==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CYTOKINE/IMMUNE SYSTEM 20-MAR-01 1I9R . COMPND 2 MOLECULE: CD40 LIGAND; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.KARPUSAS,J.LUCCI,J.FERRANT,C.BENJAMIN,Y.-M.HSU . 1731 9 15 15 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 68838.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1158 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 680 39.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 15 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 0.5 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 . 1 0.1 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 . 228 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 121 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 52 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 0.8 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 6 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 0 RESIDUES PER ALPHA HELIX . 0 0 3 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 0 0 PARALLEL BRIDGES PER LADDER . 32 15 19 19 10 26 10 0 6 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 12 6 3 6 3 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 1 119 A N 0 0 205 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -49.4 69.8 4.7 -10.9 2 120 A P - 0 0 62 0, 0.0 2,-0.4 0, 0.0 30,-0.1 -0.660 360.0-142.3 -81.9 115.9 67.2 6.3 -8.6 3 121 A Q - 0 0 72 -2,-0.6 2,-0.6 28,-0.1 31,-0.1 -0.676 11.3-158.8 -81.6 134.7 68.5 6.0 -5.1 4 122 A I + 0 0 5 -2,-0.4 138,-2.7 138,-0.3 2,-0.3 -0.937 31.6 137.1-115.9 113.2 65.9 5.3 -2.5 5 123 A A E -A 141 0A 1 -2,-0.6 26,-2.2 136,-0.2 27,-0.4 -0.968 27.4-166.5-149.1 162.0 66.9 6.3 1.0 6 124 A A E +AB 140 30A 0 134,-2.0 134,-1.4 -2,-0.3 2,-0.5 -0.874 10.5 178.3-160.5 122.3 65.3 8.0 4.0 7 125 A H E -AB 139 29A 5 22,-2.0 22,-4.6 -2,-0.3 2,-0.3 -0.994 18.5-177.7-124.2 122.3 66.6 9.4 7.3 8 126 A V E -A 138 0A 0 130,-2.5 130,-1.5 -2,-0.5 2,-0.3 -0.902 22.1-119.7-122.2 150.5 64.0 10.9 9.5 9 127 A I E -AC 137 23A 39 14,-2.4 14,-3.5 -2,-0.3 128,-0.2 -0.670 30.2-102.7 -94.8 142.4 64.3 12.7 12.8 10 128 A S E - C 0 22A 5 126,-2.1 2,-0.4 -2,-0.3 12,-0.3 -0.275 36.0-165.5 -61.4 146.1 62.7 11.6 16.1 11 129 A E E - C 0 21A 23 10,-1.1 10,-0.6 29,-0.1 523,-0.1 -0.996 15.4-131.8-139.0 121.4 59.6 13.7 17.1 12 130 A A - 0 0 12 -2,-0.4 2,-0.3 521,-0.2 115,-0.1 -0.367 28.8-168.5 -69.5 156.2 58.1 13.7 20.6 13 131 A S - 0 0 49 2,-0.1 451,-0.1 113,-0.1 519,-0.0 -0.935 34.2-149.9-158.7 132.5 54.3 13.2 20.8 14 132 A S S S+ 0 0 27 -2,-0.3 -1,-0.1 2,-0.1 450,-0.0 0.671 70.9 109.6 -68.4 -21.3 51.4 13.5 23.3 15 133 A K S S- 0 0 123 1,-0.1 2,-0.6 448,-0.0 -2,-0.1 0.131 78.1-108.6 -46.8 173.8 49.6 10.7 21.4 16 134 A T + 0 0 134 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.863 68.7 98.6-120.3 99.3 49.2 7.4 23.1 17 135 A T - 0 0 67 -2,-0.6 105,-0.0 1,-0.0 0, 0.0 -0.950 64.2-132.9-163.2 167.7 51.3 4.6 21.6 18 136 A S S S+ 0 0 49 -2,-0.3 105,-3.6 107,-0.1 2,-0.5 0.449 84.8 99.6-102.3 -10.1 54.5 2.8 22.1 19 137 A V B S-H 122 0B 26 103,-0.3 103,-0.3 105,-0.1 23,-0.1 -0.702 78.1-125.8 -81.5 121.6 55.2 3.3 18.4 20 138 A L - 0 0 10 101,-1.8 101,-0.3 -2,-0.5 2,-0.2 -0.261 14.3-131.4 -74.5 149.6 57.5 6.3 17.9 21 139 A Q E -C 11 0A 35 -10,-0.6 -10,-1.1 99,-0.1 2,-0.3 -0.549 18.8-163.9 -92.3 163.0 56.9 9.3 15.7 22 140 A W E -C 10 0A 6 18,-1.3 2,-0.3 -12,-0.3 -12,-0.2 -0.983 5.2-149.9-151.6 146.8 59.3 10.8 13.2 23 141 A A E -C 9 0A 3 -14,-3.5 -14,-2.4 -2,-0.3 2,-1.4 -0.911 19.7-133.7-122.8 144.7 59.6 14.1 11.4 24 142 A E S S+ 0 0 9 -2,-0.3 2,-0.2 -16,-0.2 660,-0.2 -0.517 74.8 104.6 -90.9 62.3 61.0 15.0 8.0 25 143 A K + 0 0 12 -2,-1.4 -16,-0.2 658,-0.1 724,-0.1 -0.595 55.1 26.9-127.2-165.3 62.8 18.0 9.4 26 144 A G S S- 0 0 11 722,-1.1 2,-2.2 -2,-0.2 723,-0.1 -0.024 123.8 -16.9 42.0-152.8 66.3 19.1 10.4 27 145 A Y S S+ 0 0 66 203,-0.2 -1,-0.2 204,-0.1 2,-0.1 -0.523 100.4 146.6 -78.9 74.9 69.2 17.3 8.5 28 146 A Y - 0 0 59 -2,-2.2 2,-0.4 -4,-0.1 228,-0.2 -0.351 41.6-129.1-106.0-171.9 67.1 14.6 7.2 29 147 A T E +B 7 0A 6 -22,-4.6 -22,-2.0 -2,-0.1 2,-0.1 -0.986 31.9 151.1-145.1 137.3 66.8 12.4 4.2 30 148 A M E -B 6 0A 35 -2,-0.4 -24,-0.2 -24,-0.3 3,-0.1 -0.635 18.3-170.8-160.9 83.1 64.0 11.5 1.9 31 149 A S - 0 0 35 -26,-2.2 2,-0.3 -2,-0.1 -25,-0.1 0.757 60.9 -49.8 -56.0 -27.7 65.3 10.7 -1.7 32 150 A N > - 0 0 41 -27,-0.4 3,-1.8 3,-0.3 -1,-0.1 -0.994 64.8 -64.6 174.6-177.1 61.9 10.6 -3.2 33 151 A N T 3 S+ 0 0 125 1,-0.3 3,-0.1 -2,-0.3 13,-0.1 0.439 109.7 83.1 -72.3 1.1 58.3 9.3 -3.3 34 152 A L T 3 S+ 0 0 44 1,-0.3 12,-1.7 -31,-0.1 13,-0.6 0.617 105.4 31.2 -77.9 -10.9 59.7 5.8 -3.9 35 153 A V E < S-I 45 0B 0 -3,-1.8 2,-0.4 10,-0.2 -3,-0.3 -0.980 83.0-176.3-140.5 133.8 59.9 6.0 -0.1 36 154 A T E -I 44 0B 30 8,-2.2 8,-2.6 -2,-0.4 2,-1.0 -0.991 25.6-136.1-140.0 139.4 57.5 8.0 1.9 37 155 A L E -I 43 0B 20 -2,-0.4 2,-0.4 6,-0.2 6,-0.2 -0.814 33.7-172.4 -92.3 100.2 57.1 8.8 5.7 38 156 A E E >> -I 42 0B 69 4,-1.4 4,-2.1 -2,-1.0 3,-1.8 -0.779 59.1 -3.9-104.3 144.2 53.5 8.4 6.5 39 157 A N T 34 S- 0 0 118 -2,-0.4 -1,-0.2 1,-0.3 4,-0.1 0.495 103.8 -93.1 63.5 7.4 51.6 9.2 9.6 40 158 A G T 34 S+ 0 0 17 2,-0.3 -18,-1.3 -3,-0.2 -1,-0.3 0.732 119.7 85.4 61.5 18.6 54.9 10.2 11.2 41 159 A K T <4 S+ 0 0 61 -3,-1.8 80,-0.6 1,-0.3 2,-0.3 0.708 88.8 17.5-117.3 -42.3 54.8 6.6 12.4 42 160 A Q E < -IJ 38 120B 41 -4,-2.1 -4,-1.4 78,-0.2 2,-0.5 -0.864 59.2-126.0-134.3 169.3 56.3 4.5 9.6 43 161 A L E -IJ 37 119B 1 76,-2.7 76,-3.5 -2,-0.3 2,-0.4 -0.966 30.1-163.7-114.0 128.2 58.3 4.4 6.4 44 162 A T E -IJ 36 118B 11 -8,-2.6 -8,-2.2 -2,-0.5 2,-0.4 -0.939 4.1-150.7-119.4 136.9 56.6 2.8 3.5 45 163 A V E -I 35 0B 0 72,-2.6 71,-2.6 -2,-0.4 72,-0.3 -0.844 12.4-165.2-112.1 140.0 58.2 1.6 0.3 46 164 A K S S+ 0 0 113 -12,-1.7 2,-0.5 -2,-0.4 -1,-0.1 0.688 73.9 67.5 -91.5 -19.2 56.7 1.3 -3.1 47 165 A R S S- 0 0 117 -13,-0.6 66,-0.1 68,-0.1 -1,-0.1 -0.897 80.5-126.0-110.3 128.7 59.3 -0.9 -4.7 48 166 A Q + 0 0 124 -2,-0.5 2,-0.3 67,-0.1 66,-0.2 -0.174 59.0 91.4 -58.9 161.2 60.0 -4.5 -3.7 49 167 A G E S-D 113 0A 10 64,-2.8 64,-4.2 2,-0.0 2,-0.3 -0.876 72.7 -49.5 149.1 179.5 63.5 -5.2 -2.8 50 168 A L E +D 112 0A 11 93,-0.3 93,-1.1 62,-0.3 2,-0.3 -0.711 52.0 175.7 -90.5 144.3 66.5 -5.6 -0.4 51 169 A Y E -DE 111 142A 0 60,-2.9 60,-2.8 -2,-0.3 2,-0.7 -0.990 32.7-127.8-148.4 150.6 67.0 -2.6 1.9 52 170 A Y E -DE 110 141A 4 89,-3.2 89,-2.2 -2,-0.3 2,-0.4 -0.945 35.5-164.9-102.4 122.2 69.3 -1.9 4.8 53 171 A I E + E 0 140A 0 56,-2.4 2,-0.3 -2,-0.7 87,-0.2 -0.900 14.0 162.5-114.2 137.9 67.1 -0.8 7.7 54 172 A Y E - E 0 139A 1 85,-2.7 85,-2.9 -2,-0.4 2,-0.3 -0.987 21.2-171.3-150.5 163.6 68.1 1.0 10.9 55 173 A A E -FE 107 138A 0 52,-1.0 52,-1.7 -2,-0.3 2,-0.5 -0.948 11.4-157.4-155.8 124.7 67.0 2.9 13.8 56 174 A Q E +FE 106 137A 1 81,-2.3 81,-2.4 -2,-0.3 2,-0.4 -0.941 20.3 178.2-106.6 131.6 69.2 4.6 16.4 57 175 A V E +F 105 0A 1 48,-3.5 48,-1.4 -2,-0.5 2,-0.4 -0.976 12.4 177.3-138.8 121.6 67.4 5.2 19.6 58 176 A T E -F 104 0A 0 -2,-0.4 72,-3.0 72,-0.4 2,-0.3 -0.923 12.7-178.9-117.6 151.5 68.8 6.7 22.8 59 177 A F E -FG 103 129A 0 44,-2.5 44,-1.8 -2,-0.4 2,-0.4 -0.897 20.9-133.2-144.2 169.1 66.5 7.2 25.8 60 178 A a E +F 102 0A 3 68,-2.8 2,-0.2 -2,-0.3 42,-0.2 -0.994 41.1 130.6-131.8 124.6 66.8 8.6 29.3 61 179 A S E -F 101 0A 3 40,-1.3 40,-2.8 -2,-0.4 2,-0.3 -0.803 41.6-106.5-155.1-166.8 65.4 6.9 32.4 62 180 A N > - 0 0 6 -2,-0.2 5,-0.8 38,-0.2 4,-0.4 -0.926 21.9-121.9-134.9 160.1 66.0 5.7 35.9 63 181 A R T 5S+ 0 0 128 -2,-0.3 4,-0.3 32,-0.2 -1,-0.2 0.988 111.1 14.8 -62.7 -74.0 66.6 2.4 37.7 64 182 A E T 5S+ 0 0 101 3,-0.1 4,-0.3 2,-0.1 -1,-0.1 0.845 109.7 84.6 -70.1 -38.1 63.6 2.5 40.1 65 183 A A T 5S- 0 0 66 1,-0.2 3,-0.2 2,-0.1 -1,-0.1 0.838 128.0 -11.6 -28.1 -89.0 61.6 5.3 38.4 66 184 A S T 5S+ 0 0 54 -4,-0.4 2,-0.6 1,-0.2 -1,-0.2 0.779 99.5 154.1 -83.9 -28.4 59.8 3.2 35.8 67 185 A S < + 0 0 22 -5,-0.8 27,-0.2 -4,-0.3 -1,-0.2 -0.153 22.0 118.2 41.2 -89.0 62.2 0.5 36.9 68 186 A Q S S- 0 0 119 -2,-0.6 -1,-0.1 -4,-0.3 -2,-0.0 -0.012 82.3 -31.0 37.3-130.9 60.0 -2.4 35.9 69 187 A A S S- 0 0 52 1,-0.3 25,-0.2 -3,-0.1 320,-0.1 -0.273 89.4 -59.2-100.5-172.7 61.8 -4.5 33.2 70 188 A P - 0 0 30 0, 0.0 2,-0.7 0, 0.0 -1,-0.3 0.031 47.7-106.6 -64.9-179.5 64.2 -3.3 30.6 71 189 A F E -K 92 0B 0 21,-2.1 21,-1.4 53,-0.1 2,-0.4 -0.918 42.1-173.8-107.5 98.1 63.6 -0.8 27.8 72 190 A I E -K 91 0B 23 -2,-0.7 52,-1.4 19,-0.2 2,-0.4 -0.818 7.3-164.6-100.2 142.4 63.3 -2.8 24.6 73 191 A A E -KL 90 123B 1 17,-2.9 17,-1.8 -2,-0.4 2,-0.4 -0.919 8.6-162.8-118.6 148.3 63.0 -1.1 21.2 74 192 A S E -KL 89 122B 8 48,-2.7 48,-3.1 -2,-0.4 2,-0.7 -0.998 20.5-141.6-140.5 138.4 61.9 -2.9 18.1 75 193 A L E -KL 88 121B 0 13,-2.8 12,-2.6 -2,-0.4 13,-1.2 -0.875 33.8-166.1 -95.2 113.6 62.0 -2.4 14.4 76 194 A C E -KL 86 120B 7 44,-3.8 44,-3.1 -2,-0.7 2,-0.4 -0.808 11.7-157.7-108.3 148.5 58.7 -3.6 13.0 77 195 A L E -KL 85 119B 6 8,-2.3 8,-0.5 -2,-0.3 2,-0.4 -0.957 4.8-170.0-125.1 142.1 57.6 -4.3 9.5 78 196 A K E - L 0 118B 65 40,-3.6 40,-0.6 -2,-0.4 6,-0.1 -0.903 10.9-171.8-133.0 99.0 54.1 -4.4 8.3 79 197 A S > - 0 0 15 4,-0.5 3,-1.6 -2,-0.4 38,-0.2 -0.692 38.5 -86.9 -93.1 151.3 53.7 -5.8 4.8 80 198 A P T 3 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.183 111.4 7.9 -54.3 134.5 50.5 -5.6 2.8 81 199 A G T 3 S+ 0 0 79 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.734 112.8 98.2 67.8 23.4 48.1 -8.5 3.6 82 200 A R S < S- 0 0 176 -3,-1.6 -1,-0.2 3,-0.0 3,-0.1 -0.976 77.4-107.9-140.5 151.7 50.3 -9.8 6.4 83 201 A F - 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