==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CYTOKINE 05-MAR-08 2ZJC . COMPND 2 MOLECULE: TUMOR NECROSIS FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.MUKAI,Y.YAMAGATA,Y.TSUTSUMI . 435 5 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17282.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 265 60.9 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 . 179 41.1 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 . 4 0.9 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 . 50 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 6.0 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+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 . 3 5 7 0 3 6 3 0 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 3 0 3 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 8 A P 0 0 149 0, 0.0 2,-3.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -49.7 23.1 32.6 4.4 2 9 A S + 0 0 36 1,-0.2 341,-0.1 341,-0.0 30,-0.0 -0.349 360.0 148.0 -66.6 68.7 19.5 31.5 3.9 3 10 A D + 0 0 116 -2,-3.2 -1,-0.2 2,-0.1 3,-0.1 0.270 14.9 118.0-103.6 8.1 20.8 28.0 3.9 4 11 A M S S- 0 0 31 1,-0.1 27,-0.1 -3,-0.1 29,-0.1 -0.582 79.7 -97.0 -72.9 134.9 18.0 25.9 5.5 5 12 A P + 0 0 22 0, 0.0 137,-2.0 0, 0.0 2,-0.3 -0.305 62.9 167.5 -51.0 126.6 16.6 23.2 3.1 6 13 A V E -AB 31 141A 1 25,-2.0 25,-3.3 135,-0.2 2,-0.3 -0.996 23.8-179.4-150.3 151.5 13.5 24.8 1.7 7 14 A A E +AB 30 140A 0 133,-2.4 133,-2.4 -2,-0.3 2,-0.3 -0.970 11.1 170.7-153.3 133.0 10.9 24.5 -1.1 8 15 A H E +AB 29 139A 2 21,-2.4 21,-2.9 -2,-0.3 2,-0.3 -0.823 23.7 172.8-139.5 101.3 7.9 26.5 -2.2 9 16 A V E - B 0 138A 0 129,-3.3 129,-2.1 -2,-0.3 2,-0.2 -0.773 13.9-152.6-112.8 156.7 6.7 25.1 -5.5 10 17 A V E -CB 22 137A 38 12,-1.9 12,-2.4 -2,-0.3 127,-0.2 -0.724 26.9 -87.9-125.5 168.2 3.6 25.9 -7.5 11 18 A A E -C 21 0A 9 125,-1.5 10,-0.2 -2,-0.2 125,-0.1 -0.563 39.4-119.7 -78.3 143.8 1.2 24.2 -10.0 12 19 A N > - 0 0 34 8,-1.7 3,-0.7 -2,-0.2 8,-0.3 -0.750 17.9-158.8 -81.3 121.6 2.0 24.4 -13.7 13 20 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 117,-0.1 0.872 88.8 56.9 -69.5 -38.7 -0.8 26.2 -15.6 14 21 A Q T 3 S+ 0 0 179 1,-0.1 2,-1.2 2,-0.1 -2,-0.0 0.577 84.8 93.1 -71.5 -10.3 0.0 24.7 -19.1 15 22 A A S X S- 0 0 6 -3,-0.7 3,-1.0 5,-0.1 5,-0.2 -0.725 78.5-141.4 -88.0 94.9 -0.3 21.2 -17.6 16 23 A E T 3 - 0 0 150 -2,-1.2 -2,-0.1 1,-0.2 3,-0.1 -0.319 69.0 -11.6 -66.4 130.1 -4.0 20.4 -18.4 17 24 A G T 3 S+ 0 0 44 108,-0.2 2,-0.3 1,-0.1 -1,-0.2 0.815 110.6 102.2 51.8 43.1 -6.0 18.5 -15.8 18 25 A Q < - 0 0 107 -3,-1.0 2,-1.1 107,-0.2 -1,-0.1 -0.985 69.3-132.8-151.9 140.4 -3.0 17.5 -13.6 19 26 A L + 0 0 19 -2,-0.3 2,-0.6 103,-0.1 101,-0.1 -0.759 42.8 160.6 -93.1 87.3 -1.5 18.7 -10.4 20 27 A Q - 0 0 72 -2,-1.1 -8,-1.7 -8,-0.3 -5,-0.1 -0.931 30.3-139.4-115.5 115.3 2.2 18.9 -11.4 21 28 A W E -C 11 0A 5 -2,-0.6 2,-0.3 18,-0.2 -10,-0.2 -0.298 21.7-174.3 -68.0 143.9 4.5 20.9 -9.2 22 29 A K E -C 10 0A 119 -12,-2.4 -12,-1.9 2,-0.1 2,-1.3 -0.996 36.1-132.1-141.2 151.2 7.2 23.2 -10.7 23 30 A N S S+ 0 0 74 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.1 -0.631 75.8 110.2 -90.7 68.7 10.1 25.3 -9.6 24 31 A A + 0 0 43 -2,-1.3 -14,-0.2 -14,-0.1 2,-0.1 -0.934 35.9 68.6-140.8 161.4 8.9 28.1 -11.9 25 32 A G S > S- 0 0 65 -2,-0.3 3,-0.5 1,-0.1 -15,-0.0 -0.400 89.1 -76.9 109.0 167.8 7.3 31.5 -11.3 26 33 A A T 3 S+ 0 0 82 1,-0.3 2,-0.2 -2,-0.1 -1,-0.1 0.813 126.3 34.3 -74.9 -29.8 8.7 34.8 -9.9 27 34 A N T 3 S+ 0 0 29 354,-0.2 2,-0.3 -3,-0.1 -1,-0.3 -0.606 84.7 122.5-129.6 70.8 8.4 33.5 -6.3 28 35 A A < - 0 0 23 -3,-0.5 2,-0.4 -2,-0.2 -19,-0.2 -0.941 40.1-152.2-125.6 150.4 9.2 29.8 -6.1 29 36 A L E +A 8 0A 21 -21,-2.9 -21,-2.4 -2,-0.3 2,-0.2 -0.980 28.6 158.6-130.8 136.3 11.9 27.9 -4.1 30 37 A L E +A 7 0A 51 -2,-0.4 2,-0.3 -23,-0.2 -23,-0.2 -0.735 43.0 146.3-144.0 91.4 13.8 24.7 -4.5 31 38 A A E > +A 6 0A 26 -25,-3.3 -25,-2.0 -2,-0.2 3,-1.4 -0.876 34.6 18.1-138.5 161.0 16.9 25.2 -2.3 32 39 A N T 3 S- 0 0 69 -2,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.806 127.3 -34.9 54.3 42.7 19.5 23.9 0.0 33 40 A G T 3 S+ 0 0 46 1,-0.3 -1,-0.3 -3,-0.1 9,-0.1 -0.144 100.3 126.4 114.2 -37.2 19.2 20.3 -0.8 34 41 A V < - 0 0 7 -3,-1.4 -1,-0.3 -28,-0.2 2,-0.3 -0.253 41.0-160.3 -62.0 138.6 15.5 19.8 -1.5 35 42 A E E -G 42 0B 85 7,-1.3 7,-2.8 -3,-0.1 2,-0.6 -0.885 22.2-141.2-120.3 154.4 14.6 18.2 -4.8 36 43 A L E +G 41 0B 39 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.943 39.1 162.5-109.7 104.3 11.6 17.9 -7.0 37 44 A R E > -G 40 0B 125 3,-3.2 3,-2.2 -2,-0.6 -2,-0.1 -0.991 63.5 -10.1-129.0 131.1 11.6 14.4 -8.4 38 45 A D T 3 S- 0 0 116 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.872 130.1 -54.0 49.0 43.6 8.8 12.4 -10.0 39 46 A N T 3 S+ 0 0 58 1,-0.2 81,-0.4 -18,-0.1 2,-0.3 0.633 120.8 108.5 66.7 17.9 6.4 15.2 -8.9 40 47 A Q E < S-G 37 0B 33 -3,-2.2 -3,-3.2 79,-0.1 2,-0.5 -0.928 71.2-121.1-129.8 147.5 7.6 14.8 -5.3 41 48 A L E -GH 36 118B 0 77,-1.8 77,-2.0 -2,-0.3 2,-0.5 -0.773 27.4-147.0 -88.8 125.5 9.7 16.9 -2.9 42 49 A V E -GH 35 117B 25 -7,-2.8 -7,-1.3 -2,-0.5 75,-0.2 -0.814 10.7-132.9 -99.3 128.2 12.8 14.9 -1.7 43 50 A V - 0 0 2 73,-2.8 72,-3.5 -2,-0.5 73,-0.2 -0.666 15.5-168.3 -84.5 122.2 14.0 15.6 1.9 44 51 A P + 0 0 49 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.685 64.2 27.5 -83.7 -13.4 17.7 16.2 2.1 45 52 A S S S- 0 0 39 68,-0.2 2,-0.3 71,-0.1 71,-0.1 -0.967 76.3-103.8-148.6 155.2 18.1 16.0 5.9 46 53 A E + 0 0 113 -2,-0.3 2,-0.3 67,-0.1 67,-0.2 -0.660 69.3 75.8 -80.3 136.4 16.8 14.7 9.2 47 54 A G E S-D 112 0A 8 65,-2.2 65,-2.9 -2,-0.3 2,-0.6 -0.979 81.4 -40.4 161.7-166.8 14.9 17.1 11.4 48 55 A L E -D 111 0A 4 95,-0.6 95,-4.3 -2,-0.3 2,-0.4 -0.812 54.4-172.1 -90.4 120.9 11.7 19.0 12.1 49 56 A Y E -DE 110 142A 0 61,-2.9 61,-2.7 -2,-0.6 2,-0.6 -0.929 23.6-139.2-111.0 140.5 10.0 20.4 9.0 50 57 A L E -DE 109 141A 7 91,-3.1 91,-2.8 -2,-0.4 2,-0.4 -0.863 32.0-175.3 -84.1 127.0 7.1 22.8 8.6 51 58 A I E +DE 108 140A 0 57,-2.6 57,-2.4 -2,-0.6 2,-0.3 -0.954 8.3 162.5-126.1 146.2 5.2 21.4 5.7 52 59 A Y E -DE 107 139A 1 87,-2.2 87,-1.8 -2,-0.4 2,-0.3 -0.967 11.9-176.6-155.1 164.3 2.1 23.0 4.0 53 60 A S E -DE 106 138A 0 53,-2.5 53,-3.3 -2,-0.3 2,-0.3 -0.951 5.9-166.2-165.9 151.8 -0.1 23.0 0.9 54 61 A Q E -DE 105 137A 0 83,-2.4 83,-1.8 -2,-0.3 2,-0.4 -0.997 3.9-174.7-139.9 137.0 -3.0 24.7 -0.7 55 62 A V E -D 104 0A 0 49,-1.2 49,-2.0 -2,-0.3 2,-0.6 -0.991 17.3-143.8-127.2 142.4 -5.2 23.8 -3.6 56 63 A L E -D 103 0A 0 -2,-0.4 73,-2.1 73,-0.2 2,-0.4 -0.939 17.3-161.6-103.7 115.9 -8.0 25.9 -5.2 57 64 A F E +DF 102 128A 0 45,-2.0 45,-3.0 -2,-0.6 2,-0.3 -0.828 14.9 175.4 -95.5 135.0 -10.8 23.7 -6.4 58 65 A S E +D 101 0A 12 69,-3.6 2,-0.3 -2,-0.4 43,-0.2 -0.980 9.1 164.3-141.7 153.0 -13.3 25.2 -8.9 59 66 A G E -D 100 0A 6 41,-1.5 41,-2.8 -2,-0.3 68,-0.1 -0.975 35.6-132.0-164.9 155.4 -16.3 24.1 -10.9 60 67 A Q S S- 0 0 130 -2,-0.3 2,-0.2 39,-0.2 -1,-0.1 0.911 85.3 -12.4 -81.2 -48.0 -19.2 25.6 -13.0 61 68 A G S S- 0 0 22 38,-0.1 39,-0.1 39,-0.0 -1,-0.0 -0.633 74.0 -92.6-132.8-163.2 -22.0 23.6 -11.5 62 69 A a + 0 0 48 -2,-0.2 -3,-0.0 1,-0.2 32,-0.0 -0.807 42.3 173.9-118.8 87.9 -22.7 20.5 -9.4 63 70 A P + 0 0 100 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.961 60.9 48.5 -65.2 -60.0 -23.1 17.6 -11.9 64 71 A S S S- 0 0 67 1,-0.1 3,-0.1 0, 0.0 0, 0.0 -0.580 89.9-115.0 -84.3 144.0 -23.4 14.6 -9.6 65 72 A T S S+ 0 0 105 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.759 104.2 11.5 -40.5 -31.7 -25.8 14.5 -6.6 66 73 A H + 0 0 38 2,-0.0 2,-0.3 27,-0.0 -1,-0.2 -0.944 65.1 176.6-158.7 133.1 -22.6 14.3 -4.6 67 74 A V - 0 0 18 27,-0.3 2,-0.5 -2,-0.3 27,-0.4 -0.994 16.4-148.2-135.9 139.6 -18.8 14.7 -5.1 68 75 A L - 0 0 62 -2,-0.3 2,-0.5 24,-0.2 24,-0.2 -0.951 6.5-161.1-115.7 124.4 -16.0 14.6 -2.6 69 76 A L E -I 91 0B 0 22,-2.5 22,-2.5 -2,-0.5 2,-0.3 -0.875 13.2-172.1-100.3 127.4 -12.8 16.7 -3.0 70 77 A T E -I 90 0B 35 -2,-0.5 53,-0.9 20,-0.2 2,-0.4 -0.891 13.7-165.5-119.6 151.6 -9.7 15.6 -1.0 71 78 A H E -IJ 89 122B 0 18,-2.6 18,-2.2 -2,-0.3 2,-0.4 -0.988 18.3-179.5-135.1 128.4 -6.3 17.1 -0.4 72 79 A T E -IJ 88 121B 23 49,-2.5 49,-2.4 -2,-0.4 2,-0.5 -0.961 27.1-163.9-134.7 140.5 -3.4 15.1 1.0 73 80 A I E +IJ 87 120B 0 14,-2.9 13,-3.2 -2,-0.4 14,-2.1 -0.975 29.2 177.7-116.6 113.9 0.2 15.3 2.0 74 81 A S E -IJ 85 119B 4 45,-1.6 45,-1.6 -2,-0.5 2,-0.4 -0.758 20.1-134.1-114.0 160.9 1.7 11.8 2.3 75 82 A R E -IJ 84 118B 62 9,-2.8 9,-2.0 -2,-0.3 2,-0.5 -0.948 9.5-165.9-119.0 133.2 5.1 10.6 3.1 76 83 A I E - J 0 117B 33 41,-2.8 41,-3.0 -2,-0.4 2,-0.1 -0.979 17.0-145.5-114.7 115.8 7.2 7.9 1.4 77 84 A A > - 0 0 23 -2,-0.5 3,-1.0 3,-0.5 5,-0.2 -0.484 30.5-102.6 -73.8 154.8 10.2 6.7 3.3 78 85 A V T 3 S+ 0 0 94 1,-0.3 -1,-0.1 36,-0.2 3,-0.1 0.799 115.9 24.5 -53.3 -51.8 13.3 5.8 1.3 79 86 A S T 3 S+ 0 0 93 1,-0.2 2,-0.7 2,-0.0 -1,-0.3 0.424 110.5 83.1 -94.5 1.1 13.2 1.9 1.3 80 87 A Y < - 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