==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM/VIRAL PROTEIN 27-JAN-12 4DGY . COMPND 2 MOLECULE: HCV1 HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.KONG,I.A.WILSON,M.LAW . 450 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20800.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 178 39.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 51 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 3 4 6 3 4 9 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 5 1 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 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 H E 0 0 187 0, 0.0 2,-0.3 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 136.3 4.3 -32.7 -2.8 2 2 H V + 0 0 40 24,-0.1 2,-0.3 22,-0.1 24,-0.2 -0.583 360.0 170.4 -75.8 130.7 4.8 -29.6 -5.1 3 3 H Q E -A 25 0A 76 22,-2.3 22,-1.8 -2,-0.3 2,-0.3 -0.995 26.2-170.6-140.1 147.1 5.6 -30.5 -8.7 4 4 H L E -A 24 0A 8 -2,-0.3 111,-0.6 20,-0.2 2,-0.6 -0.865 17.9-168.0-134.9 99.2 5.9 -28.7 -12.0 5 5 H L E -A 23 0A 99 18,-2.6 18,-2.7 -2,-0.3 2,-0.2 -0.798 6.8-159.3 -99.0 119.9 6.2 -31.2 -14.8 6 6 H E E +A 22 0A 34 -2,-0.6 2,-0.3 16,-0.2 16,-0.2 -0.628 17.8 157.8-100.1 154.3 7.2 -29.8 -18.2 7 7 H S E +A 21 0A 62 14,-2.1 14,-2.7 -2,-0.2 3,-0.1 -0.954 40.0 76.8-157.9 175.8 6.9 -31.1 -21.7 8 8 H G + 0 0 37 1,-0.3 11,-0.2 -2,-0.3 14,-0.0 0.263 64.6 133.3 101.3 -9.3 6.7 -30.0 -25.3 9 9 H G + 0 0 30 12,-0.1 -1,-0.3 9,-0.1 2,-0.3 -0.178 24.1 97.2 -70.6 165.2 10.5 -29.5 -25.7 10 10 H G E S-d 119 0B 27 108,-0.8 110,-2.5 -3,-0.1 2,-0.4 -0.972 70.3 -30.0 153.3-165.3 12.5 -30.7 -28.6 11 11 H V E +d 120 0B 67 -2,-0.3 2,-0.3 108,-0.2 110,-0.2 -0.708 54.0 172.2 -89.5 135.3 14.1 -29.9 -31.9 12 12 H V E -d 121 0B 14 108,-2.4 110,-2.0 -2,-0.4 3,-0.1 -0.997 30.8-116.0-142.2 141.7 12.4 -27.3 -34.1 13 13 H Q > - 0 0 98 -2,-0.3 3,-2.2 108,-0.2 73,-0.2 -0.522 44.8 -89.7 -76.7 147.7 13.4 -25.6 -37.3 14 14 H P T 3 S+ 0 0 49 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.256 114.6 25.2 -52.5 137.8 14.1 -21.9 -37.4 15 15 H G T 3 S+ 0 0 55 71,-2.8 70,-0.5 1,-0.3 72,-0.1 0.182 103.8 101.8 89.8 -17.5 10.9 -19.9 -38.2 16 16 H R < - 0 0 154 -3,-2.2 70,-1.8 70,-0.1 -1,-0.3 -0.223 66.4-113.6 -89.8-173.7 8.6 -22.7 -36.9 17 17 H S - 0 0 58 67,-0.2 2,-0.3 68,-0.1 67,-0.2 -0.853 20.7-173.7-125.1 155.6 6.6 -22.9 -33.6 18 18 H L E - B 0 83A 33 65,-2.1 65,-3.5 -2,-0.3 2,-0.5 -0.977 14.0-147.7-138.7 151.6 6.6 -25.0 -30.4 19 19 H R E - B 0 82A 109 -2,-0.3 2,-0.3 63,-0.2 63,-0.2 -0.984 14.4-157.5-120.0 121.5 4.2 -25.0 -27.5 20 20 H L E - B 0 81A 0 61,-2.7 61,-2.2 -2,-0.5 2,-0.3 -0.707 7.5-158.8 -91.6 148.0 5.6 -25.8 -24.0 21 21 H S E -AB 7 80A 24 -14,-2.7 -14,-2.1 -2,-0.3 2,-0.4 -0.943 11.3-168.7-126.0 151.4 3.4 -27.1 -21.2 22 22 H a E -AB 6 79A 0 57,-2.1 57,-3.0 -2,-0.3 2,-0.6 -0.974 8.8-161.3-139.4 117.6 3.9 -27.2 -17.4 23 23 H T E -AB 5 78A 62 -18,-2.7 -18,-2.6 -2,-0.4 2,-0.3 -0.922 11.6-155.2-107.4 122.3 1.5 -29.3 -15.3 24 24 H A E +A 4 0A 3 53,-2.8 2,-0.3 -2,-0.6 -20,-0.2 -0.655 18.0 166.1 -98.0 150.7 1.3 -28.4 -11.7 25 25 H S E +A 3 0A 46 -22,-1.8 -22,-2.3 -2,-0.3 3,-0.1 -0.976 50.6 47.4-156.7 151.4 0.3 -30.6 -8.8 26 26 H G S S+ 0 0 52 -2,-0.3 2,-0.3 1,-0.3 -24,-0.1 0.535 103.9 54.6 94.5 7.5 0.5 -30.5 -5.0 27 27 H F S S- 0 0 35 -24,-0.1 2,-1.4 -26,-0.1 -1,-0.3 -0.968 98.9 -84.2-157.0 170.5 -0.8 -27.0 -4.5 28 28 H T > - 0 0 87 -2,-0.3 3,-2.2 1,-0.2 4,-0.2 -0.648 40.6-166.8 -83.9 92.5 -3.7 -24.8 -5.4 29 29 H F G > S+ 0 0 3 -2,-1.4 3,-1.8 1,-0.3 -1,-0.2 0.814 79.3 65.2 -49.5 -43.5 -2.6 -23.7 -8.9 30 30 H N G 3 S+ 0 0 85 1,-0.3 -1,-0.3 44,-0.1 44,-0.1 0.696 94.8 60.0 -51.0 -27.9 -5.2 -20.9 -9.2 31 31 H N G < S+ 0 0 99 -3,-2.2 2,-0.4 2,-0.0 -1,-0.3 0.380 95.1 74.9 -91.5 6.6 -3.6 -19.0 -6.3 32 32 H Y < - 0 0 45 -3,-1.8 2,-0.2 -4,-0.2 68,-0.1 -0.939 68.6-134.9-125.1 138.6 -0.2 -18.4 -7.9 33 33 H G - 0 0 0 -2,-0.4 66,-2.4 66,-0.1 2,-0.3 -0.531 32.6-152.9 -71.4 158.1 1.3 -16.3 -10.6 34 34 H M E -EF 51 98B 0 17,-2.4 17,-2.5 64,-0.2 2,-0.3 -0.952 11.2-164.9-141.3 155.1 3.6 -18.2 -12.9 35 35 H H E -EF 50 97B 0 62,-2.4 62,-2.4 -2,-0.3 2,-0.4 -0.912 17.4-139.2-136.6 157.4 6.6 -17.5 -15.1 36 36 H W E +EF 49 96B 0 13,-1.9 12,-2.4 -2,-0.3 13,-1.4 -0.980 27.0 174.2-114.3 139.3 8.8 -18.9 -17.9 37 37 H V E -EF 47 95B 0 58,-2.4 58,-3.5 -2,-0.4 2,-0.3 -0.991 12.3-156.2-141.2 136.2 12.6 -18.4 -17.6 38 38 H R E -EF 46 94B 13 8,-2.3 8,-2.6 -2,-0.3 2,-0.4 -0.768 2.9-156.8-114.2 164.7 15.3 -19.8 -19.9 39 39 H Q E +EF 45 93B 28 54,-2.1 54,-2.5 -2,-0.3 6,-0.2 -0.998 11.6 175.0-143.5 137.3 18.9 -20.5 -19.4 40 40 H T E > -E 44 0B 32 4,-1.5 4,-1.8 -2,-0.4 52,-0.1 -0.956 39.7-117.0-134.2 155.8 22.0 -20.9 -21.6 41 41 H P T 4 S+ 0 0 142 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.867 112.8 36.9 -58.8 -38.1 25.7 -21.4 -20.7 42 42 H G T 4 S+ 0 0 79 1,-0.1 -3,-0.0 2,-0.1 0, 0.0 0.824 125.7 32.8 -88.6 -34.8 26.7 -18.0 -22.3 43 43 H K T 4 S- 0 0 153 1,-0.3 -1,-0.1 3,-0.0 2,-0.1 0.505 92.7-152.7-101.6 -5.4 23.8 -15.7 -21.4 44 44 H G E < -E 40 0B 15 -4,-1.8 -4,-1.5 282,-0.1 2,-0.3 -0.341 51.9 -6.9 71.9-150.6 22.8 -17.2 -18.1 45 45 H L E -E 39 0B 13 280,-0.4 279,-0.4 -6,-0.2 2,-0.4 -0.643 62.4-175.9 -85.4 135.3 19.3 -16.9 -16.7 46 46 H E E -E 38 0B 54 -8,-2.6 -8,-2.3 -2,-0.3 2,-0.2 -0.955 20.2-137.5-136.5 114.7 16.8 -14.7 -18.6 47 47 H W E +E 37 0B 10 -2,-0.4 -10,-0.2 275,-0.4 275,-0.1 -0.481 25.1 174.6 -67.5 140.2 13.2 -14.0 -17.5 48 48 H L E - 0 0 0 -12,-2.4 13,-2.7 1,-0.4 2,-0.3 0.778 50.5 -10.8-116.4 -43.3 10.7 -14.3 -20.4 49 49 H A E -EG 36 60B 0 -13,-1.4 -13,-1.9 11,-0.2 -1,-0.4 -0.994 44.3-157.1-162.2 153.9 7.1 -13.9 -19.2 50 50 H V E -EG 35 59B 0 9,-2.2 9,-1.8 -2,-0.3 2,-0.4 -0.987 2.6-166.5-135.2 145.1 4.7 -13.8 -16.2 51 51 H I E -EG 34 58B 0 -17,-2.5 -17,-2.4 -2,-0.3 7,-0.2 -1.000 15.5-156.8-129.2 132.8 1.0 -14.5 -15.9 52 52 H W - 0 0 0 5,-2.7 5,-0.1 2,-0.4 -20,-0.1 0.021 45.9 -64.1 -95.4-158.9 -0.8 -13.4 -12.8 53 52AH F S S+ 0 0 67 -22,-0.1 2,-0.3 -20,-0.1 -21,-0.1 0.911 118.5 63.0 -58.2 -43.7 -4.1 -14.6 -11.1 54 53 H D S > S- 0 0 85 1,-0.1 3,-1.8 3,-0.0 -2,-0.4 -0.624 86.3-127.2 -88.2 142.6 -6.2 -13.5 -14.1 55 54 H E T 3 S+ 0 0 149 -2,-0.3 17,-0.1 1,-0.3 -1,-0.1 0.748 108.2 48.1 -59.8 -29.0 -5.8 -15.0 -17.5 56 55 H N T 3 S+ 0 0 129 1,-0.1 2,-1.0 15,-0.1 -1,-0.3 0.386 85.6 98.1 -93.0 3.5 -5.4 -11.6 -19.3 57 56 H N < + 0 0 9 -3,-1.8 -5,-2.7 -5,-0.1 2,-0.3 -0.756 55.9 139.6-100.6 90.4 -2.8 -10.2 -16.8 58 57 H K E -G 51 0B 64 -2,-1.0 2,-0.3 -7,-0.2 -7,-0.2 -0.931 31.7-171.3-137.0 150.7 0.5 -10.8 -18.5 59 58 H Y E -G 50 0B 52 -9,-1.8 -9,-2.2 -2,-0.3 2,-0.3 -0.984 10.9-161.4-142.4 154.4 3.9 -9.2 -19.2 60 59 H Y E -G 49 0B 34 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.2 -0.923 23.9-107.5-132.4 154.5 6.9 -10.2 -21.4 61 60 H A >> - 0 0 14 -13,-2.7 3,-1.6 -2,-0.3 4,-1.5 -0.505 36.4-116.9 -71.2 150.5 10.6 -9.5 -21.9 62 61 H D T 34 S+ 0 0 131 1,-0.3 -1,-0.1 2,-0.2 -14,-0.1 0.824 111.4 66.3 -54.9 -34.1 11.5 -7.4 -24.9 63 62 H S T 34 S+ 0 0 45 1,-0.2 -1,-0.3 4,-0.0 -15,-0.1 0.660 117.0 22.1 -67.0 -18.4 13.4 -10.3 -26.4 64 63 H V T X> S+ 0 0 0 -3,-1.6 4,-2.5 -16,-0.2 3,-2.2 0.456 84.8 128.0-127.9 -6.2 10.2 -12.4 -26.9 65 64 H R T 3< S+ 0 0 117 -4,-1.5 4,-0.1 1,-0.3 -16,-0.0 -0.280 81.8 16.8 -58.6 135.2 7.3 -9.9 -27.0 66 65 H G T 34 S+ 0 0 79 2,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.203 125.9 57.9 87.3 -18.4 5.1 -10.4 -30.0 67 66 H R T <4 S+ 0 0 34 -3,-2.2 17,-1.9 1,-0.2 2,-0.4 0.735 101.0 49.8-108.2 -40.2 6.5 -13.9 -30.7 68 67 H F E < -C 83 0A 2 -4,-2.5 -2,-0.4 15,-0.2 2,-0.4 -0.847 62.6-164.8-105.8 142.7 5.8 -15.8 -27.4 69 68 H T E -C 82 0A 62 13,-2.4 13,-2.8 -2,-0.4 2,-0.4 -0.988 6.1-154.3-128.5 126.3 2.5 -16.0 -25.6 70 69 H I E +C 81 0A 0 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.778 24.1 163.7 -95.5 141.5 2.0 -17.2 -22.0 71 70 H S E -C 80 0A 27 9,-1.8 9,-3.0 -2,-0.4 2,-0.4 -0.978 22.4-145.7-150.9 162.0 -1.4 -18.6 -21.0 72 71 H R E -C 79 0A 24 -2,-0.3 2,-0.5 7,-0.2 7,-0.2 -0.987 7.9-163.2-134.1 143.5 -3.0 -20.7 -18.3 73 72 H D E > > -C 78 0A 55 5,-2.8 5,-2.0 -2,-0.4 3,-1.2 -0.868 10.4-176.4-119.9 93.4 -5.7 -23.3 -18.1 74 73 H N G > 5S+ 0 0 46 -2,-0.5 3,-1.6 1,-0.3 -44,-0.1 0.857 78.6 65.2 -60.5 -34.1 -6.7 -23.5 -14.4 75 74 H S G 3 5S+ 0 0 104 1,-0.3 -1,-0.3 -3,-0.1 -45,-0.0 0.813 114.5 32.1 -61.2 -28.1 -9.2 -26.3 -15.0 76 75 H K G < 5S- 0 0 135 -3,-1.2 -1,-0.3 2,-0.2 -2,-0.2 0.218 107.5-122.3-111.5 14.5 -6.3 -28.6 -16.1 77 76 H N T < 5 + 0 0 70 -3,-1.6 -53,-2.8 -4,-0.2 2,-0.4 0.853 66.0 142.5 47.9 41.8 -3.7 -27.0 -13.7 78 77 H T E < -BC 23 73A 12 -5,-2.0 -5,-2.8 -55,-0.2 2,-0.4 -0.926 41.7-161.0-124.0 137.4 -1.5 -26.2 -16.8 79 78 H L E -BC 22 72A 0 -57,-3.0 -57,-2.1 -2,-0.4 2,-0.3 -0.923 18.1-163.0-108.4 140.0 0.7 -23.4 -17.9 80 79 H F E -BC 21 71A 35 -9,-3.0 -9,-1.8 -2,-0.4 2,-0.4 -0.907 18.2-164.2-123.5 154.0 1.6 -22.9 -21.5 81 80 H L E -BC 20 70A 0 -61,-2.2 -61,-2.7 -2,-0.3 2,-0.6 -0.928 11.8-158.6-131.9 110.4 4.2 -21.0 -23.6 82 81 H Q E -BC 19 69A 46 -13,-2.8 -13,-2.4 -2,-0.4 2,-0.6 -0.801 12.1-163.2 -86.8 118.4 3.4 -20.7 -27.3 83 82 H M E +BC 18 68A 0 -65,-3.5 -65,-2.1 -2,-0.6 3,-0.2 -0.905 13.2 175.0-112.0 107.4 6.7 -20.0 -29.0 84 82AH N + 0 0 55 -17,-1.9 -67,-0.2 -2,-0.6 -68,-0.1 -0.674 56.4 21.1-108.8 160.9 6.4 -18.6 -32.6 85 82BH S S S- 0 0 67 -70,-0.5 -1,-0.2 -2,-0.2 -68,-0.1 0.888 83.1-158.8 54.0 50.2 9.0 -17.4 -35.1 86 82CH L - 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