==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CYTOKINE 02-JAN-90 2I1B . COMPND 2 MOLECULE: INTERLEUKIN-1 BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.P.PRIESTLE,H.-P.SCHAER,M.G.GRUETTER . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8399.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 99 64.7 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 . 62 40.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 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 . 6 1 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 A 0 0 97 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.0 19.7 20.2 22.0 2 2 A P + 0 0 128 0, 0.0 2,-0.6 0, 0.0 90,-0.1 0.783 360.0 10.0 -29.2 -94.7 22.8 18.2 21.1 3 3 A V S S- 0 0 24 88,-0.2 2,-0.4 42,-0.0 44,-0.1 -0.814 91.7-144.5 -93.0 130.2 21.7 17.4 17.6 4 4 A R E -A 46 0A 168 -2,-0.6 42,-2.5 42,-0.5 2,-0.3 -0.762 22.0-179.9 -93.4 139.9 18.7 19.5 16.8 5 5 A S E -A 45 0A 52 -2,-0.4 2,-0.3 40,-0.2 40,-0.2 -0.896 16.8-163.9-137.2 163.6 15.9 18.1 14.6 6 6 A L E -A 44 0A 50 38,-1.4 38,-3.3 -2,-0.3 2,-0.3 -0.964 23.3-125.3-148.6 141.7 12.5 19.1 13.2 7 7 A N E +AB 43 151A 20 144,-0.5 144,-1.8 -2,-0.3 2,-0.3 -0.740 43.8 148.9 -89.6 142.7 9.8 16.8 11.7 8 8 A C E -AB 42 150A 0 34,-2.1 34,-3.1 -2,-0.3 2,-0.3 -0.979 38.6-127.2-165.4 169.4 8.6 17.6 8.2 9 9 A T E - B 0 149A 4 140,-2.4 140,-2.4 -2,-0.3 2,-0.4 -0.873 21.4-143.4-124.5 155.7 7.3 16.3 4.9 10 10 A L E - B 0 148A 6 30,-0.4 8,-0.6 -2,-0.3 2,-0.4 -0.935 12.0-172.5-121.3 143.7 8.7 17.0 1.4 11 11 A R E -CB 17 147A 53 136,-1.9 136,-2.4 -2,-0.4 6,-0.2 -0.983 24.6-124.3-134.7 135.1 6.8 17.5 -1.8 12 12 A D E > - B 0 146A 1 4,-1.8 3,-2.1 -2,-0.4 134,-0.3 -0.119 38.5 -96.5 -73.1 171.3 8.5 17.8 -5.3 13 13 A S T 3 S+ 0 0 35 132,-1.6 133,-0.1 1,-0.3 -1,-0.1 0.471 127.1 59.6 -70.4 -1.3 7.8 20.9 -7.4 14 14 A Q T 3 S- 0 0 96 2,-0.1 -1,-0.3 129,-0.0 132,-0.1 0.188 121.7-109.3-106.5 9.4 5.1 19.0 -9.2 15 15 A Q < + 0 0 121 -3,-2.1 16,-0.5 1,-0.3 2,-0.3 0.673 65.2 154.6 69.4 26.0 3.3 18.5 -5.9 16 16 A K - 0 0 0 14,-0.1 -4,-1.8 12,-0.1 -1,-0.3 -0.661 34.4-139.8 -84.8 138.1 4.1 14.8 -5.6 17 17 A S E -CD 11 29A 0 12,-2.7 12,-2.0 -2,-0.3 2,-0.4 -0.537 13.9-119.8 -90.8 161.0 4.2 13.4 -2.1 18 18 A L E + D 0 28A 5 -8,-0.6 22,-2.9 10,-0.2 2,-0.3 -0.910 33.7 170.6-110.1 135.6 6.7 10.8 -0.8 19 19 A V E -ED 39 27A 5 8,-2.2 8,-2.6 -2,-0.4 2,-0.4 -0.923 40.4 -91.5-137.1 159.1 5.7 7.3 0.5 20 20 A M E - D 0 26A 60 18,-0.5 6,-0.3 -2,-0.3 8,-0.0 -0.585 33.9-176.8 -76.9 127.7 7.5 4.2 1.5 21 21 A S - 0 0 56 4,-3.6 -1,-0.2 -2,-0.4 5,-0.2 0.884 69.4 -15.8 -84.7 -84.1 7.9 1.7 -1.3 22 22 A G S > S- 0 0 33 3,-0.1 3,-0.7 4,-0.0 -1,-0.2 -0.231 94.0 -77.1-103.1-160.6 9.6 -1.4 0.3 23 23 A P T 3 S+ 0 0 90 0, 0.0 3,-0.0 0, 0.0 -3,-0.0 0.642 133.9 35.1 -73.8 -15.3 11.4 -1.3 3.7 24 24 A Y T 3 S+ 0 0 125 43,-0.0 58,-0.8 57,-0.0 2,-0.3 0.122 108.1 67.1-128.0 23.6 14.3 0.4 1.9 25 25 A E < - 0 0 89 -3,-0.7 -4,-3.6 56,-0.1 2,-0.3 -0.995 54.9-148.8-146.2 151.9 12.8 2.7 -0.8 26 26 A L E -D 20 0A 5 -2,-0.3 106,-2.5 106,-0.3 2,-0.3 -0.853 14.5-165.7-114.6 148.5 10.8 5.8 -1.3 27 27 A K E -DF 19 131A 45 -8,-2.6 -8,-2.2 -2,-0.3 2,-0.5 -0.933 14.1-133.7-130.4 154.9 8.4 6.5 -4.2 28 28 A A E +DF 18 130A 2 102,-2.3 101,-1.1 -2,-0.3 102,-0.8 -0.964 33.1 157.8-116.7 127.4 6.8 9.8 -5.4 29 29 A L E -D 17 0A 18 -12,-2.0 -12,-2.7 -2,-0.5 2,-0.7 -0.970 48.2 -97.5-145.1 157.7 3.1 10.0 -6.3 30 30 A H + 0 0 94 -2,-0.3 2,-0.3 -14,-0.3 -14,-0.1 -0.671 53.2 173.0 -76.2 110.9 0.3 12.5 -6.6 31 31 A L + 0 0 27 -2,-0.7 2,-0.3 -16,-0.5 5,-0.1 -0.864 9.1 161.4-123.9 156.5 -1.7 12.2 -3.4 32 32 A Q > + 0 0 172 -2,-0.3 3,-1.0 -15,-0.0 2,-0.2 -0.957 46.8 9.3-168.5 158.3 -4.6 14.1 -1.8 33 33 A G G > S- 0 0 54 -2,-0.3 3,-0.8 1,-0.2 4,-0.1 -0.454 123.6 -11.1 70.9-133.6 -7.3 13.8 0.8 34 34 A Q G > S+ 0 0 152 1,-0.2 3,-1.5 -2,-0.2 -1,-0.2 0.778 126.0 70.3 -71.2 -32.4 -7.2 10.9 3.2 35 35 A D G < S+ 0 0 96 -3,-1.0 3,-0.4 1,-0.3 -1,-0.2 0.323 81.4 82.8 -67.7 3.8 -4.5 9.1 1.2 36 36 A M G X S+ 0 0 36 -3,-0.8 3,-1.5 1,-0.2 -1,-0.3 0.617 71.3 69.7 -81.4 -24.8 -2.1 11.8 2.4 37 37 A E T < S+ 0 0 156 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.505 84.5 76.3 -77.5 -1.8 -1.5 10.2 5.8 38 38 A Q T 3 S+ 0 0 96 -3,-0.4 -18,-0.5 -4,-0.1 -1,-0.3 0.658 74.8 110.3 -77.7 -21.3 0.4 7.7 3.7 39 39 A Q B < S-E 19 0A 37 -3,-1.5 2,-0.3 -20,-0.1 -20,-0.2 -0.173 75.4-109.9 -63.6 145.6 3.3 10.3 3.3 40 40 A V - 0 0 13 -22,-2.9 2,-0.5 -30,-0.1 -30,-0.4 -0.609 23.0-145.7 -76.4 135.8 6.6 9.8 5.0 41 41 A V - 0 0 41 -2,-0.3 22,-3.1 22,-0.1 2,-0.3 -0.898 17.6-152.1-104.7 123.1 7.5 12.1 7.8 42 42 A F E -AG 8 62A 1 -34,-3.1 -34,-2.1 -2,-0.5 2,-0.7 -0.653 13.7-144.7 -96.0 151.3 11.2 13.0 8.0 43 43 A S E -AG 7 61A 27 18,-3.1 18,-2.1 -2,-0.3 2,-0.6 -0.956 24.2-158.6-113.4 98.3 13.2 14.0 11.0 44 44 A M E -AG 6 60A 0 -38,-3.3 -38,-1.4 -2,-0.7 2,-0.4 -0.803 7.2-160.1 -87.9 122.4 15.6 16.5 9.6 45 45 A S E -AG 5 59A 1 14,-2.5 14,-2.0 -2,-0.6 2,-1.1 -0.883 17.0-135.2-109.3 136.7 18.7 16.9 11.7 46 46 A F E +A 4 0A 60 -42,-2.5 -42,-0.5 -2,-0.4 12,-0.2 -0.729 39.7 176.6 -90.5 91.3 21.1 19.9 11.6 47 47 A V - 0 0 3 -2,-1.1 2,-0.2 10,-0.4 47,-0.2 -0.168 33.7 -82.4 -88.0 175.7 24.5 18.2 11.6 48 48 A Q S S+ 0 0 93 45,-2.8 2,-0.3 -2,-0.1 47,-0.2 -0.590 71.8 100.3 -84.2 146.6 28.1 19.5 11.4 49 49 A G S S- 0 0 30 -2,-0.2 2,-0.4 8,-0.1 45,-0.0 -0.862 78.5 -39.5 159.8 177.4 29.6 20.3 8.0 50 50 A E - 0 0 173 -2,-0.3 2,-0.3 6,-0.1 -2,-0.0 -0.526 64.4-174.2 -71.4 121.8 30.4 23.3 5.8 51 51 A E + 0 0 113 -2,-0.4 2,-0.2 5,-0.1 5,-0.2 -0.742 15.8 171.6-116.6 158.7 27.5 25.8 6.0 52 52 A S - 0 0 52 3,-2.2 0, 0.0 -2,-0.3 0, 0.0 -0.790 53.8 -85.0-148.8-176.1 26.6 29.1 4.3 53 53 A N S S+ 0 0 162 -2,-0.2 3,-0.1 1,-0.2 52,-0.0 0.719 130.7 24.9 -73.9 -23.5 23.5 31.3 4.3 54 54 A D S S+ 0 0 87 1,-0.2 51,-1.2 50,-0.1 2,-0.4 0.279 115.8 69.3-122.5 5.7 21.8 29.3 1.6 55 55 A K E + H 0 104A 68 49,-0.2 -3,-2.2 2,-0.0 49,-0.2 -0.940 57.1 171.8-132.5 105.2 23.6 25.9 2.1 56 56 A I E - H 0 103A 34 47,-2.4 47,-3.6 -2,-0.4 2,-0.3 -0.972 29.2-130.5-119.7 120.9 22.9 24.0 5.3 57 57 A P E + H 0 102A 1 0, 0.0 -10,-0.4 0, 0.0 2,-0.3 -0.525 36.9 170.0 -71.2 128.5 24.1 20.4 6.0 58 58 A V E - H 0 101A 0 43,-2.9 43,-2.8 -2,-0.3 2,-0.4 -0.907 30.9-140.2-133.8 163.7 21.3 18.1 7.1 59 59 A A E -GH 45 100A 1 -14,-2.0 -14,-2.5 -2,-0.3 2,-0.6 -0.928 19.6-146.7-119.4 144.4 20.7 14.4 7.8 60 60 A L E +G 44 0A 0 39,-0.5 9,-2.4 -2,-0.4 2,-0.3 -0.952 25.5 166.7-119.8 107.3 17.3 13.0 6.7 61 61 A G E -GI 43 68A 0 -18,-2.1 -18,-3.1 -2,-0.6 2,-0.4 -0.714 41.4-104.6-115.2 163.1 15.9 10.2 8.8 62 62 A L E > -G 42 0A 7 5,-2.5 3,-2.1 3,-0.3 5,-0.4 -0.773 51.6 -95.6 -86.8 132.7 12.4 8.7 8.9 63 63 A K T 3 S- 0 0 53 -22,-3.1 -22,-0.1 -2,-0.4 3,-0.1 -0.284 103.2 -6.8 -56.5 125.3 10.5 9.9 12.0 64 64 A E T 3 S+ 0 0 174 1,-0.2 2,-0.4 -2,-0.1 -1,-0.3 0.661 113.6 105.1 58.2 26.7 10.8 7.4 14.8 65 65 A K S < S- 0 0 118 -3,-2.1 2,-1.5 2,-0.2 -3,-0.3 -0.973 75.9-128.7-129.9 139.6 12.6 4.8 12.6 66 66 A N S S+ 0 0 67 -2,-0.4 19,-1.7 -5,-0.1 2,-0.4 -0.376 75.3 113.1 -84.8 55.3 16.3 4.0 12.7 67 67 A L E - J 0 84A 16 -2,-1.5 -5,-2.5 -5,-0.4 2,-0.3 -1.000 42.0-179.4-133.1 128.3 16.4 4.6 8.9 68 68 A Y E -IJ 61 83A 18 15,-2.3 15,-2.6 -2,-0.4 2,-0.3 -0.945 34.2-107.5-129.9 147.4 18.3 7.4 7.1 69 69 A L E - J 0 82A 3 -9,-2.4 -9,-0.4 -2,-0.3 2,-0.3 -0.530 45.8-177.3 -70.9 135.1 18.8 8.5 3.5 70 70 A S E - J 0 81A 0 11,-2.6 11,-1.9 -2,-0.3 2,-0.5 -0.978 24.9-138.1-139.7 148.2 22.4 7.6 2.5 71 71 A C E + J 0 80A 0 27,-2.0 2,-0.3 -2,-0.3 9,-0.2 -0.964 35.2 159.7-112.9 117.3 24.5 8.2 -0.7 72 72 A V E - J 0 79A 28 7,-2.2 7,-2.2 -2,-0.5 2,-0.4 -0.935 43.9-105.4-136.7 154.0 26.7 5.2 -1.6 73 73 A L E - J 0 78A 111 -2,-0.3 2,-0.4 5,-0.2 3,-0.1 -0.715 38.2-179.7 -82.2 129.5 28.4 4.0 -4.8 74 74 A K S S- 0 0 110 3,-2.9 -2,-0.0 -2,-0.4 0, 0.0 -0.978 72.1 -11.9-136.4 117.8 26.6 1.1 -6.4 75 75 A D S S- 0 0 157 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.942 132.9 -53.5 55.4 49.1 27.9 -0.5 -9.6 76 76 A D S S+ 0 0 137 1,-0.1 -1,-0.2 -3,-0.1 -3,-0.1 0.870 119.1 103.0 53.4 52.3 30.2 2.5 -9.9 77 77 A K S S- 0 0 111 -5,-0.0 -3,-2.9 2,-0.0 -1,-0.1 -0.914 78.9-105.5-161.6 131.4 27.4 5.1 -9.6 78 78 A P E +J 73 0A 15 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.388 49.8 179.8 -60.1 128.9 26.2 7.4 -6.8 79 79 A T E -J 72 0A 41 -7,-2.2 -7,-2.2 -2,-0.1 2,-0.3 -0.975 27.0-125.9-137.8 147.1 22.9 5.9 -5.5 80 80 A L E +J 71 0A 24 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.757 35.4 164.8 -94.8 141.0 20.3 6.8 -2.9 81 81 A Q E -J 70 0A 47 -11,-1.9 -11,-2.6 -2,-0.3 2,-0.5 -0.943 39.0-121.0-150.8 161.5 19.4 4.2 -0.3 82 82 A L E -J 69 0A 8 -58,-0.8 2,-0.4 -2,-0.3 -13,-0.2 -0.927 38.8-165.8-101.4 130.3 17.6 4.0 3.0 83 83 A E E -J 68 0A 35 -15,-2.6 -15,-2.3 -2,-0.5 2,-0.2 -0.969 16.1-126.9-129.4 144.1 20.0 2.5 5.6 84 84 A S E -J 67 0A 57 -2,-0.4 2,-0.3 -17,-0.2 -17,-0.2 -0.633 27.7-173.0 -82.6 139.1 19.5 1.1 9.1 85 85 A V - 0 0 15 -19,-1.7 5,-0.1 -2,-0.2 -19,-0.1 -0.884 40.0 -80.1-134.3 163.6 21.5 2.4 12.0 86 86 A D >> - 0 0 53 -2,-0.3 3,-0.9 1,-0.2 4,-0.7 -0.508 40.1-141.7 -62.2 119.6 22.0 1.5 15.6 87 87 A P T 34 S+ 0 0 95 0, 0.0 -1,-0.2 0, 0.0 -20,-0.0 0.593 97.4 54.4 -63.6 -14.3 18.9 3.0 17.3 88 88 A K T 34 S+ 0 0 167 1,-0.1 -2,-0.1 -22,-0.1 -22,-0.0 0.723 106.9 48.1 -93.2 -23.2 21.0 4.0 20.3 89 89 A N T <4 S+ 0 0 89 -3,-0.9 -1,-0.1 3,-0.0 -3,-0.1 0.480 93.2 123.0 -94.4 -6.4 23.7 6.0 18.5 90 90 A Y < + 0 0 38 -4,-0.7 2,-0.1 -5,-0.1 -5,-0.0 -0.926 48.9 29.2-127.8 152.1 21.6 8.2 16.2 91 91 A P S S+ 0 0 54 0, 0.0 2,-0.3 0, 0.0 -88,-0.2 0.513 74.5 172.4 -76.7 161.3 21.0 10.9 15.4 92 92 A K - 0 0 67 -2,-0.1 3,-0.3 1,-0.1 -2,-0.0 -0.902 42.8-123.2-131.3 159.5 24.4 12.5 16.1 93 93 A K S S+ 0 0 101 -2,-0.3 -45,-2.8 1,-0.3 2,-0.9 0.856 109.8 51.9 -70.8 -33.7 25.7 15.9 15.4 94 94 A K S S+ 0 0 120 -47,-0.2 -1,-0.3 -3,-0.1 2,-0.2 -0.731 78.2 177.4-106.9 82.8 28.6 14.4 13.5 95 95 A M - 0 0 7 -2,-0.9 5,-0.1 -3,-0.3 -47,-0.0 -0.506 40.5 -94.7 -79.3 150.7 26.9 12.0 11.0 96 96 A E > - 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