==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 04-JUL-05 2BVU . COMPND 2 MOLECULE: MAJOR SPERM PROTEIN, ISOFORM ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: ASCARIS SUUM; . AUTHOR M.STEWART,R.P.GRANT,T.M.ROBERTS . 493 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25296.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 272 55.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 159 32.3 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 . 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 . 1 0.2 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 . 47 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 2.8 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+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 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 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 0 PARALLEL BRIDGES PER LADDER . 0 1 0 12 0 4 4 4 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 . 4 0 6 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 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 4 A V 0 0 126 0, 0.0 91,-0.3 0, 0.0 110,-0.2 0.000 360.0 360.0 360.0 160.2 21.8 22.2 73.7 2 5 A P - 0 0 87 0, 0.0 89,-0.1 0, 0.0 110,-0.0 -0.304 360.0 -99.8 -70.3 147.5 20.9 19.9 70.7 3 6 A P - 0 0 10 0, 0.0 35,-0.0 0, 0.0 109,-0.0 -0.374 34.1-126.7 -63.6 141.6 23.5 19.3 68.1 4 7 A G - 0 0 26 1,-0.2 30,-0.2 32,-0.1 109,-0.1 -0.120 38.4 -86.4 -69.7 179.6 23.3 21.3 64.9 5 8 A D - 0 0 70 28,-0.3 28,-1.1 27,-0.1 2,-0.3 -0.309 31.2-141.8 -90.2 170.2 23.2 19.5 61.5 6 9 A I E -A 32 0A 1 26,-0.2 2,-0.4 27,-0.2 26,-0.2 -0.860 8.9-137.0-116.5 159.1 25.9 18.3 59.2 7 10 A N E -A 31 0A 101 24,-2.2 24,-3.4 -2,-0.3 2,-0.4 -0.945 22.0-169.0-107.7 141.8 26.1 18.3 55.4 8 11 A T E -A 30 0A 7 -2,-0.4 22,-0.2 22,-0.2 20,-0.0 -0.974 18.7-119.3-125.6 147.8 27.5 15.3 53.7 9 12 A Q E S+A 29 0A 61 20,-1.9 20,-2.8 -2,-0.4 2,-0.2 -0.986 107.3 37.5-125.7 122.3 28.5 14.7 50.1 10 13 A P S S- 0 0 0 0, 0.0 237,-0.1 0, 0.0 -1,-0.1 0.589 92.8-156.3 -69.6 166.9 27.0 12.7 48.7 11 14 A S S S+ 0 0 60 -2,-0.2 3,-0.1 1,-0.1 -2,-0.1 0.833 73.6 14.3 -85.0 -43.6 23.8 13.7 50.5 12 15 A Q S S- 0 0 129 1,-0.4 2,-0.3 105,-0.1 -1,-0.1 0.622 123.4 -12.8-115.0 -21.1 21.3 10.8 50.6 13 16 A K - 0 0 34 104,-0.2 2,-0.4 72,-0.0 -1,-0.4 -0.961 56.6-118.5-174.2 170.0 23.2 7.6 49.7 14 17 A I E -d 119 0B 0 104,-2.3 106,-2.7 -2,-0.3 2,-0.5 -0.988 22.4-155.1-132.6 129.8 26.5 6.2 48.3 15 18 A V E -d 120 0B 2 -2,-0.4 2,-0.4 104,-0.2 106,-0.2 -0.926 2.0-159.8-117.8 132.1 26.7 4.1 45.2 16 19 A F E -d 121 0B 0 104,-2.6 106,-3.0 -2,-0.5 2,-0.4 -0.896 15.8-135.3-112.1 136.7 29.4 1.7 44.3 17 20 A N E -d 122 0B 7 -2,-0.4 106,-0.2 104,-0.2 134,-0.1 -0.737 25.1 -94.9-101.8 135.2 30.1 0.5 40.8 18 21 A A S S+ 0 0 4 104,-2.4 2,-0.1 -2,-0.4 133,-0.1 -0.336 83.7 86.8 -56.9 155.1 30.7 -2.9 39.4 19 22 A P + 0 0 4 0, 0.0 3,-0.4 0, 0.0 -2,-0.1 0.420 49.3 179.9 -78.4 146.8 33.1 -4.6 38.8 20 23 A Y + 0 0 10 1,-0.2 54,-1.8 54,-0.1 -2,-0.1 0.052 56.4 99.1-102.6 24.2 33.5 -6.0 42.3 21 24 A D S S+ 0 0 83 52,-0.2 2,-0.3 2,-0.1 -1,-0.2 0.362 85.7 44.8 -91.6 3.6 36.5 -8.1 41.5 22 25 A D S S- 0 0 95 -3,-0.4 2,-0.3 50,-0.1 52,-0.1 -0.920 95.1 -97.7-136.6 165.0 38.8 -5.5 43.0 23 26 A K - 0 0 101 -2,-0.3 2,-0.3 49,-0.1 49,-0.2 -0.663 38.6-164.4 -82.0 140.5 38.7 -3.4 46.1 24 27 A H E - B 0 71A 43 47,-2.6 47,-3.0 -2,-0.3 2,-0.5 -0.919 9.5-155.9-125.0 150.8 37.3 0.2 45.7 25 28 A T E - B 0 70A 73 -2,-0.3 45,-0.3 45,-0.2 2,-0.2 -0.926 14.7-180.0-133.0 108.9 37.6 3.1 48.1 26 29 A Y E - B 0 69A 22 43,-2.8 43,-3.3 -2,-0.5 2,-0.2 -0.515 15.6-136.3 -99.9 169.5 35.0 5.9 47.9 27 30 A H E - B 0 68A 74 41,-0.2 2,-0.3 -2,-0.2 41,-0.2 -0.646 9.6-157.7-122.6 176.4 34.8 9.1 50.0 28 31 A I E - B 0 67A 0 39,-1.3 39,-2.6 -2,-0.2 2,-0.7 -0.924 14.7-142.9-152.2 127.3 32.3 11.2 51.9 29 32 A K E -AB 9 66A 32 -20,-2.8 -20,-1.9 -2,-0.3 2,-0.5 -0.905 18.4-166.1 -90.9 119.4 32.8 14.8 52.7 30 33 A I E -AB 8 65A 0 35,-2.5 35,-1.6 -2,-0.7 2,-0.4 -0.934 8.2-177.1-104.4 123.2 31.3 15.5 56.2 31 34 A T E -AB 7 64A 12 -24,-3.4 -24,-2.2 -2,-0.5 2,-0.9 -0.907 28.1-126.4-120.9 144.3 30.9 19.1 57.1 32 35 A N E -A 6 0A 0 31,-2.2 30,-2.5 -2,-0.4 -26,-0.2 -0.778 24.9-179.3 -92.2 107.4 29.7 20.6 60.3 33 36 A A + 0 0 50 -28,-1.1 -28,-0.3 -2,-0.9 -27,-0.2 0.197 51.7 91.1 -92.7 16.9 26.8 22.9 59.3 34 37 A G S S- 0 0 17 2,-0.2 28,-0.3 -29,-0.2 4,-0.1 -0.426 81.0-113.5-110.7-177.8 26.2 24.0 62.9 35 38 A G S S+ 0 0 74 -2,-0.1 2,-0.3 26,-0.1 -1,-0.0 0.551 91.1 55.4 -93.5 -9.7 27.2 26.8 65.3 36 39 A R S S- 0 0 106 24,-0.1 -2,-0.2 23,-0.0 2,-0.1 -0.838 92.3 -91.7-120.3 161.5 29.1 24.7 67.9 37 40 A R - 0 0 63 -2,-0.3 56,-2.0 56,-0.1 2,-0.3 -0.467 47.0-160.6 -65.1 139.7 32.1 22.3 67.8 38 41 A I E -EF 59 92C 1 21,-2.4 21,-2.5 54,-0.2 2,-0.4 -0.932 18.2-145.2-126.6 150.6 31.0 18.7 67.3 39 42 A G E -EF 58 91C 0 52,-2.3 52,-1.7 -2,-0.3 2,-0.3 -0.902 28.2-171.7-104.7 140.1 32.5 15.2 67.9 40 43 A W E -EF 57 90C 4 17,-2.8 17,-2.1 -2,-0.4 2,-0.3 -0.960 13.3-168.2-138.4 151.1 31.4 12.6 65.3 41 44 A A E -EF 56 89C 21 48,-2.9 48,-3.0 -2,-0.3 2,-0.4 -0.965 9.6-147.3-139.5 156.7 31.7 8.8 64.8 42 45 A I E + F 0 88C 17 13,-2.1 2,-0.3 -2,-0.3 46,-0.2 -0.975 13.0 177.8-130.9 139.6 31.0 6.5 61.9 43 46 A K E - F 0 87C 131 44,-2.0 44,-2.6 -2,-0.4 2,-0.3 -0.902 9.9-158.5-124.7 156.1 29.8 2.9 61.6 44 47 A T E - F 0 86C 17 -2,-0.3 3,-0.3 42,-0.2 42,-0.2 -0.962 20.3-129.7-125.1 159.7 29.0 0.6 58.6 45 48 A T S S+ 0 0 50 40,-1.5 41,-0.1 -2,-0.3 38,-0.1 0.339 93.6 46.2 -78.5 0.6 26.8 -2.5 58.5 46 49 A N >> + 0 0 13 39,-0.1 3,-3.1 4,-0.1 4,-2.4 -0.256 58.7 172.8-146.7 64.1 29.1 -5.1 56.8 47 50 A M T 34 S+ 0 0 159 1,-0.3 -1,-0.1 -3,-0.3 5,-0.1 0.530 75.1 60.8 -71.8 -10.2 32.5 -5.0 58.3 48 51 A R T 34 S+ 0 0 243 1,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.832 125.3 20.8 -72.7 -30.9 33.9 -8.0 56.5 49 52 A R T <4 S+ 0 0 14 -3,-3.1 23,-2.4 1,-0.2 2,-0.3 0.843 122.3 52.2-100.6 -46.5 33.3 -6.1 53.2 50 53 A L E < -C 71 0A 4 -4,-2.4 2,-0.3 21,-0.2 21,-0.2 -0.754 59.6-175.8-106.6 142.0 33.0 -2.4 54.1 51 54 A S E -C 70 0A 46 19,-2.4 19,-1.3 -2,-0.3 2,-0.4 -0.872 13.1-151.3-130.1 163.0 35.3 -0.1 56.0 52 55 A V E -C 69 0A 29 -2,-0.3 17,-0.2 17,-0.2 -8,-0.1 -0.992 12.5-149.9-133.0 141.7 35.5 3.4 57.4 53 56 A D E S+C 68 0A 108 15,-1.6 15,-2.6 1,-0.4 -2,-0.0 -0.871 83.0 24.8-160.1 123.5 38.6 5.6 58.0 54 57 A P S S- 0 0 44 0, 0.0 -1,-0.4 0, 0.0 3,-0.0 0.545 75.1-161.6 -77.0 151.0 38.8 7.7 60.1 55 58 A P - 0 0 72 0, 0.0 -13,-2.1 0, 0.0 2,-0.3 0.432 69.5 -3.6 -81.6 -1.7 36.2 6.2 62.4 56 59 A C E +E 41 0C 41 -15,-0.3 2,-0.3 2,-0.0 -15,-0.2 -0.965 64.7 153.2-176.0 168.8 35.7 9.4 64.3 57 60 A G E -E 40 0C 16 -17,-2.1 -17,-2.8 -2,-0.3 2,-0.3 -0.973 37.2 -91.1 178.4-172.2 36.9 13.0 64.8 58 61 A V E -E 39 0C 14 -2,-0.3 2,-0.4 41,-0.2 -19,-0.2 -0.912 29.1-166.7-127.0 153.1 36.1 16.5 65.8 59 62 A L E -E 38 0C 2 -21,-2.5 -21,-2.4 -2,-0.3 3,-0.1 -0.951 10.0-148.5-149.3 116.2 34.8 19.3 63.6 60 63 A D > - 0 0 50 -2,-0.4 3,-1.7 -23,-0.2 -28,-0.4 -0.385 53.9 -65.9 -75.6 163.6 34.6 23.0 64.3 61 64 A P T 3 S+ 0 0 51 0, 0.0 -1,-0.2 0, 0.0 -28,-0.2 -0.242 124.6 5.2 -49.3 135.4 31.7 25.0 62.7 62 65 A K T 3 S+ 0 0 100 -30,-2.5 -29,-0.1 -28,-0.3 -27,-0.1 0.174 101.2 131.3 72.8 -17.9 32.0 25.1 58.9 63 66 A E < - 0 0 67 -3,-1.7 -31,-2.2 -32,-0.1 2,-0.3 -0.358 41.5-154.3 -69.8 149.9 35.0 22.7 59.1 64 67 A K E -B 31 0A 101 -33,-0.2 2,-0.3 -3,-0.1 -33,-0.2 -0.781 12.2-164.0-124.0 158.6 35.1 19.6 56.9 65 68 A V E -B 30 0A 34 -35,-1.6 -35,-2.5 -2,-0.3 2,-0.5 -0.991 15.5-139.1-143.2 149.5 36.6 16.2 56.8 66 69 A L E -B 29 0A 91 -2,-0.3 2,-0.4 -37,-0.2 -37,-0.2 -0.923 24.1-164.9-108.3 133.9 37.1 13.7 54.0 67 70 A M E -B 28 0A 1 -39,-2.6 -39,-1.3 -2,-0.5 2,-0.5 -0.959 12.7-134.5-129.8 140.0 36.3 10.2 54.9 68 71 A A E -BC 27 53A 19 -15,-2.6 -15,-1.6 -2,-0.4 2,-0.6 -0.831 13.8-170.6-100.4 124.2 37.2 7.0 53.1 69 72 A V E -BC 26 52A 0 -43,-3.3 -43,-2.8 -2,-0.5 2,-0.3 -0.948 15.2-162.2-112.1 111.8 34.6 4.2 52.7 70 73 A S E -BC 25 51A 9 -19,-1.3 -19,-2.4 -2,-0.6 2,-0.4 -0.692 11.0-166.0-100.7 150.5 36.2 1.1 51.4 71 74 A C E -BC 24 50A 4 -47,-3.0 -47,-2.6 -2,-0.3 -21,-0.2 -0.963 13.4-148.6-136.5 112.6 34.5 -1.9 49.7 72 75 A D - 0 0 71 -23,-2.4 -50,-0.1 -2,-0.4 -49,-0.1 -0.168 36.0 -75.9 -75.5 169.2 36.4 -5.2 49.3 73 76 A T + 0 0 66 -52,-0.2 2,-0.3 -50,-0.0 -52,-0.2 -0.250 60.2 155.4 -57.3 154.9 36.0 -7.7 46.4 74 77 A F - 0 0 16 -54,-1.8 2,-1.1 -52,-0.1 -54,-0.1 -0.922 51.1 -94.2-174.8 158.4 32.9 -10.0 46.7 75 78 A N >> - 0 0 84 -2,-0.3 3,-2.1 1,-0.2 4,-2.0 -0.737 31.1-168.0 -87.9 102.5 30.7 -12.0 44.3 76 79 A A T 34 S+ 0 0 19 -2,-1.1 -1,-0.2 1,-0.3 47,-0.1 0.516 85.2 57.4 -72.1 -0.5 27.9 -9.6 43.5 77 80 A A T 34 S+ 0 0 91 1,-0.0 -1,-0.3 3,-0.0 4,-0.1 0.497 120.0 24.7 -93.9 -6.7 25.9 -12.5 41.9 78 81 A T T <4 S+ 0 0 108 -3,-2.1 -2,-0.2 2,-0.1 2,-0.1 0.615 107.8 65.0-138.2 -26.8 26.0 -14.6 45.0 79 82 A E S < S- 0 0 94 -4,-2.0 2,-0.1 1,-0.2 -5,-0.0 -0.410 90.4 -62.5-108.9 178.7 26.3 -12.6 48.2 80 83 A R + 0 0 120 1,-0.1 -1,-0.2 -2,-0.1 -2,-0.1 -0.383 48.2 159.3 -66.8 136.5 24.4 -10.0 50.2 81 84 A L + 0 0 42 -2,-0.1 3,-0.3 -3,-0.1 40,-0.3 0.410 53.0 76.5-123.4 -8.5 23.7 -6.7 48.4 82 85 A N S S+ 0 0 131 1,-0.2 37,-0.0 38,-0.1 -2,-0.0 0.764 81.9 34.0-102.5 -32.8 20.8 -5.4 50.3 83 86 A N S S+ 0 0 136 -38,-0.1 2,-0.2 35,-0.1 -1,-0.2 0.060 74.3 133.8-119.1 40.9 20.8 -3.8 53.7 84 87 A D + 0 0 4 35,-0.4 35,-2.4 -3,-0.3 2,-0.3 -0.546 20.6 150.6 -92.0 148.0 24.1 -2.0 53.8 85 88 A R E - 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