 -0.994 10.9-134.8-136.9 130.2 39.7 -15.7 32.8 20 47 A C E + D 0 25B 0 -15,-2.8 47,-3.0 -2,-0.4 2,-0.4 -0.746 31.6 162.5 -89.1 123.4 36.4 -15.5 34.8 21 48 A I E > -eD 67 24B 1 3,-2.7 3,-1.8 -2,-0.6 47,-0.1 -0.998 68.0 -6.5-139.7 131.8 34.8 -18.8 35.8 22 49 A N T 3 S- 0 0 71 45,-0.8 -1,-0.1 -2,-0.4 3,-0.1 0.877 130.0 -52.5 47.9 47.0 32.2 -19.2 38.5 23 50 A G T 3 S+ 0 0 43 1,-0.2 37,-1.9 44,-0.1 2,-0.4 0.486 117.4 109.5 75.8 2.5 32.4 -15.5 39.6 24 51 A V E < -DF 21 59B 5 -3,-1.8 -3,-2.7 35,-0.2 2,-0.8 -0.915 64.8-138.8-114.9 138.7 36.1 -15.7 40.1 25 52 A C E -DF 20 58B 0 33,-3.3 33,-2.5 -2,-0.4 2,-0.3 -0.860 32.5-166.6 -93.3 111.3 38.8 -14.0 37.9 26 53 A W E +DF 19 57B 0 -7,-2.9 -7,-2.9 -2,-0.8 2,-0.3 -0.782 17.1 150.4-109.1 143.1 41.5 -16.6 37.5 27 54 A T E - F 0 56B 0 29,-2.3 29,-2.6 -2,-0.3 2,-0.4 -0.903 46.9 -67.3-153.2-177.8 45.1 -16.3 36.3 28 55 A V E >> - F 0 55B 0 -11,-0.5 4,-2.5 -2,-0.3 3,-1.7 -0.637 27.8-144.1 -81.3 129.0 48.6 -17.7 36.6 29 56 A Y H 3> S+ 0 0 74 25,-1.4 4,-2.2 -2,-0.4 -1,-0.1 0.844 99.8 65.4 -54.8 -35.1 50.6 -17.3 39.8 30 57 A H H 34 S+ 0 0 82 24,-0.3 -1,-0.3 1,-0.2 25,-0.1 0.606 113.7 32.6 -69.2 -7.2 53.8 -16.9 37.8 31 58 A G H <4 S+ 0 0 1 -3,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.770 130.1 30.3-107.2 -53.5 52.4 -13.7 36.4 32 59 A A H >< S- 0 0 0 -4,-2.5 3,-1.8 1,-0.2 2,-0.2 0.790 81.0-179.1 -78.4 -29.8 50.2 -12.2 39.2 33 60 A G T 3< - 0 0 14 -4,-2.2 -1,-0.2 -5,-0.4 -2,-0.1 -0.478 69.4 -34.9 59.6-125.0 52.3 -13.6 42.1 34 61 A T T 3 S+ 0 0 107 -2,-0.2 12,-0.3 15,-0.1 -1,-0.2 0.293 101.3 138.2-111.6 6.8 50.5 -12.5 45.3 35 62 A R < - 0 0 81 -3,-1.8 2,-0.2 1,-0.1 122,-0.1 0.050 52.2-119.8 -56.9 157.3 49.4 -9.1 43.9 36 63 A T - 0 0 36 120,-0.2 122,-3.1 9,-0.1 2,-0.4 -0.499 28.2-119.6 -83.8 162.5 46.1 -7.3 44.3 37 64 A I B -Ij 44 158C 5 7,-2.2 7,-2.2 120,-0.2 122,-0.2 -0.886 29.1-110.6-105.7 143.9 43.9 -6.4 41.3 38 65 A A + 0 0 40 120,-2.9 122,-0.1 -2,-0.4 -1,-0.0 -0.370 40.1 166.6 -70.9 146.1 43.0 -2.8 40.5 39 66 A S > - 0 0 44 22,-0.1 3,-2.3 -2,-0.1 120,-0.0 -0.960 51.2-105.6-148.5 159.4 39.5 -1.5 40.8 40 67 A P T 3 S+ 0 0 134 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.646 123.9 51.1 -60.7 -12.9 38.0 2.0 40.9 41 68 A K T 3 S- 0 0 199 1,-0.4 -3,-0.0 0, 0.0 0, 0.0 0.272 125.6 -91.2-103.0 8.3 37.6 1.6 44.7 42 69 A G S < S- 0 0 28 -3,-2.3 -1,-0.4 2,-0.0 -5,-0.1 -0.430 70.1 -19.5 106.3 176.1 41.2 0.5 45.2 43 70 A P - 0 0 90 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.215 55.3-148.3 -63.0 143.9 43.1 -2.8 45.3 44 71 A V B -I 37 0C 47 -7,-2.2 -7,-2.2 15,-0.1 2,-0.1 -0.942 16.3-123.4-116.0 136.1 41.2 -6.0 45.8 45 72 A I - 0 0 126 -2,-0.4 -9,-0.1 -9,-0.2 2,-0.1 -0.420 31.9 -96.5 -78.7 146.5 42.8 -9.0 47.6 46 73 A Q - 0 0 21 -12,-0.3 12,-0.3 1,-0.2 -1,-0.1 -0.402 23.9-159.2 -57.0 135.0 43.1 -12.4 46.0 47 74 A M S S+ 0 0 100 10,-2.6 2,-0.3 1,-0.3 11,-0.2 0.809 80.7 24.8 -79.8 -36.9 40.3 -14.8 47.0 48 75 A Y E +G 57 0B 53 9,-1.8 9,-2.6 -3,-0.0 2,-0.3 -0.981 59.9 179.0-133.8 142.6 42.4 -17.8 46.2 49 76 A T E +G 56 0B 69 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.958 7.1 168.2-144.7 121.1 46.2 -18.5 46.0 50 77 A N E >> -G 55 0B 38 5,-2.8 5,-2.6 -2,-0.3 4,-0.7 -0.767 9.6-179.5-143.1 89.5 47.6 -21.9 45.1 51 78 A V T 45S+ 0 0 90 -2,-0.3 3,-0.2 3,-0.2 -1,-0.1 0.802 81.2 58.9 -59.0 -35.4 51.2 -21.9 44.3 52 79 A D T 45S+ 0 0 155 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.936 112.9 36.2 -63.9 -48.7 51.3 -25.7 43.6 53 80 A Q T 45S- 0 0 67 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.503 111.0-120.3 -80.7 -4.2 48.7 -25.5 40.8 54 81 A D T <5 + 0 0 14 -4,-0.7 -25,-1.4 1,-0.2 2,-0.4 0.849 68.0 142.1 65.3 38.9 50.2 -22.1 39.6 55 82 A L E < +FG 28 50B 1 -5,-2.6 -5,-2.8 -27,-0.3 2,-0.3 -0.912 30.5 173.7-122.4 129.1 46.7 -20.6 40.2 56 83 A V E -FG 27 49B 0 -29,-2.6 -29,-2.3 -2,-0.4 2,-0.3 -0.969 9.7-165.6-126.8 155.5 45.4 -17.3 41.6 57 84 A G E +FG 26 48B 0 -9,-2.6 -10,-2.6 -2,-0.3 -9,-1.8 -1.000 8.7 178.7-139.1 137.0 41.9 -15.9 41.9 58 85 A W E -F 25 0B 0 -33,-2.5 -33,-3.3 -2,-0.3 -12,-0.1 -0.850 47.9 -83.5-118.7 165.3 40.2 -12.5 42.5 59 86 A P E -F 24 0B 53 0, 0.0 -35,-0.2 0, 0.0 -36,-0.1 -0.474 63.0 -94.0 -63.3 141.9 36.5 -11.6 42.6 60 87 A A - 0 0 32 -37,-1.9 3,-0.1 -2,-0.1 6,-0.0 -0.326 45.6-125.7 -61.4 137.7 35.5 -10.9 39.0 61 88 A P > - 0 0 27 0, 0.0 3,-1.1 0, 0.0 2,-0.1 -0.250 32.1 -79.6 -78.5 167.6 35.7 -7.2 38.1 62 89 A Q T 3 S+ 0 0 179 1,-0.2 3,-0.1 -59,-0.0 0, 0.0 -0.413 117.1 36.3 -55.9 139.0 33.0 -4.9 36.6 63 90 A G T 3 S+ 0 0 9 1,-0.3 -59,-2.0 -2,-0.1 -1,-0.2 0.496 97.3 111.0 94.8 4.1 32.7 -5.5 32.8 64 91 A S B < -a 4 0A 15 -3,-1.1 -1,-0.3 -61,-0.3 2,-0.3 -0.576 47.3-160.6-111.1 173.9 33.2 -9.2 33.0 65 92 A R - 0 0 99 -61,-1.3 -45,-0.3 -2,-0.2 2,-0.3 -0.976 26.4-110.4-153.9 140.0 31.1 -12.4 32.5 66 93 A S - 0 0 42 -2,-0.3 2,-0.3 -47,-0.1 -45,-0.3 -0.585 19.9-137.8 -84.4 140.2 31.7 -15.9 33.7 67 94 A L B -e 21 0B 6 -47,-3.0 -45,-0.8 -2,-0.3 55,-0.1 -0.726 24.2-122.9 -83.4 142.3 32.6 -18.8 31.4 68 95 A T - 0 0 49 -2,-0.3 55,-2.5 53,-0.2 2,-0.0 -0.686 29.9-110.0 -89.9 142.2 30.8 -22.0 32.2 69 96 A P B -k 123 0D 30 0, 0.0 2,-0.2 0, 0.0 55,-0.2 -0.358 33.5-102.8 -67.4 149.5 33.1 -25.1 32.9 70 97 A C + 0 0 18 53,-3.2 75,-0.0 1,-0.1 53,-0.0 -0.508 42.9 163.9 -67.8 137.2 33.3 -28.0 30.4 71 98 A T + 0 0 76 -2,-0.2 -1,-0.1 229,-0.0 2,-0.1 0.384 55.1 84.6-133.8 -7.2 31.3 -31.1 31.4 72 99 A C S S- 0 0 16 228,-0.0 46,-0.0 1,-0.0 203,-0.0 -0.279 87.0-125.0 -71.6 178.4 31.2 -32.9 28.0 73 100 A G + 0 0 76 -2,-0.1 -1,-0.0 -3,-0.0 -3,-0.0 0.083 49.5 157.2-119.2 31.3 34.5 -34.8 27.9 74 101 A S - 0 0 17 1,-0.1 -4,-0.0 2,-0.1 -2,-0.0 -0.054 34.9-163.4 -66.8 155.3 35.9 -33.6 24.7 75 102 A S + 0 0 35 2,-0.1 16,-3.4 16,-0.1 2,-0.8 0.274 67.5 96.9-118.7 8.9 39.6 -33.6 23.7 76 103 A D E +L 90 0D 74 14,-0.2 2,-0.2 12,-0.0 14,-0.2 -0.888 60.6 176.4 -89.5 109.7 39.2 -31.1 20.9 77 104 A L E -L 89 0D 1 12,-2.9 12,-2.2 -2,-0.8 2,-0.4 -0.699 25.4-147.2-116.3 163.2 40.2 -27.9 22.6 78 105 A Y E -LM 88 117D 34 39,-2.0 39,-2.9 -2,-0.2 2,-0.4 -0.974 9.0-152.0-136.8 122.2 40.6 -24.3 21.4 79 106 A L E -LM 87 116D 0 8,-2.9 8,-2.6 -2,-0.4 2,-0.5 -0.778 9.0-151.2 -93.9 132.6 43.2 -21.9 23.0 80 107 A V E -L 86 0D 1 35,-1.9 6,-0.2 -2,-0.4 47,-0.1 -0.923 14.3-155.6-106.8 126.7 42.3 -18.2 22.9 81 108 A T > - 0 0 0 4,-2.4 3,-1.9 -2,-0.5 27,-0.1 -0.391 33.7 -97.7 -96.8 175.1 45.3 -15.9 22.8 82 109 A R T 3 S+ 0 0 44 1,-0.3 26,-0.1 27,-0.2 -1,-0.1 0.674 125.3 54.9 -68.1 -18.2 45.7 -12.2 23.8 83 110 A H T 3 S- 0 0 102 24,-0.2 -1,-0.3 2,-0.1 289,-0.2 0.214 121.0-110.0 -92.6 13.0 45.2 -11.2 20.2 84 111 A A S < S+ 0 0 15 -3,-1.9 2,-0.2 1,-0.2 -2,-0.1 0.729 70.7 147.0 62.3 24.8 41.9 -13.1 20.2 85 112 A D - 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