==== 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 PLANT PROTEIN, BIOSYNTHETIC PROTEIN 22-JUL-09 3IE5 . COMPND 2 MOLECULE: PHENOLIC OXIDATIVE COUPLING PROTEIN HYP-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HYPERICUM PERFORATUM; . AUTHOR K.MICHALSKA,H.FERNANDES,M.M.SIKORSKI,M.JASKOLSKI . 324 2 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16551.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 35.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 2 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 . 16 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 21.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 2 4 0 2 2 0 0 2 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 0 0 0 0 0 0 0 0 0 1 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 A T 0 0 151 0, 0.0 128,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -28.2 0.2 -21.2 -0.9 2 1 A M + 0 0 125 126,-0.2 2,-0.2 2,-0.0 125,-0.1 0.040 360.0 110.3-107.2 23.0 -0.0 -19.2 -4.1 3 2 A A S S- 0 0 58 1,-0.1 126,-0.3 126,-0.1 118,-0.0 -0.517 80.7 -86.5 -91.7 165.3 -2.8 -17.0 -2.8 4 3 A A - 0 0 22 -2,-0.2 2,-0.5 118,-0.1 118,-0.2 -0.306 42.0-138.5 -63.2 158.7 -2.5 -13.3 -2.0 5 4 A Y E -A 121 0A 37 116,-2.2 116,-3.0 -3,-0.1 2,-0.4 -0.984 19.4-167.5-133.1 117.6 -1.4 -12.7 1.6 6 5 A T E -Ab 120 167A 0 160,-2.7 162,-3.4 -2,-0.5 163,-1.1 -0.895 9.5-173.9-119.7 139.4 -3.0 -9.9 3.7 7 6 A I E -Ab 119 169A 8 112,-2.4 112,-2.8 -2,-0.4 2,-0.4 -0.960 6.8-162.4-122.4 144.2 -2.1 -8.3 7.0 8 7 A V E -Ab 118 170A 6 161,-2.1 163,-2.8 -2,-0.3 2,-0.3 -0.976 10.1-177.3-125.5 140.3 -4.3 -5.8 8.9 9 8 A K E -Ab 117 171A 66 108,-2.5 108,-2.5 -2,-0.4 2,-0.4 -0.997 8.1-169.8-139.9 139.6 -2.9 -3.6 11.6 10 9 A E E +Ab 116 172A 8 161,-2.3 163,-2.3 -2,-0.3 2,-0.3 -0.978 16.2 155.6-127.0 140.5 -4.5 -1.0 14.0 11 10 A E E -Ab 115 173A 17 104,-1.8 104,-2.6 -2,-0.4 2,-0.2 -0.965 33.1-125.3-157.0 146.0 -2.7 1.4 16.2 12 11 A E E -A 114 0A 103 161,-0.6 102,-0.2 -2,-0.3 -2,-0.0 -0.667 22.5-164.6 -89.2 152.5 -3.5 4.8 17.9 13 12 A S E -A 113 0A 8 100,-2.4 100,-2.7 -2,-0.2 96,-0.2 -0.979 27.1-137.9-133.2 146.2 -1.3 7.9 17.5 14 13 A P S S+ 0 0 101 0, 0.0 2,-0.2 0, 0.0 100,-0.1 0.641 80.8 98.8 -75.9 -8.4 -1.1 11.1 19.4 15 14 A I S S- 0 0 10 98,-0.1 -2,-0.2 1,-0.1 97,-0.1 -0.571 86.0-109.2 -82.8 137.9 -0.8 13.0 16.1 16 15 A A >> - 0 0 22 -2,-0.2 4,-2.2 96,-0.1 3,-0.7 -0.337 28.1-120.3 -63.7 147.5 -4.1 14.5 14.7 17 16 A P H 3> S+ 0 0 10 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.802 107.9 60.8 -70.8 -26.7 -5.3 12.6 11.6 18 17 A H H 3> S+ 0 0 74 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.905 112.0 41.2 -65.2 -31.8 -5.2 15.5 9.2 19 18 A R H <> S+ 0 0 25 -3,-0.7 4,-2.5 2,-0.2 -1,-0.2 0.925 115.7 48.6 -76.2 -45.1 -1.4 15.7 9.8 20 19 A L H X S+ 0 0 3 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.904 110.3 52.6 -62.3 -41.6 -0.8 12.0 9.8 21 20 A F H X>S+ 0 0 5 -4,-2.9 4,-1.7 -5,-0.2 5,-1.5 0.924 111.8 45.4 -63.5 -39.6 -2.8 11.6 6.6 22 21 A K H <>S+ 0 0 68 -4,-1.5 5,-2.9 -5,-0.3 -2,-0.2 0.945 117.6 44.2 -64.8 -44.5 -0.7 14.2 4.8 23 22 A A H <5S+ 0 0 0 -4,-2.5 8,-0.2 1,-0.2 -2,-0.2 0.899 122.2 35.4 -69.9 -39.0 2.5 12.8 6.1 24 23 A L H <5S+ 0 0 19 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.593 136.2 4.9 -89.8 -17.7 1.8 9.1 5.5 25 24 A V T ><5S+ 0 0 2 -4,-1.7 3,-0.9 -5,-0.3 4,-0.4 0.548 123.9 37.0-129.3 -73.8 -0.2 9.4 2.2 26 25 A L T 3 > S+ 0 0 43 -3,-0.9 4,-2.0 1,-0.3 3,-0.9 0.892 72.2 61.5 -57.4 -36.3 4.5 11.2 1.9 29 28 A H H 34 S+ 0 0 23 -4,-0.4 4,-0.3 1,-0.3 -1,-0.3 0.743 108.2 43.6 -63.8 -21.7 6.9 11.9 -1.1 30 29 A Q H <4 S+ 0 0 113 -3,-1.7 -1,-0.3 2,-0.1 4,-0.2 0.605 117.5 44.1 -95.9 -13.9 7.8 15.3 0.5 31 30 A V H X + 0 0 7 -4,-2.7 4,-2.5 -5,-0.3 3,-2.0 -0.499 64.8 157.1-139.1 66.5 14.3 9.4 7.5 37 36 A P T 34 S+ 0 0 78 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.633 75.3 64.3 -72.6 -11.4 17.1 11.1 5.6 38 37 A H T 34 S+ 0 0 119 -3,-0.1 3,-0.1 1,-0.1 25,-0.1 0.530 115.8 28.4 -84.7 -4.2 19.3 8.1 6.5 39 38 A V T <4 S+ 0 0 21 -3,-2.0 22,-2.3 1,-0.2 2,-0.4 0.728 115.8 55.4-116.4 -43.5 17.0 5.8 4.5 40 39 A F E < -C 60 0A 15 -4,-2.5 20,-0.3 20,-0.3 -1,-0.2 -0.846 44.8-179.2-109.6 132.8 15.5 7.9 1.7 41 40 A K E S- 0 0 119 18,-2.2 2,-0.3 -2,-0.4 19,-0.2 0.801 70.1 -9.2 -93.1 -39.8 17.3 10.0 -0.9 42 41 A S E -C 59 0A 35 17,-1.3 17,-2.5 2,-0.0 2,-0.3 -0.995 46.5-165.6-158.4 160.6 14.3 11.5 -2.8 43 42 A G E +C 58 0A 21 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.976 25.5 154.4-146.9 131.7 10.6 11.4 -3.3 44 43 A E E -C 57 0A 80 13,-2.0 13,-2.7 -2,-0.3 2,-0.5 -0.993 45.2-107.4-154.4 159.4 8.7 13.0 -6.2 45 44 A I E +C 56 0A 61 -2,-0.3 11,-0.3 11,-0.2 3,-0.1 -0.801 30.2 176.2 -84.8 128.9 5.6 12.9 -8.3 46 45 A I E + 0 0 79 9,-2.6 2,-0.3 -2,-0.5 10,-0.2 0.542 68.7 17.1-109.0 -14.3 6.5 11.5 -11.7 47 46 A E E S+C 55 0A 132 8,-1.4 8,-2.3 0, 0.0 -1,-0.3 -0.966 103.5 19.2-156.4 138.5 2.9 11.4 -13.2 48 47 A G S S- 0 0 53 -2,-0.3 5,-0.1 6,-0.2 4,-0.1 -0.278 81.0 -79.9 97.3-176.9 -0.4 13.0 -12.2 49 48 A D S S- 0 0 142 3,-0.3 -1,-0.2 -2,-0.1 3,-0.1 0.283 73.5 -81.4-114.9 9.1 -1.5 15.9 -10.1 50 49 A G S S+ 0 0 27 1,-0.4 3,-0.1 -3,-0.3 -2,-0.1 0.095 106.3 79.3 109.8 -23.1 -1.4 14.7 -6.5 51 50 A G S > S- 0 0 23 1,-0.3 3,-2.2 23,-0.0 -1,-0.4 -0.061 94.5 -22.1-100.7-155.7 -4.7 12.9 -6.6 52 51 A V T 3 S+ 0 0 89 1,-0.3 -1,-0.3 24,-0.1 -3,-0.3 -0.214 129.0 27.7 -53.8 134.4 -6.0 9.7 -7.9 53 52 A G T 3 S+ 0 0 30 20,-3.2 -1,-0.3 1,-0.3 21,-0.1 0.241 86.3 141.7 98.1 -12.7 -3.8 8.2 -10.7 54 53 A T < - 0 0 0 -3,-2.2 19,-2.2 19,-0.2 2,-0.5 -0.396 37.0-156.3 -64.0 135.5 -0.7 9.9 -9.3 55 54 A V E -CD 47 72A 10 -8,-2.3 -9,-2.6 17,-0.2 -8,-1.4 -0.974 9.0-166.1-111.4 132.8 2.5 7.9 -9.5 56 55 A T E -CD 45 71A 6 15,-2.3 15,-1.6 -2,-0.5 2,-0.4 -0.829 9.6-149.3-111.8 154.1 5.4 8.7 -7.1 57 56 A K E -CD 44 70A 72 -13,-2.7 -13,-2.0 -2,-0.3 2,-0.4 -0.994 13.5-174.3-120.6 125.9 9.0 7.6 -7.3 58 57 A I E -CD 43 69A 2 11,-2.5 11,-2.2 -2,-0.4 2,-0.4 -0.965 6.0-163.9-116.1 135.0 10.9 7.1 -4.0 59 58 A T E -CD 42 68A 19 -17,-2.5 -18,-2.2 -2,-0.4 -17,-1.3 -0.909 12.3-131.1-119.1 152.4 14.6 6.3 -4.1 60 59 A F E -C 40 0A 16 7,-2.4 -20,-0.3 -2,-0.4 -21,-0.1 -0.580 31.3 -95.4 -93.7 158.4 16.7 5.0 -1.3 61 60 A V > - 0 0 37 -22,-2.3 3,-1.4 -2,-0.2 -1,-0.1 -0.230 43.0 -97.8 -65.6 164.5 20.1 6.4 -0.2 62 61 A D T 3 S+ 0 0 154 1,-0.3 -1,-0.1 3,-0.0 -2,-0.1 0.872 117.8 51.4 -47.3 -55.7 23.4 4.9 -1.5 63 62 A G T 3 S+ 0 0 80 -25,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.126 89.9 104.1 -79.6 24.2 24.2 2.6 1.4 64 63 A H S < S- 0 0 55 -3,-1.4 -4,-0.1 2,-0.2 -25,-0.0 -0.809 73.9-131.0-110.1 143.6 20.8 0.9 1.4 65 64 A P S S+ 0 0 117 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.765 90.6 66.8 -60.8 -26.6 20.0 -2.6 0.0 66 65 A L - 0 0 44 1,-0.1 -2,-0.2 -5,-0.1 3,-0.1 -0.507 59.8-168.0-100.4 161.2 17.0 -1.2 -1.9 67 66 A T - 0 0 88 1,-0.4 -7,-2.4 -2,-0.2 2,-0.3 0.747 56.0 -24.5-115.2 -58.6 17.1 1.2 -4.9 68 67 A Y E -D 59 0A 71 -9,-0.2 23,-0.7 2,-0.0 24,-0.5 -0.992 42.6-156.3-155.8 164.4 13.6 2.7 -5.8 69 68 A M E -DE 58 90A 24 -11,-2.2 -11,-2.5 -2,-0.3 2,-0.5 -0.997 7.4-152.7-140.6 143.0 9.9 2.1 -5.6 70 69 A L E -DE 57 89A 15 19,-2.8 18,-1.9 -2,-0.3 19,-1.2 -0.964 16.9-176.1-112.5 135.4 7.0 3.4 -7.7 71 70 A H E -DE 56 87A 7 -15,-1.6 -15,-2.3 -2,-0.5 2,-0.4 -0.929 10.4-153.1-123.7 150.6 3.5 3.7 -6.1 72 71 A K E -DE 55 86A 95 14,-2.3 14,-2.5 -2,-0.3 2,-0.7 -0.974 17.9-126.6-124.1 141.1 0.2 4.7 -7.6 73 72 A F E + E 0 85A 13 -19,-2.2 -20,-3.2 -2,-0.4 12,-0.2 -0.755 29.2 174.6 -87.1 114.3 -2.8 6.3 -5.8 74 73 A D E + 0 0 44 10,-2.1 2,-0.3 -2,-0.7 11,-0.2 0.883 65.4 4.4 -88.1 -41.6 -5.9 4.3 -6.6 75 74 A E E - E 0 84A 94 9,-2.0 9,-2.2 -23,-0.1 2,-0.4 -0.992 60.6-173.2-146.4 138.6 -8.5 6.0 -4.4 76 75 A I E + E 0 83A 47 -2,-0.3 2,-0.4 7,-0.2 7,-0.2 -0.991 13.4 168.8-136.6 128.0 -8.4 9.0 -2.2 77 76 A D E > > + E 0 82A 65 5,-2.9 5,-2.4 -2,-0.4 3,-0.6 -0.811 10.2 178.7-130.2 89.8 -11.1 10.3 0.2 78 77 A A G > 5S+ 0 0 50 -2,-0.4 3,-1.3 1,-0.2 -1,-0.1 0.856 75.2 59.2 -67.9 -33.3 -9.3 12.9 2.2 79 78 A A G 3 5S+ 0 0 84 1,-0.3 -1,-0.2 2,-0.1 -61,-0.0 0.821 114.5 38.1 -65.6 -31.0 -12.2 14.0 4.3 80 79 A N G < 5S- 0 0 88 -3,-0.6 26,-0.4 2,-0.1 -1,-0.3 0.286 112.0-121.3 -97.8 7.2 -12.5 10.4 5.7 81 80 A F T < 5 + 0 0 44 -3,-1.3 25,-2.0 -4,-0.2 2,-0.4 0.905 64.5 142.1 53.7 49.9 -8.7 10.0 5.8 82 81 A Y E < +EF 77 105A 43 -5,-2.4 -5,-2.9 23,-0.2 2,-0.3 -0.959 21.5 165.3-122.9 138.9 -8.8 7.0 3.4 83 82 A C E -EF 76 104A 0 21,-2.2 21,-2.9 -2,-0.4 2,-0.5 -0.974 19.8-162.6-148.3 138.5 -6.5 6.0 0.7 84 83 A K E +EF 75 103A 47 -9,-2.2 -10,-2.1 -2,-0.3 -9,-2.0 -0.973 26.3 164.7-109.1 128.7 -5.9 2.9 -1.4 85 84 A Y E -EF 73 102A 9 17,-2.2 17,-3.1 -2,-0.5 2,-0.4 -0.981 24.2-138.5-141.9 161.1 -2.5 2.9 -3.2 86 85 A T E -EF 72 101A 9 -14,-2.5 -14,-2.3 -2,-0.3 2,-0.8 -0.970 8.8-145.6-128.9 127.6 -0.3 0.2 -4.9 87 86 A L E +EF 71 100A 7 13,-3.0 13,-2.0 -2,-0.4 -16,-0.2 -0.820 35.5 161.9 -81.2 110.0 3.4 -0.5 -4.9 88 87 A F E + 0 0 77 -18,-1.9 2,-0.3 -2,-0.8 -17,-0.1 0.515 51.0 28.9-114.8 -6.9 3.7 -1.7 -8.4 89 88 A E E +E 70 0A 78 -19,-1.2 -19,-2.8 0, 0.0 -1,-0.3 -0.981 69.7 90.1-154.5 141.9 7.4 -1.5 -9.3 90 89 A G E > S-E 69 0A 13 -2,-0.3 3,-1.9 -21,-0.2 4,-0.2 -0.558 72.8 -90.4 148.8 160.0 10.8 -1.6 -7.6 91 90 A D G > S+ 0 0 55 -23,-0.7 3,-1.7 1,-0.3 -22,-0.1 0.735 113.9 73.7 -67.5 -21.3 13.6 -4.0 -6.6 92 91 A V G 3 S+ 0 0 53 -24,-0.5 -1,-0.3 1,-0.3 -23,-0.1 0.773 89.6 60.2 -61.7 -24.3 11.9 -4.5 -3.2 93 92 A L G <> S- 0 0 13 -3,-1.9 4,-1.8 1,-0.2 3,-0.5 0.598 88.2-172.9 -75.9 -11.3 9.3 -6.7 -5.1 94 93 A R T <4 - 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