==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (SEMINAL PLASMA PROTEIN/SPP) 19-JUN-97 1SPP . COMPND 2 MOLECULE: MAJOR SEMINAL PLASMA GLYCOPROTEIN PSP-I; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR A.ROMERO,M.J.ROMAO,P.F.VARELA,I.KOLLN,J.M.DIAS,A.L.CARVALHO, . 221 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10119.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 141 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 37.6 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 . 1 0.5 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 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 1.4 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 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 RESIDUES PER ALPHA HELIX . 1 1 2 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 . 0 0 0 2 5 2 2 1 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 0 3 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 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 L 0 0 82 0, 0.0 15,-2.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 169.7 46.6 42.1 28.4 2 5 A D E -a 16 0A 36 217,-0.3 2,-0.4 13,-0.2 15,-0.2 -0.747 360.0-161.9 -93.1 142.4 49.0 40.8 31.1 3 6 A Y E +a 17 0A 48 13,-2.7 15,-2.9 -2,-0.3 7,-0.0 -0.968 24.3 162.0-129.8 137.5 50.8 37.4 30.6 4 7 A H + 0 0 107 -2,-0.4 17,-0.4 13,-0.2 2,-0.1 0.241 44.8 108.6-133.1 3.3 52.4 35.3 33.3 5 8 A A S S- 0 0 61 15,-0.1 2,-1.5 2,-0.1 15,-0.1 -0.365 81.8 -97.3 -80.6 167.5 52.7 31.9 31.6 6 9 A a S S- 0 0 30 -2,-0.1 22,-0.3 13,-0.1 -1,-0.1 -0.644 81.7 -52.1 -88.0 85.1 55.9 30.3 30.4 7 10 A G + 0 0 11 -2,-1.5 22,-0.3 20,-0.2 2,-0.2 -0.243 67.7 151.6 84.4-172.3 55.8 31.2 26.7 8 11 A G E -e 29 0B 37 20,-2.1 22,-3.0 2,-0.1 2,-0.8 -0.635 55.3 -67.8 129.7 169.8 53.1 30.8 24.1 9 12 A R E -e 30 0B 155 20,-0.2 2,-0.3 -2,-0.2 22,-0.2 -0.900 55.7-167.5 -98.1 108.8 51.8 32.3 20.8 10 13 A L E -e 31 0B 17 20,-2.6 22,-2.8 -2,-0.8 2,-0.4 -0.768 16.2-173.1-101.5 143.7 50.4 35.7 21.9 11 14 A T E +e 32 0B 92 -2,-0.3 2,-0.3 20,-0.2 22,-0.2 -0.968 32.3 130.2-133.9 114.5 48.2 37.9 19.7 12 15 A D - 0 0 27 20,-0.9 3,-0.3 -2,-0.4 -2,-0.0 -0.963 57.1-135.2-166.6 146.6 47.6 41.3 21.3 13 16 A D S S+ 0 0 62 1,-0.3 92,-2.4 -2,-0.3 2,-0.3 0.852 104.4 11.9 -73.7 -36.0 47.7 45.0 20.4 14 17 A Y E S+ B 0 104A 3 90,-0.2 2,-0.3 -3,-0.1 -1,-0.3 -0.895 79.6 169.3-145.7 109.0 49.3 45.8 23.8 15 18 A G E - B 0 103A 0 88,-2.5 88,-1.9 -2,-0.3 2,-0.5 -0.924 20.4-157.2-125.7 148.0 50.7 43.0 25.9 16 19 A T E -aB 2 102A 0 -15,-2.3 -13,-2.7 -2,-0.3 2,-0.5 -0.985 10.6-156.5-126.2 116.4 52.8 43.0 29.1 17 20 A I E -aB 3 101A 0 84,-3.0 84,-2.1 -2,-0.5 2,-0.3 -0.823 14.7-167.4 -92.8 129.5 54.8 39.8 29.8 18 21 A F E - B 0 100A 35 -15,-2.9 82,-0.2 -2,-0.5 -2,-0.0 -0.784 38.1 -64.5-115.4 163.4 55.7 39.4 33.5 19 22 A T - 0 0 17 80,-1.0 2,-0.5 -2,-0.3 -1,-0.1 -0.137 45.8-137.6 -46.6 120.5 58.1 37.0 35.3 20 23 A Y - 0 0 23 1,-0.1 76,-0.1 -15,-0.1 -15,-0.1 -0.761 18.0-169.2 -81.1 128.7 56.9 33.4 34.9 21 24 A K + 0 0 190 -2,-0.5 -1,-0.1 -17,-0.4 75,-0.1 0.414 45.6 107.8-103.1 1.8 57.5 31.9 38.4 22 25 A G S S- 0 0 23 1,-0.1 -2,-0.0 2,-0.0 -17,-0.0 -0.051 85.9 -89.5 -71.0 179.1 56.9 28.2 37.6 23 26 A P S S+ 0 0 120 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.564 90.1 105.5 -67.1 -18.1 59.5 25.4 37.5 24 27 A K - 0 0 123 1,-0.1 3,-0.1 68,-0.0 -4,-0.0 -0.499 55.2-158.5 -69.0 136.9 60.5 25.7 33.8 25 28 A T S S+ 0 0 44 -2,-0.2 65,-2.4 1,-0.2 2,-0.4 0.444 75.1 47.4 -94.5 -2.7 63.9 27.4 33.2 26 29 A E E + F 0 89B 87 63,-0.2 2,-0.4 -20,-0.1 63,-0.2 -0.981 60.8 179.2-143.8 127.3 63.2 28.5 29.6 27 30 A a E - F 0 88B 2 61,-2.7 61,-3.1 -2,-0.4 2,-0.4 -0.986 6.2-167.7-130.3 136.9 60.2 30.3 28.2 28 31 A V E - F 0 87B 42 -2,-0.4 -20,-2.1 -22,-0.3 2,-0.5 -0.989 2.0-165.4-130.4 120.9 59.6 31.5 24.6 29 32 A W E -eF 8 86B 0 57,-3.0 57,-2.6 -2,-0.4 2,-0.6 -0.938 5.7-157.7-107.2 126.0 56.8 33.8 23.6 30 33 A T E -eF 9 85B 11 -22,-3.0 -20,-2.6 -2,-0.5 2,-0.4 -0.925 14.7-149.1-104.4 121.9 56.0 34.1 19.9 31 34 A L E -e 10 0B 0 53,-3.0 52,-3.1 -2,-0.6 53,-0.5 -0.782 12.3-167.3 -99.1 131.7 54.2 37.4 19.2 32 35 A Q E +e 11 0B 56 -22,-2.8 -20,-0.9 -2,-0.4 2,-0.3 -0.907 11.4 166.2-118.0 151.6 51.7 37.7 16.4 33 36 A V - 0 0 11 -2,-0.3 49,-0.1 -22,-0.2 6,-0.1 -0.933 54.1 -76.0-155.3 159.0 50.1 40.8 14.8 34 37 A D > - 0 0 89 -2,-0.3 3,-3.2 1,-0.2 48,-0.1 -0.567 50.8-128.1 -61.0 117.0 48.1 41.5 11.7 35 38 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.2 0, 0.0 47,-0.0 0.553 103.4 75.9 -48.1 -13.3 51.0 41.3 9.1 36 39 A K T 3 S+ 0 0 157 2,-0.0 2,-0.2 0, 0.0 -2,-0.1 0.737 99.7 51.2 -72.6 -20.6 50.0 44.7 7.7 37 40 A Y S < S- 0 0 66 -3,-3.2 45,-0.5 70,-0.0 2,-0.2 -0.718 80.0-126.7-116.0 164.7 51.6 46.2 10.9 38 41 A K E -C 106 0A 91 68,-0.6 68,-2.9 -2,-0.2 2,-0.4 -0.674 24.1-118.4-106.3 158.9 54.9 45.8 12.6 39 42 A L E -CD 105 80A 0 41,-3.8 41,-2.8 -2,-0.2 2,-0.5 -0.850 14.8-153.9 -99.7 140.2 55.5 44.9 16.3 40 43 A L E -CD 104 79A 2 64,-2.7 64,-2.0 -2,-0.4 2,-0.5 -0.954 12.2-166.2-113.5 116.4 57.3 47.3 18.7 41 44 A V E -CD 103 78A 2 37,-3.3 37,-2.7 -2,-0.5 2,-0.4 -0.946 4.8-173.0-107.9 128.8 59.0 45.4 21.6 42 45 A S E +CD 102 77A 11 60,-3.1 60,-2.9 -2,-0.5 35,-0.2 -0.986 15.4 178.4-126.0 126.6 60.1 47.4 24.7 43 46 A I E - D 0 76A 1 33,-2.4 33,-0.8 -2,-0.4 3,-0.4 -0.808 21.0-170.5-125.2 80.2 62.2 46.1 27.5 44 47 A P E - D 0 75A 45 0, 0.0 31,-0.3 0, 0.0 56,-0.2 -0.473 61.0 -5.9 -74.9 149.0 62.7 49.1 29.8 45 48 A T E S- 0 0 101 29,-3.1 2,-0.3 1,-0.1 29,-0.2 0.814 78.1-167.8 32.5 67.9 65.1 49.0 32.7 46 49 A L E + D 0 73A 11 27,-2.3 27,-1.3 -3,-0.4 -1,-0.1 -0.649 13.0 174.9 -82.2 137.6 66.0 45.3 32.6 47 50 A N E + D 0 72A 110 51,-0.4 25,-0.2 -2,-0.3 2,-0.2 -0.560 14.0 150.9-146.9 79.5 67.9 44.0 35.7 48 51 A L - 0 0 5 23,-3.8 2,-1.2 -2,-0.1 23,-0.1 -0.481 59.1 -88.4-101.7 172.9 68.6 40.3 35.7 49 52 A T >> - 0 0 58 -2,-0.2 3,-2.4 2,-0.0 4,-1.4 -0.744 48.5-137.1 -85.1 95.0 71.5 38.4 37.3 50 53 A b T 34 S+ 0 0 62 -2,-1.2 4,-0.1 1,-0.3 21,-0.0 -0.268 89.0 25.9 -51.8 134.0 74.0 38.5 34.5 51 54 A G T 34 S+ 0 0 72 2,-0.4 -1,-0.3 1,-0.1 3,-0.1 -0.003 122.5 55.4 97.8 -32.0 75.6 35.1 34.1 52 55 A K T <4 S+ 0 0 76 -3,-2.4 39,-2.1 1,-0.3 2,-0.3 0.556 116.4 8.8-108.3 -13.0 72.6 33.3 35.6 53 56 A E E < +G 90 0B 4 -4,-1.4 -2,-0.4 37,-0.2 2,-0.3 -0.991 57.8 177.4-163.7 157.3 69.8 34.5 33.3 54 57 A Y E -G 89 0B 47 35,-2.2 35,-2.3 -2,-0.3 2,-0.4 -0.989 25.2-130.1-160.8 161.5 69.0 36.5 30.1 55 58 A V E -GH 88 70B 0 15,-2.5 15,-2.7 -2,-0.3 2,-0.4 -0.943 27.5-165.4-115.7 133.3 66.3 37.7 27.7 56 59 A E E -GH 87 69B 15 31,-2.9 31,-3.0 -2,-0.4 2,-0.5 -0.977 9.5-148.9-126.3 136.5 67.0 37.0 24.0 57 60 A V E -GH 86 68B 0 11,-2.0 10,-3.0 -2,-0.4 11,-1.0 -0.934 14.9-163.6-107.5 124.9 65.2 38.6 21.0 58 61 A L E -GH 85 66B 11 27,-3.2 27,-1.2 -2,-0.5 8,-0.2 -0.865 24.0-133.3-110.9 145.5 64.8 36.5 17.8 59 62 A E S S- 0 0 105 6,-3.2 22,-0.4 -2,-0.4 2,-0.2 0.834 85.9 -20.2 -63.2 -33.8 63.9 37.7 14.4 60 63 A G S S- 0 0 18 1,-0.5 25,-0.6 5,-0.3 4,-0.2 -0.524 110.2 -11.9-146.3-144.2 61.3 35.0 13.9 61 64 A A S > S- 0 0 56 -2,-0.2 3,-2.2 1,-0.2 -1,-0.5 -0.042 93.1 -65.8 -61.3 163.9 60.5 31.6 15.3 62 65 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.239 128.9 35.7 -52.6 138.4 62.9 29.8 17.6 63 66 A G T 3 S+ 0 0 85 1,-0.4 3,-0.1 -3,-0.1 -2,-0.1 0.313 95.1 117.6 96.8 -10.8 66.0 28.9 15.6 64 67 A S S < S- 0 0 37 -3,-2.2 -1,-0.4 1,-0.2 2,-0.1 -0.232 82.2 -54.1 -79.8 178.6 65.7 32.1 13.6 65 68 A K - 0 0 123 -7,-0.1 -6,-3.2 -3,-0.1 2,-0.5 -0.310 55.3-132.6 -57.9 125.7 68.4 34.9 13.7 66 69 A S E -H 58 0B 55 -8,-0.2 -8,-0.2 1,-0.1 3,-0.1 -0.721 17.2-169.2 -83.3 124.7 69.2 36.1 17.2 67 70 A L E - 0 0 71 -10,-3.0 2,-0.3 -2,-0.5 -9,-0.2 0.744 62.1 -37.7 -85.0 -26.8 69.1 39.8 17.5 68 71 A G E -H 57 0B 19 -11,-1.0 -11,-2.0 2,-0.0 2,-0.4 -0.903 41.7-135.1 171.9 160.0 70.7 40.0 21.0 69 72 A K E +H 56 0B 126 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.997 33.5 168.5-131.3 131.4 70.9 38.5 24.5 70 73 A F E -H 55 0B 46 -15,-2.7 -15,-2.5 -2,-0.4 3,-0.1 -0.952 35.1-178.6-145.6 163.1 70.9 40.8 27.6 71 74 A b S S+ 0 0 27 1,-0.5 -23,-3.8 -2,-0.3 2,-0.3 0.462 84.0 25.3-131.4 -20.8 70.6 40.9 31.4 72 75 A E E +D 47 0A 118 -25,-0.2 -1,-0.5 -23,-0.1 -25,-0.2 -0.975 63.2 139.3-143.9 151.7 70.7 44.7 32.0 73 76 A G E -D 46 0A 26 -27,-1.3 -27,-2.3 -2,-0.3 3,-0.2 -0.533 44.5-135.1 167.1 124.9 69.9 47.7 29.8 74 77 A L E S- 0 0 144 1,-0.3 -29,-3.1 -29,-0.2 2,-0.3 0.893 94.8 -2.6 -58.5 -41.9 68.1 51.0 30.4 75 78 A S E -D 44 0A 84 -31,-0.3 2,-0.5 -30,-0.1 -1,-0.3 -0.943 59.7-177.0-157.1 125.4 66.1 50.7 27.3 76 79 A I E -D 43 0A 23 -33,-0.8 -33,-2.4 -2,-0.3 2,-0.4 -0.998 14.0-178.3-122.4 121.9 66.0 48.1 24.6 77 80 A L E +D 42 0A 79 -2,-0.5 2,-0.3 -35,-0.2 -35,-0.2 -0.991 2.6 176.1-126.2 133.9 63.6 48.9 21.8 78 81 A N E -D 41 0A 44 -37,-2.7 -37,-3.3 -2,-0.4 2,-0.5 -0.972 18.4-157.7-135.8 147.3 62.9 46.7 18.8 79 82 A R E +D 40 0A 136 -2,-0.3 -39,-0.2 -39,-0.2 2,-0.2 -0.995 32.8 152.3-123.6 116.4 60.6 46.8 15.8 80 83 A G E -D 39 0A 11 -41,-2.8 -41,-3.8 -2,-0.5 2,-0.2 -0.761 38.5 -97.3-134.1-173.3 59.9 43.5 14.2 81 84 A S > - 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