==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 01-APR-97 1AG4 . COMPND 2 MOLECULE: SPHERULIN 3A; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSARUM POLYCEPHALUM; . AUTHOR B.ROSINKE,C.RENNER,E.-M.MAYR,R.JAENICKE,T.A.HOLAK . 103 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6360.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 59 57.3 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 . 34 33.0 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 . 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 . 11 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 1.9 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 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 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 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 242 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-155.1 85.8 -12.8 5.7 2 2 A S - 0 0 100 33,-0.0 2,-0.1 39,-0.0 39,-0.1 -0.978 360.0 -90.2-161.1 170.7 85.4 -11.0 2.4 3 3 A V - 0 0 20 -2,-0.3 2,-0.6 38,-0.1 28,-0.1 -0.431 35.2-126.1 -85.7 165.2 82.9 -9.3 0.1 4 4 A C E -A 30 0A 70 26,-1.2 26,-2.2 -2,-0.1 2,-0.1 -0.929 17.8-144.1-116.7 115.9 81.0 -11.2 -2.7 5 5 A K E +A 29 0A 129 -2,-0.6 24,-0.2 24,-0.2 39,-0.0 -0.380 67.9 62.4 -72.9 154.5 81.2 -9.8 -6.2 6 6 A G - 0 0 34 22,-2.1 23,-0.1 -2,-0.1 2,-0.1 0.698 68.2-147.1 95.6 100.2 78.1 -10.1 -8.4 7 7 A V - 0 0 35 21,-0.2 23,-0.1 1,-0.1 2,-0.1 -0.419 7.8-137.4 -92.5 173.0 74.9 -8.3 -7.2 8 8 A S - 0 0 95 -2,-0.1 -1,-0.1 1,-0.0 -2,-0.0 -0.223 47.3 -61.8-111.2-156.2 71.3 -9.4 -7.7 9 9 A G S S- 0 0 67 1,-0.2 -2,-0.1 -2,-0.1 -1,-0.0 0.992 112.3 -17.6 -56.1 -68.5 68.1 -7.6 -8.7 10 10 A N - 0 0 113 -3,-0.0 -1,-0.2 6,-0.0 2,-0.2 -0.997 66.3-121.9-145.3 139.5 68.0 -5.2 -5.7 11 11 A P + 0 0 7 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.530 39.1 164.0 -78.5 141.1 69.7 -5.3 -2.3 12 12 A A + 0 0 12 1,-0.3 44,-0.1 42,-0.2 42,-0.1 -0.925 42.5 37.0-148.5 173.3 67.5 -5.2 0.8 13 13 A K S S- 0 0 128 42,-0.9 -1,-0.3 -2,-0.3 44,-0.2 0.910 137.8 -24.5 43.4 91.7 67.6 -5.9 4.6 14 14 A G S S+ 0 0 6 41,-0.2 2,-0.4 42,-0.2 -1,-0.2 0.842 111.8 134.5 47.0 34.1 71.1 -4.6 5.5 15 15 A E - 0 0 51 40,-0.2 39,-1.8 17,-0.1 2,-0.4 -0.927 32.9-177.1-116.6 137.6 72.2 -5.2 1.9 16 16 A V E -BC 31 53A 3 15,-2.1 15,-2.4 -2,-0.4 2,-0.7 -0.992 14.4-152.4-134.1 133.2 74.1 -2.7 -0.2 17 17 A F E -BC 30 52A 5 35,-2.3 35,-1.8 -2,-0.4 13,-0.2 -0.880 14.9-159.4-107.2 111.8 75.1 -3.0 -3.9 18 18 A L E -BC 29 51A 4 11,-1.7 11,-1.6 -2,-0.7 2,-0.3 -0.413 2.1-157.9 -83.0 163.9 78.3 -1.1 -4.8 19 19 A Y E -BC 28 50A 46 31,-1.4 31,-1.7 9,-0.2 30,-1.0 -0.874 21.0-119.6-147.5 112.8 79.1 -0.1 -8.4 20 20 A K S S+ 0 0 71 7,-2.0 5,-0.4 -2,-0.3 27,-0.1 -0.133 88.9 7.0 -46.3 141.8 82.6 0.7 -9.8 21 21 A H S S- 0 0 62 3,-0.1 29,-2.0 5,-0.0 28,-0.5 0.140 106.2 -69.3 64.1 166.4 82.5 4.3 -11.1 22 22 A V S > S+ 0 0 26 27,-0.3 3,-1.6 1,-0.2 60,-0.2 -0.182 112.8 37.3 -82.6-177.8 79.5 6.5 -10.5 23 23 A N T 3 S- 0 0 78 58,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.895 129.5 -71.5 40.8 51.8 76.0 6.1 -12.1 24 24 A F T 3 S+ 0 0 69 -3,-0.3 2,-0.7 1,-0.2 -1,-0.3 0.868 90.1 151.7 35.6 49.3 76.4 2.2 -11.9 25 25 A Q < + 0 0 131 -3,-1.6 2,-0.3 -5,-0.4 -1,-0.2 -0.570 52.2 24.5-108.0 71.9 79.0 2.4 -14.7 26 26 A G S S- 0 0 36 -2,-0.7 -5,-0.0 -5,-0.1 21,-0.0 -0.950 105.4 -29.5 161.3-179.3 81.2 -0.6 -13.9 27 27 A D - 0 0 86 -2,-0.3 -7,-2.0 -8,-0.1 2,-0.4 -0.051 61.6-131.2 -52.4 163.0 81.2 -4.0 -12.2 28 28 A S E - B 0 19A 20 -9,-0.2 -22,-2.1 -21,-0.1 2,-0.3 -0.961 15.2-158.3-124.0 139.5 78.8 -4.4 -9.2 29 29 A W E -AB 5 18A 20 -11,-1.6 -11,-1.7 -2,-0.4 2,-0.5 -0.867 6.9-146.6-115.4 149.7 79.6 -5.8 -5.8 30 30 A K E +AB 4 17A 61 -26,-2.2 -26,-1.2 -2,-0.3 2,-0.5 -0.942 19.3 173.4-118.7 118.7 77.1 -7.2 -3.2 31 31 A V E + B 0 16A 7 -15,-2.4 -15,-2.1 -2,-0.5 4,-0.1 -0.949 11.5 170.2-126.5 115.9 77.8 -6.7 0.5 32 32 A T S S+ 0 0 70 -2,-0.5 -17,-0.1 -17,-0.2 2,-0.1 -0.157 74.1 28.6-114.1 40.0 75.2 -7.7 3.1 33 33 A G S S- 0 0 26 -17,-0.1 64,-2.2 62,-0.1 2,-0.4 -0.244 109.2 -41.8-154.7-112.3 77.4 -7.3 6.2 34 34 A N E +E 96 0B 99 62,-0.2 2,-0.3 -2,-0.1 62,-0.2 -0.998 42.1 177.3-138.7 140.6 80.3 -5.0 6.9 35 35 A V E +E 95 0B 14 60,-2.1 60,-2.2 -2,-0.4 2,-0.3 -0.773 6.4 173.8-146.9 100.2 83.3 -4.1 4.7 36 36 A Y E +E 94 0B 137 -2,-0.3 58,-0.2 58,-0.3 29,-0.1 -0.783 64.1 10.0-105.7 150.9 85.9 -1.6 5.9 37 37 A D - 0 0 55 56,-0.7 3,-0.3 -2,-0.3 -1,-0.2 0.895 65.0-165.1 48.5 96.9 89.1 -0.7 4.0 38 38 A F + 0 0 15 55,-0.5 3,-0.5 1,-0.2 -1,-0.2 -0.241 52.1 114.2-106.6 46.6 88.6 -2.4 0.6 39 39 A R S S+ 0 0 178 1,-0.2 2,-0.3 6,-0.2 6,-0.3 0.899 85.0 31.9 -82.7 -41.2 92.2 -2.2 -0.6 40 40 A S S S+ 0 0 93 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.0 -0.426 80.7 116.8-112.0 59.2 92.9 -6.0 -0.7 41 41 A V S S- 0 0 24 -3,-0.5 -1,-0.2 -2,-0.3 -38,-0.1 0.320 85.3-108.0-105.5 8.3 89.4 -7.3 -1.6 42 42 A S S S+ 0 0 112 -3,-0.2 -2,-0.1 -4,-0.0 -3,-0.0 0.984 98.3 6.4 65.4 79.3 90.4 -8.8 -4.9 43 43 A G S S+ 0 0 43 -4,-0.2 3,-0.1 2,-0.0 -3,-0.1 0.952 116.2 70.4 82.3 75.0 88.9 -6.4 -7.5 44 44 A L > + 0 0 4 1,-0.3 3,-0.7 -5,-0.2 47,-0.3 0.096 52.8 115.4 178.6 -45.6 87.4 -3.5 -5.5 45 45 A N T 3 S+ 0 0 78 -6,-0.3 2,-1.2 1,-0.3 -1,-0.3 -0.179 97.8 3.5 -46.5 131.4 90.1 -1.2 -4.0 46 46 A D T 3 S+ 0 0 103 1,-0.1 2,-1.7 -3,-0.1 45,-0.5 -0.151 109.2 98.4 82.6 -45.4 89.8 2.2 -5.7 47 47 A V < + 0 0 28 -2,-1.2 2,-0.2 -3,-0.7 -1,-0.1 -0.545 51.5 112.1 -78.4 89.0 86.7 1.1 -7.7 48 48 A V + 0 0 1 -2,-1.7 42,-1.0 -30,-0.1 44,-0.4 -0.718 23.0 111.7-160.4 103.0 83.9 2.5 -5.5 49 49 A S + 0 0 2 -30,-1.0 2,-0.5 -28,-0.5 -27,-0.3 0.495 67.1 47.9-139.3 -60.4 81.7 5.4 -6.6 50 50 A S E +C 19 0A 0 -29,-2.0 -31,-1.4 -31,-1.7 -1,-0.4 -0.787 63.8 169.6 -95.0 130.2 78.0 4.6 -7.2 51 51 A V E -CD 18 80A 9 29,-1.3 29,-2.0 -2,-0.5 2,-0.4 -0.948 20.8-153.1-135.6 156.9 76.2 2.5 -4.5 52 52 A K E -CD 17 79A 72 -35,-1.8 -35,-2.3 -2,-0.3 2,-0.3 -0.955 8.1-154.3-134.8 119.0 72.6 1.6 -3.8 53 53 A V E -CD 16 78A 11 25,-1.6 25,-1.6 -2,-0.4 -37,-0.2 -0.668 22.6-119.9 -90.6 145.6 71.2 0.8 -0.3 54 54 A G > - 0 0 1 -39,-1.8 3,-0.6 -2,-0.3 -42,-0.2 -0.324 31.3 -98.9 -78.7 167.6 68.1 -1.4 0.1 55 55 A P T 3 S+ 0 0 58 0, 0.0 -42,-0.9 0, 0.0 -41,-0.2 -0.162 105.2 29.2 -77.0 174.0 64.8 -0.4 1.6 56 56 A N T 3 S+ 0 0 130 1,-0.2 44,-0.6 -44,-0.1 2,-0.3 0.817 109.3 103.8 43.6 26.9 63.9 -1.1 5.3 57 57 A T E < -F 99 0B 1 -3,-0.6 19,-0.8 42,-0.2 2,-0.4 -0.847 65.2-143.3-131.0 169.3 67.6 -1.1 5.8 58 58 A K E -FG 98 75B 45 40,-1.2 40,-1.9 -2,-0.3 2,-0.5 -0.831 14.8-169.3-138.2 99.4 70.2 1.4 7.3 59 59 A A E -FG 97 74B 3 15,-2.1 15,-1.2 17,-0.4 2,-0.6 -0.757 3.4-165.3 -91.8 129.1 73.6 1.7 5.6 60 60 A F E -FG 96 73B 35 36,-1.9 36,-1.8 -2,-0.5 2,-0.3 -0.927 3.1-166.1-116.1 115.3 76.2 3.6 7.5 61 61 A I E -FG 95 72B 14 11,-0.8 11,-1.8 -2,-0.6 2,-0.6 -0.761 8.7-150.0 -99.3 144.7 79.3 4.7 5.5 62 62 A F E -F 94 0B 37 32,-2.1 32,-0.6 -2,-0.3 9,-0.3 -0.866 16.8-133.4-116.7 102.3 82.5 6.0 7.3 63 63 A K E S+F 93 0B 83 -2,-0.6 7,-1.8 7,-0.3 30,-0.1 -0.175 79.3 12.7 -48.9 141.1 84.5 8.5 5.3 64 64 A D S S- 0 0 64 28,-0.6 30,-0.2 5,-0.2 -27,-0.2 0.079 126.7 -23.9 72.3 166.1 88.2 7.5 5.5 65 65 A D S > S- 0 0 68 1,-0.2 3,-1.3 28,-0.1 29,-0.1 -0.083 70.8-113.3 -43.1 142.1 89.3 4.1 6.8 66 66 A R T 3 S+ 0 0 121 1,-0.3 -1,-0.2 27,-0.2 3,-0.1 0.758 118.1 64.4 -54.7 -18.4 86.6 2.7 9.1 67 67 A F T 3 S+ 0 0 187 1,-0.1 2,-0.3 -5,-0.1 -1,-0.3 0.897 119.0 3.5 -74.0 -38.1 89.3 3.2 11.8 68 68 A N S < S+ 0 0 125 -3,-1.3 2,-0.5 -6,-0.1 -1,-0.1 -0.890 97.5 61.5-140.0 171.8 89.3 7.0 11.4 69 69 A G S S- 0 0 46 -2,-0.3 2,-0.3 -3,-0.1 -5,-0.2 -0.938 89.9 -47.1 115.5-122.8 87.5 9.8 9.5 70 70 A N - 0 0 86 -7,-1.8 2,-0.3 -2,-0.5 -7,-0.3 -0.959 42.1-139.2-147.0 164.8 83.8 10.2 9.9 71 71 A F - 0 0 125 -2,-0.3 2,-0.3 -9,-0.3 -9,-0.2 -0.955 15.2-177.5-129.2 149.3 80.6 8.1 10.0 72 72 A I E -G 61 0B 47 -11,-1.8 -11,-0.8 -2,-0.3 2,-0.4 -0.999 17.3-137.8-144.9 145.9 77.1 8.7 8.6 73 73 A R E -G 60 0B 176 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.833 10.9-168.4-106.5 143.4 73.8 6.7 8.8 74 74 A L E -G 59 0B 49 -15,-1.2 -15,-2.1 -2,-0.4 -17,-0.0 -0.836 10.2-162.4-131.6 96.6 71.5 6.2 5.8 75 75 A E E +G 58 0B 128 -2,-0.4 -17,-0.2 -17,-0.3 -22,-0.1 -0.226 59.2 8.5 -71.7 167.9 68.1 4.7 6.7 76 76 A E S S- 0 0 114 -19,-0.8 -17,-0.4 -21,-0.1 -22,-0.1 0.185 113.3 -43.0 47.6 180.0 65.8 3.1 4.1 77 77 A S - 0 0 48 -19,-0.1 2,-0.3 -25,-0.0 -23,-0.3 0.096 65.6-179.0 -62.9-173.2 67.3 2.5 0.6 78 78 A S E -D 53 0A 26 -25,-1.6 -25,-1.6 -23,-0.0 2,-0.4 -0.951 26.4-133.5-179.9 161.6 69.4 5.2 -1.1 79 79 A Q E +D 52 0A 107 -2,-0.3 2,-1.3 -27,-0.2 3,-0.2 -0.786 17.8 177.3-135.2 94.6 71.3 6.0 -4.4 80 80 A V E +D 51 0A 33 -29,-2.0 -29,-1.3 -2,-0.4 -28,-0.1 -0.539 12.8 162.2 -94.7 71.3 74.8 7.4 -4.0 81 81 A T S S+ 0 0 46 -2,-1.3 -58,-0.5 -31,-0.3 2,-0.4 0.865 70.8 32.1 -59.0 -34.0 75.7 7.5 -7.7 82 82 A D + 0 0 69 -3,-0.2 -1,-0.1 -60,-0.2 -32,-0.1 -0.971 53.1 176.2-127.7 141.0 78.5 10.0 -6.9 83 83 A L > + 0 0 9 -2,-0.4 4,-2.2 2,-0.1 3,-0.1 0.102 48.7 114.1-126.4 21.3 80.7 10.2 -3.7 84 84 A T H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.939 79.4 51.6 -60.0 -44.2 83.1 13.0 -4.8 85 85 A T H 4 S+ 0 0 125 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.863 108.7 52.9 -61.9 -32.2 81.6 15.3 -2.1 86 86 A R H 4 S- 0 0 63 1,-0.1 -1,-0.2 -3,-0.1 -2,-0.2 0.927 143.4 -45.0 -71.0 -42.1 82.2 12.6 0.5 87 87 A N H < S- 0 0 61 -4,-2.2 -2,-0.2 -24,-0.1 -3,-0.2 0.023 98.6 -52.8 172.2 66.1 85.9 12.1 -0.5 88 88 A L S < S- 0 0 129 -4,-2.1 -4,-0.2 -6,-0.0 -3,-0.1 0.776 76.1 -88.0 57.7 116.1 86.8 12.0 -4.2 89 89 A N S S+ 0 0 58 2,-0.0 -40,-0.2 -42,-0.0 -7,-0.1 0.017 102.7 36.2 -45.9 162.3 84.7 9.4 -6.1 90 90 A D S S+ 0 0 40 -42,-1.0 -43,-0.2 1,-0.1 -41,-0.1 0.570 104.1 50.8 61.6 134.6 86.3 5.9 -6.1 91 91 A A + 0 0 39 -45,-0.5 -27,-0.2 -47,-0.3 -44,-0.1 0.875 66.6 168.6 75.9 35.8 88.1 4.8 -3.0 92 92 A I - 0 0 7 -44,-0.4 -28,-0.6 -46,-0.1 -44,-0.0 0.905 35.1-128.3 -45.5 -90.9 85.2 5.7 -0.7 93 93 A S E - F 0 63B 11 -30,-0.1 -56,-0.7 -58,-0.1 -55,-0.5 -0.326 57.2 -8.8 174.7 -83.3 86.4 4.0 2.6 94 94 A S E -EF 36 62B 0 -32,-0.6 -32,-2.1 -58,-0.2 2,-0.4 -0.999 49.5-163.4-143.2 145.7 84.1 1.7 4.6 95 95 A I E -EF 35 61B 6 -60,-2.2 -60,-2.1 -2,-0.3 2,-0.4 -0.991 4.9-167.7-132.5 134.2 80.4 0.7 4.3 96 96 A I E -EF 34 60B 29 -36,-1.8 -36,-1.9 -2,-0.4 2,-0.5 -0.919 10.3-148.1-120.5 146.8 78.3 -1.1 7.0 97 97 A V E + F 0 59B 15 -64,-2.2 2,-0.4 -2,-0.4 -38,-0.2 -0.938 26.7 159.2-116.9 118.9 74.8 -2.6 6.5 98 98 A A E - F 0 58B 37 -40,-1.9 -40,-1.2 -2,-0.5 -84,-0.2 -0.985 30.6-135.3-140.5 129.8 72.4 -2.5 9.5 99 99 A T E - F 0 57B 54 -2,-0.4 2,-0.2 -42,-0.2 -42,-0.2 -0.271 38.7 -89.9 -75.7 168.5 68.6 -2.9 9.5 100 100 A F + 0 0 140 -44,-0.6 2,-0.3 -2,-0.0 -1,-0.1 -0.577 57.0 157.7 -80.5 141.4 66.4 -0.6 11.6 101 101 A E - 0 0 125 -2,-0.2 -3,-0.0 -3,-0.1 0, 0.0 -0.993 49.8 -68.7-158.9 155.8 65.7 -1.7 15.1 102 102 A S 0 0 105 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.084 360.0 360.0 -44.5 145.2 64.6 -0.3 18.5 103 103 A A 0 0 171 -3,-0.0 -1,-0.1 0, 0.0 -2,-0.0 0.971 360.0 360.0 -52.8 360.0 67.4 1.8 20.0