==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ALLERGEN 15-MAR-00 1E09 . COMPND 2 MOLECULE: PRU AV 1; . SOURCE 2 ORGANISM_SCIENTIFIC: PRUNUS AVIUM; . AUTHOR P.NEUDECKER,J.NERKAMP,K.SCHWEIMER,H.STICHT,M.BOEHM, . 159 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9513.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 32.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 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 . 6 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 1 3 0 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 . 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 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 G 0 0 91 0, 0.0 121,-1.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -24.5 -6.2 41.8 0.2 2 2 A V E -A 121 0A 73 119,-0.2 2,-0.3 117,-0.0 119,-0.2 -0.845 360.0-142.0-104.0 135.9 -5.9 42.0 -3.7 3 3 A F E -A 120 0A 39 117,-0.9 117,-1.1 -2,-0.4 2,-0.5 -0.658 8.8-154.4 -93.6 150.5 -6.3 38.9 -5.8 4 4 A T E +A 119 0A 93 -2,-0.3 2,-0.4 115,-0.2 115,-0.2 -0.929 19.7 165.2-129.1 113.1 -4.1 38.4 -9.0 5 5 A Y E +A 118 0A 51 113,-2.6 113,-3.3 -2,-0.5 2,-0.3 -0.978 6.4 176.2-127.4 136.7 -5.4 36.2 -11.9 6 6 A E E -A 117 0A 112 -2,-0.4 2,-0.4 111,-0.3 111,-0.3 -0.974 11.9-159.2-138.3 153.8 -3.9 36.1 -15.4 7 7 A S E -A 116 0A 27 109,-1.9 109,-3.0 -2,-0.3 2,-0.4 -0.981 3.4-161.7-132.8 144.5 -4.5 34.0 -18.6 8 8 A E E +A 115 0A 137 -2,-0.4 2,-0.2 107,-0.2 107,-0.2 -0.976 28.2 129.2-130.4 127.3 -2.3 33.4 -21.6 9 9 A F E -A 114 0A 40 105,-1.8 105,-3.8 -2,-0.4 2,-0.3 -0.865 36.4-128.5-155.1-171.5 -3.4 32.1 -25.0 10 10 A T E -A 113 0A 90 103,-0.3 2,-0.3 -2,-0.2 103,-0.3 -0.891 9.5-152.9-142.8 174.0 -3.2 32.9 -28.8 11 11 A S E -A 112 0A 14 101,-3.0 101,-3.8 -2,-0.3 134,-0.0 -0.999 26.3-129.0-151.6 148.3 -5.4 33.4 -31.8 12 12 A E S S+ 0 0 140 -2,-0.3 101,-0.1 99,-0.3 -1,-0.1 0.591 89.4 86.9 -74.1 -6.1 -5.1 32.9 -35.6 13 13 A I S S- 0 0 9 99,-0.2 99,-0.2 1,-0.1 -2,-0.2 -0.690 90.6-100.6 -95.9 150.1 -6.4 36.5 -36.0 14 14 A P > - 0 0 60 0, 0.0 4,-1.7 0, 0.0 3,-0.4 -0.363 20.8-135.4 -67.4 143.9 -4.2 39.6 -35.9 15 15 A P H > S+ 0 0 14 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.810 101.7 62.5 -71.3 -31.5 -4.1 41.6 -32.7 16 16 A P H > S+ 0 0 30 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.772 107.7 46.1 -67.4 -21.1 -4.4 45.0 -34.4 17 17 A R H > S+ 0 0 45 -3,-0.4 4,-1.4 2,-0.2 5,-0.1 0.913 116.0 41.9 -85.2 -46.2 -7.8 43.8 -35.6 18 18 A L H X S+ 0 0 3 -4,-1.7 4,-3.3 2,-0.2 5,-0.3 0.835 115.1 54.9 -69.0 -28.2 -9.0 42.4 -32.3 19 19 A F H X>S+ 0 0 4 -4,-2.7 4,-2.6 2,-0.2 5,-1.0 0.974 106.6 46.7 -69.3 -53.5 -7.5 45.5 -30.6 20 20 A K H <5S+ 0 0 71 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.851 120.0 45.1 -57.3 -29.9 -9.4 48.1 -32.7 21 21 A A H X5S+ 0 0 0 -4,-1.4 4,-0.8 3,-0.2 8,-0.3 0.975 114.8 41.1 -77.7 -63.6 -12.5 45.9 -32.0 22 22 A F H <5S+ 0 0 38 -4,-3.3 -3,-0.2 3,-0.1 -2,-0.2 0.884 137.4 14.5 -56.3 -39.6 -12.2 45.2 -28.2 23 23 A V T ><5S+ 0 0 10 -4,-2.6 3,-1.2 -5,-0.3 4,-0.3 0.857 133.8 37.9-102.1 -65.9 -11.1 48.7 -27.4 24 24 A L T 34X S+ 0 0 41 -4,-0.8 4,-1.9 -6,-0.4 3,-1.7 0.128 80.0 122.8-146.5 24.4 -15.0 49.2 -31.0 26 26 A A H <> S+ 0 0 17 -3,-1.2 4,-1.2 1,-0.3 3,-0.1 0.904 77.9 57.2 -57.5 -38.4 -15.8 47.5 -27.6 27 27 A D H 34 S+ 0 0 33 -4,-0.3 14,-0.5 1,-0.2 -1,-0.3 0.680 121.9 28.0 -67.7 -12.9 -19.2 49.3 -27.7 28 28 A N H <4 S+ 0 0 87 -3,-1.7 -2,-0.2 -7,-0.3 -1,-0.2 0.421 113.3 65.0-125.2 -3.8 -19.8 47.6 -31.1 29 29 A L H >X S+ 0 0 0 -4,-1.9 4,-1.8 -8,-0.3 3,-1.4 0.934 104.9 40.1 -86.0 -52.3 -17.7 44.4 -30.8 30 30 A V H 3X S+ 0 0 24 -4,-1.2 4,-1.3 1,-0.3 8,-0.3 0.911 115.6 52.3 -63.3 -41.0 -19.6 42.6 -28.0 31 31 A P H 34 S+ 0 0 35 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.376 115.5 43.3 -77.2 7.4 -23.0 43.7 -29.3 32 32 A K H <4 S+ 0 0 128 -3,-1.4 -2,-0.2 2,-0.1 -3,-0.1 0.589 110.3 51.4-122.4 -23.6 -22.0 42.3 -32.7 33 33 A I H < S- 0 0 39 -4,-1.8 -3,-0.1 1,-0.2 -4,-0.0 0.960 130.9 -13.0 -80.0 -56.3 -20.3 39.0 -31.8 34 34 A A >X - 0 0 14 -4,-1.3 3,-1.5 -5,-0.2 4,-1.0 -0.791 48.7-168.2-153.5 106.3 -23.0 37.5 -29.6 35 35 A P T 34 S+ 0 0 90 0, 0.0 24,-0.1 0, 0.0 -1,-0.1 0.461 83.6 79.1 -72.0 0.5 -26.0 39.4 -28.2 36 36 A Q T 34 S+ 0 0 152 1,-0.1 3,-0.1 22,-0.1 23,-0.1 0.636 97.4 42.2 -83.8 -11.8 -26.7 36.4 -25.9 37 37 A A T <4 S+ 0 0 35 -3,-1.5 22,-0.6 1,-0.3 23,-0.5 0.865 124.3 19.1 -98.7 -51.4 -23.9 37.6 -23.6 38 38 A I E < -B 58 0A 14 -4,-1.0 20,-0.3 -8,-0.3 -1,-0.3 -0.923 58.2-148.9-122.2 147.6 -24.4 41.4 -23.3 39 39 A K E S- 0 0 122 18,-1.1 2,-0.3 -2,-0.4 19,-0.1 0.917 72.5 -43.8 -80.1 -43.9 -27.5 43.5 -24.2 40 40 A H E - 0 0 75 17,-0.3 17,-1.9 15,-0.1 2,-0.5 -0.961 48.6-119.4-177.4 161.4 -25.6 46.6 -25.3 41 41 A S E +B 56 0A 16 -14,-0.5 2,-0.4 -2,-0.3 15,-0.2 -0.954 25.3 176.7-119.4 128.7 -22.6 48.9 -24.4 42 42 A E E -B 55 0A 94 13,-1.2 13,-1.3 -2,-0.5 2,-0.1 -0.920 25.7-134.8-133.5 111.5 -23.1 52.7 -23.7 43 43 A I E -B 54 0A 42 -2,-0.4 11,-0.3 11,-0.2 3,-0.1 -0.391 18.6-173.9 -63.0 132.9 -20.1 54.8 -22.6 44 44 A L E + 0 0 84 9,-4.2 2,-0.3 1,-0.3 10,-0.2 0.848 67.6 17.0 -96.7 -43.1 -21.1 57.1 -19.7 45 45 A E E S+B 53 0A 117 8,-1.3 8,-0.9 0, 0.0 3,-0.3 -0.956 114.2 6.4-130.8 150.1 -18.0 59.2 -19.3 46 46 A G S S- 0 0 61 -2,-0.3 5,-0.1 6,-0.3 6,-0.0 -0.339 83.9 -93.8 76.9-164.0 -15.1 60.0 -21.6 47 47 A D S S- 0 0 142 3,-0.1 -1,-0.2 -2,-0.0 -4,-0.0 0.147 80.4 -58.5-138.5 19.8 -15.1 58.7 -25.2 48 48 A G S S+ 0 0 23 -3,-0.3 3,-0.1 1,-0.3 -2,-0.1 0.322 108.7 104.1 118.2 -5.7 -13.2 55.4 -25.0 49 49 A G S > S- 0 0 29 1,-0.2 3,-1.4 22,-0.1 -1,-0.3 -0.140 86.1 -51.4 -92.3-165.9 -9.9 56.7 -23.6 50 50 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.2 0, 0.0 22,-0.2 -0.459 127.3 27.1 -69.8 134.1 -8.5 56.6 -20.0 51 51 A G T 3 S+ 0 0 40 20,-1.4 2,-0.3 1,-0.3 21,-0.1 0.359 89.2 132.5 95.3 -6.9 -11.0 57.8 -17.4 52 52 A T < - 0 0 3 -3,-1.4 19,-2.8 -8,-0.0 2,-0.7 -0.598 48.3-146.7 -80.0 136.2 -14.0 56.8 -19.6 53 53 A I E -BC 45 70A 15 -8,-0.9 -9,-4.2 -2,-0.3 -8,-1.3 -0.878 14.6-167.7-107.2 113.3 -16.7 54.9 -17.8 54 54 A K E -BC 43 69A 7 15,-3.6 15,-3.5 -2,-0.7 2,-0.6 -0.723 11.7-148.9 -98.3 148.2 -18.5 52.3 -20.0 55 55 A K E -BC 42 68A 60 -13,-1.3 -13,-1.2 -2,-0.3 2,-0.3 -0.797 14.7-169.0-118.1 92.4 -21.8 50.6 -18.9 56 56 A I E -BC 41 67A 25 11,-1.0 11,-4.0 -2,-0.6 2,-0.3 -0.576 9.1-153.1 -80.0 139.6 -22.0 47.0 -20.4 57 57 A T E - C 0 66A 0 -17,-1.9 -18,-1.1 9,-0.3 2,-0.4 -0.765 3.1-139.6-111.3 159.6 -25.4 45.3 -20.1 58 58 A F E -BC 38 65A 65 7,-4.5 7,-0.8 -20,-0.3 -20,-0.3 -0.938 9.5-164.2-119.6 139.7 -26.3 41.6 -19.9 59 59 A G + 0 0 43 -22,-0.6 2,-0.4 -2,-0.4 -21,-0.1 0.306 69.3 87.7-101.6 9.6 -29.2 39.9 -21.6 60 60 A E + 0 0 149 -23,-0.5 -21,-0.1 5,-0.0 -2,-0.1 -0.891 68.7 45.0-111.0 138.0 -28.9 36.7 -19.5 61 61 A G S S- 0 0 59 -2,-0.4 4,-0.1 1,-0.1 -3,-0.0 0.173 81.5-105.1 107.2 132.5 -30.6 36.3 -16.1 62 62 A S S S+ 0 0 139 2,-0.1 2,-0.1 -2,-0.0 -1,-0.1 0.930 106.0 65.7 -56.2 -43.9 -34.2 37.1 -15.1 63 63 A Q S S- 0 0 167 1,-0.1 -3,-0.0 -3,-0.0 0, 0.0 -0.446 109.9 -82.9 -77.8 153.7 -33.0 40.2 -13.2 64 64 A Y - 0 0 132 -2,-0.1 2,-0.4 1,-0.1 -1,-0.1 -0.238 48.8-156.8 -53.9 139.5 -31.4 43.1 -15.1 65 65 A G E +C 58 0A 6 -7,-0.8 -7,-4.5 -4,-0.1 2,-0.3 -0.971 31.0 122.2-124.3 135.6 -27.7 42.4 -15.8 66 66 A Y E -C 57 0A 64 -2,-0.4 23,-0.4 -9,-0.4 -9,-0.3 -0.946 30.7-156.8-178.9 159.4 -25.1 45.0 -16.5 67 67 A V E -C 56 0A 11 -11,-4.0 -11,-1.0 -2,-0.3 2,-0.5 -0.915 17.7-122.5-143.6 171.5 -21.7 46.4 -15.3 68 68 A K E -C 55 0A 49 19,-0.5 18,-1.7 -2,-0.3 19,-0.9 -0.965 20.5-164.8-121.2 127.3 -19.6 49.6 -15.4 69 69 A H E -CD 54 85A 31 -15,-3.5 -15,-3.6 -2,-0.5 2,-0.8 -0.931 5.5-158.0-115.3 124.7 -16.0 49.6 -16.8 70 70 A K E -CD 53 84A 96 14,-4.1 14,-3.8 -2,-0.5 -17,-0.2 -0.841 26.4-123.5-100.9 109.7 -13.6 52.5 -16.1 71 71 A I E + D 0 83A 5 -19,-2.8 -20,-1.4 -2,-0.8 12,-0.3 -0.161 30.2 179.8 -48.3 139.6 -10.9 52.6 -18.7 72 72 A D E - 0 0 75 10,-2.4 11,-0.3 1,-0.3 2,-0.2 0.728 54.5 -51.9-113.0 -40.0 -7.4 52.4 -17.1 73 73 A S E - D 0 82A 58 9,-2.7 9,-2.8 -24,-0.1 -1,-0.3 -0.875 46.3-156.0 170.4 157.0 -5.0 52.5 -20.0 74 74 A I E - 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