==== 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 INHIBITOR 24-JUL-06 2IZ3 . COMPND 2 MOLECULE: BETA-MICROSEMINOPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.GHASRIANI,K.TEILUM,Y.JOHNSSON,P.FERNLUND,T.DRAKENBERG . 94 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7208.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 50 53.2 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 . 33 35.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 2.1 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 . 5 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.1 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 . 2 0 1 1 1 2 0 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 . 1 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 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 S 0 0 84 0, 0.0 50,-2.0 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -8.1 3.2 0.0 4.1 2 2 A a E +A 50 0A 71 48,-0.2 2,-0.3 2,-0.0 48,-0.2 -0.928 360.0 167.7-159.9 132.3 4.6 -3.5 4.3 3 3 A Y E -A 49 0A 125 46,-1.8 46,-2.2 -2,-0.3 2,-0.5 -0.981 27.0-126.4-145.4 153.6 3.9 -6.6 6.4 4 4 A F E -A 48 0A 149 -2,-0.3 44,-0.2 44,-0.2 -2,-0.0 -0.892 12.8-164.7-108.3 131.7 4.8 -10.3 6.3 5 5 A I E -A 47 0A 40 42,-1.9 42,-1.1 -2,-0.5 5,-0.1 -0.919 14.6-154.8-113.0 106.1 2.3 -13.1 6.5 6 6 A P E > -A 46 0A 47 0, 0.0 3,-1.0 0, 0.0 2,-0.9 -0.420 30.0-111.3 -78.9 156.1 4.0 -16.6 7.3 7 7 A N T 3 S+ 0 0 23 38,-1.1 39,-0.1 1,-0.3 11,-0.0 -0.014 102.0 91.7 -75.6 34.9 2.4 -19.9 6.3 8 8 A E T 3 S- 0 0 179 -2,-0.9 -1,-0.3 1,-0.1 38,-0.0 0.253 112.4 -16.8-110.8 7.8 1.8 -20.4 10.0 9 9 A G S < S- 0 0 63 -3,-1.0 -2,-0.1 7,-0.1 -1,-0.1 0.265 73.5-177.9 151.5 68.4 -1.7 -18.9 10.0 10 10 A V > - 0 0 19 -5,-0.1 3,-1.0 1,-0.1 2,-0.1 -0.542 35.9-101.4 -82.9 149.8 -2.6 -16.7 7.0 11 11 A P T 3 S+ 0 0 99 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.385 102.4 9.6 -71.2 148.5 -6.1 -15.1 6.9 12 12 A G T 3 S- 0 0 75 1,-0.2 7,-0.0 -2,-0.1 -2,-0.0 0.822 90.9-170.2 52.8 32.2 -8.9 -16.6 4.8 13 13 A D < + 0 0 75 -3,-1.0 -1,-0.2 1,-0.2 5,-0.0 -0.244 27.1 147.5 -55.8 138.5 -6.6 -19.6 4.3 14 14 A S S S+ 0 0 87 -3,-0.1 -1,-0.2 5,-0.0 -2,-0.1 0.500 76.0 27.7-139.1 -47.0 -7.8 -22.1 1.7 15 15 A T S S- 0 0 44 0, 0.0 -2,-0.1 0, 0.0 10,-0.0 0.385 91.6-131.5-102.8 0.3 -4.8 -23.8 -0.0 16 16 A R S S+ 0 0 167 1,-0.2 -7,-0.1 -6,-0.1 -6,-0.1 0.365 94.3 74.4 65.4 -8.9 -2.5 -23.3 3.0 17 17 A K S S- 0 0 148 28,-0.0 26,-0.2 25,-0.0 -1,-0.2 0.847 114.1 -49.7 -94.4 -86.0 -0.1 -22.0 0.4 18 18 A b + 0 0 9 8,-0.1 8,-0.5 24,-0.1 2,-0.4 -0.577 58.0 171.4-163.4 92.6 -1.0 -18.5 -0.9 19 19 A M B -D 25 0B 56 -2,-0.1 6,-0.2 6,-0.1 -3,-0.0 -0.898 29.3-126.7-108.8 132.5 -4.5 -17.6 -2.0 20 20 A D > - 0 0 14 4,-1.7 3,-0.7 -2,-0.4 -2,-0.0 -0.229 25.8-108.7 -71.5 164.1 -5.5 -14.0 -2.8 21 21 A L T 3 S+ 0 0 143 1,-0.2 -1,-0.1 2,-0.1 13,-0.0 0.729 116.1 67.5 -65.9 -21.7 -8.5 -12.3 -1.2 22 22 A K T 3 S- 0 0 166 2,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.885 115.9-111.2 -65.0 -39.5 -10.2 -12.4 -4.6 23 23 A G S < S+ 0 0 41 -3,-0.7 2,-0.4 1,-0.4 -2,-0.1 0.483 76.8 125.5 116.1 13.0 -10.4 -16.2 -4.4 24 24 A N - 0 0 92 1,-0.0 -4,-1.7 2,-0.0 -1,-0.4 -0.842 52.1-136.0-106.2 140.8 -7.9 -16.9 -7.2 25 25 A K B -D 19 0B 151 -2,-0.4 -6,-0.1 -6,-0.2 -1,-0.0 -0.498 17.8-165.8 -90.1 161.9 -4.8 -19.1 -6.9 26 26 A H - 0 0 49 -8,-0.5 -8,-0.1 -2,-0.2 4,-0.1 -0.995 20.4-114.7-149.1 142.2 -1.3 -18.2 -8.2 27 27 A P > - 0 0 101 0, 0.0 3,-1.2 0, 0.0 15,-0.2 -0.356 48.9 -82.9 -74.2 156.3 1.9 -20.2 -8.8 28 28 A I T 3 S+ 0 0 87 1,-0.3 15,-0.2 13,-0.1 3,-0.1 -0.060 117.1 32.7 -53.2 161.4 5.1 -19.4 -6.9 29 29 A N T 3 S+ 0 0 128 13,-1.6 2,-0.3 1,-0.2 -1,-0.3 0.559 98.2 119.8 64.7 8.1 7.2 -16.5 -8.1 30 30 A S < - 0 0 22 -3,-1.2 12,-1.3 12,-0.3 2,-0.3 -0.778 51.5-150.8-105.0 149.4 4.0 -14.9 -9.2 31 31 A E E -B 41 0A 116 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.899 10.8-171.0-119.5 148.0 2.6 -11.5 -8.0 32 32 A W E -B 40 0A 24 8,-1.9 8,-1.1 -2,-0.3 2,-0.5 -0.986 18.3-133.1-139.4 149.3 -1.0 -10.4 -7.7 33 33 A Q E +B 39 0A 145 -2,-0.3 2,-0.3 6,-0.2 6,-0.2 -0.888 30.7 173.4-105.9 127.1 -2.8 -7.1 -7.0 34 34 A T E >> +B 38 0A 22 4,-2.0 3,-1.7 -2,-0.5 4,-1.6 -0.829 57.1 30.4-128.4 166.8 -5.6 -7.1 -4.4 35 35 A D T 34 S- 0 0 118 1,-0.3 -1,-0.1 -2,-0.3 4,-0.1 0.530 111.9 -94.1 63.7 2.8 -7.8 -4.6 -2.7 36 36 A N T 34 S+ 0 0 150 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.841 125.0 46.8 57.9 35.2 -7.4 -2.6 -5.9 37 37 A c T <4 S+ 0 0 24 -3,-1.7 15,-1.4 1,-0.3 16,-0.5 0.248 97.3 77.8 172.7 22.3 -4.5 -0.8 -4.3 38 38 A E E < -BC 34 51A 41 -4,-1.6 -4,-2.0 13,-0.2 -1,-0.3 -0.980 53.0-162.7-143.7 152.1 -2.3 -3.5 -2.6 39 39 A T E +BC 33 50A 34 11,-2.0 11,-2.1 -2,-0.3 2,-0.3 -0.882 9.7 170.5-133.7 165.5 0.2 -6.0 -3.9 40 40 A d E -BC 32 49A 4 -8,-1.1 -8,-1.9 -2,-0.3 2,-0.3 -0.960 19.3-138.6-171.5 154.4 1.9 -9.2 -2.6 41 41 A T E -BC 31 48A 19 7,-1.9 7,-1.3 -2,-0.3 2,-0.4 -0.863 16.3-133.2-120.8 154.8 4.1 -12.1 -3.7 42 42 A b E + C 0 47A 1 -12,-1.3 -13,-1.6 -2,-0.3 -12,-0.3 -0.918 22.9 179.6-112.2 134.2 3.9 -15.9 -2.9 43 43 A Y E > - C 0 46A 111 3,-2.3 3,-0.6 -2,-0.4 -15,-0.0 -0.775 49.1 -84.7-124.4 168.4 6.9 -18.0 -1.8 44 44 A E T 3 S- 0 0 161 1,-0.3 -1,-0.0 -2,-0.3 3,-0.0 0.877 120.7 -10.8 -36.5 -58.9 7.3 -21.7 -0.9 45 45 A T T 3 S+ 0 0 91 -3,-0.0 -38,-1.1 -37,-0.0 2,-0.3 -0.115 126.4 69.3-139.5 38.8 6.2 -21.1 2.7 46 46 A E E < -AC 6 43A 72 -3,-0.6 -3,-2.3 -40,-0.2 2,-0.4 -0.992 53.2-157.8-156.8 150.1 6.1 -17.3 3.0 47 47 A I E -AC 5 42A 14 -42,-1.1 -42,-1.9 -2,-0.3 2,-0.5 -0.994 2.9-166.0-132.8 138.9 4.2 -14.2 1.8 48 48 A S E -AC 4 41A 31 -7,-1.3 -7,-1.9 -2,-0.4 2,-0.4 -0.979 10.1-170.4-127.9 118.5 5.3 -10.6 1.6 49 49 A d E +AC 3 40A 12 -46,-2.2 -46,-1.8 -2,-0.5 2,-0.3 -0.860 7.6 173.6-112.7 145.4 2.7 -7.8 1.0 50 50 A a E -AC 2 39A 45 -11,-2.1 -11,-2.0 -2,-0.4 -48,-0.2 -0.992 26.8-121.0-149.4 139.1 3.2 -4.2 0.3 51 51 A T E - C 0 38A 14 -50,-2.0 -13,-0.2 -2,-0.3 -11,-0.0 -0.300 11.1-135.9 -78.1 164.2 0.9 -1.4 -0.6 52 52 A L S S+ 0 0 76 -15,-1.4 2,-0.2 42,-0.1 -14,-0.1 0.608 76.3 97.9 -93.0 -17.3 1.0 0.7 -3.8 53 53 A V - 0 0 12 -16,-0.5 2,-0.2 21,-0.1 21,-0.2 -0.536 69.9-133.6 -77.4 138.7 0.5 4.0 -2.0 54 54 A S - 0 0 24 19,-0.2 21,-0.4 -2,-0.2 40,-0.2 -0.582 13.4-130.8 -89.7 153.1 3.5 6.2 -1.2 55 55 A T E -E 93 0C 32 38,-1.6 38,-1.6 -2,-0.2 2,-0.3 -0.890 16.8-127.8-106.8 132.2 4.1 7.8 2.2 56 56 A P E +E 92 0C 2 0, 0.0 2,-0.3 0, 0.0 36,-0.2 -0.582 38.0 162.7 -78.2 135.2 5.0 11.5 2.6 57 57 A V E +E 91 0C 45 34,-1.3 34,-1.6 -2,-0.3 33,-0.5 -0.995 47.1 39.6-152.7 148.3 8.1 12.2 4.7 58 58 A G S S+ 0 0 42 1,-0.3 32,-0.6 -2,-0.3 2,-0.3 0.802 89.2 112.0 83.2 31.3 10.5 15.1 5.2 59 59 A Y S S- 0 0 29 30,-0.2 2,-1.2 -3,-0.1 -1,-0.3 -0.864 81.7 -85.0-131.8 165.1 7.8 17.8 5.1 60 60 A D > - 0 0 62 28,-0.3 4,-2.0 -2,-0.3 3,-0.2 -0.586 37.6-177.2 -74.9 99.1 6.2 20.2 7.5 61 61 A K T 4 S+ 0 0 118 -2,-1.2 -1,-0.2 1,-0.2 5,-0.1 0.595 81.6 57.4 -71.2 -11.1 3.5 18.1 9.2 62 62 A D T 4 S+ 0 0 130 1,-0.1 -1,-0.2 3,-0.1 -2,-0.1 0.821 116.7 28.9 -88.5 -35.9 2.5 21.2 11.1 63 63 A N T 4 S+ 0 0 92 -3,-0.2 17,-2.3 1,-0.1 18,-0.3 0.622 126.0 45.1 -98.5 -17.0 1.8 23.5 8.1 64 64 A e E < -F 79 0D 1 -4,-2.0 2,-0.4 15,-0.2 15,-0.2 -0.949 65.3-157.8-129.5 149.8 0.8 20.7 5.7 65 65 A Q E -F 78 0D 84 13,-1.7 13,-1.5 -2,-0.3 2,-0.3 -0.970 22.5-118.1-128.2 141.4 -1.4 17.7 6.0 66 66 A R E -F 77 0D 138 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.582 26.4-155.6 -79.9 136.3 -1.4 14.5 3.9 67 67 A I E -F 76 0D 45 9,-3.2 9,-1.9 -2,-0.3 2,-0.6 -0.941 10.1-134.8-117.2 133.6 -4.6 13.7 2.0 68 68 A F E -F 75 0D 80 -2,-0.4 2,-0.6 7,-0.2 7,-0.2 -0.776 21.7-177.9 -91.7 119.4 -5.7 10.2 0.9 69 69 A K E > > -F 74 0D 90 5,-1.8 5,-1.4 -2,-0.6 3,-0.8 -0.925 11.0-175.7-119.3 106.3 -6.9 9.9 -2.8 70 70 A K G > 5S+ 0 0 153 -2,-0.6 3,-1.4 1,-0.2 -1,-0.1 0.888 81.8 67.1 -64.6 -42.4 -8.1 6.5 -3.8 71 71 A E G 3 5S+ 0 0 176 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.758 118.3 25.2 -52.1 -25.7 -8.6 7.5 -7.4 72 72 A D G < 5S- 0 0 93 -3,-0.8 -1,-0.3 2,-0.2 -2,-0.2 0.263 100.9-133.3-121.3 7.8 -4.8 7.9 -7.7 73 73 A c T < 5 + 0 0 25 -3,-1.4 2,-0.3 -4,-0.3 -19,-0.2 0.895 68.1 101.6 36.2 64.9 -3.9 5.5 -4.9 74 74 A K E - 0 0 96 3,-0.1 3,-1.5 1,-0.1 -3,-0.7 -0.782 64.5-176.1-132.9 88.3 -4.4 26.8 0.8 83 83 A P T 3 S+ 0 0 79 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.665 81.4 72.4 -58.5 -14.7 -5.1 23.1 0.1 84 84 A K T 3 S+ 0 0 201 -6,-0.1 2,-0.3 -3,-0.1 -3,-0.0 0.887 87.1 70.5 -67.6 -40.1 -4.7 24.0 -3.6 85 85 A K S < S- 0 0 131 -3,-1.5 -6,-1.9 -6,-0.1 -3,-0.1 -0.621 84.8-127.7 -83.1 136.7 -1.0 24.4 -3.3 86 86 A T B -G 78 0D 97 -2,-0.3 2,-0.4 -8,-0.2 -8,-0.3 -0.359 19.0-120.8 -79.3 162.1 1.2 21.3 -2.8 87 87 A e - 0 0 16 -10,-3.3 -10,-0.3 -22,-0.1 2,-0.1 -0.831 26.3-109.1-106.4 142.8 3.7 20.9 0.0 88 88 A S - 0 0 106 -2,-0.4 2,-0.4 2,-0.0 -28,-0.3 -0.434 34.8-167.7 -70.2 140.6 7.4 20.3 -0.5 89 89 A V - 0 0 30 -2,-0.1 -31,-0.2 -30,-0.1 -30,-0.2 -0.997 24.5-148.0-133.7 135.0 8.7 16.8 0.5 90 90 A S S S- 0 0 94 -32,-0.6 2,-0.3 -33,-0.5 -32,-0.2 0.874 78.9 -31.5 -66.3 -38.0 12.3 15.5 0.8 91 91 A E E -E 57 0C 124 -34,-1.6 -34,-1.3 -36,-0.0 2,-0.3 -0.984 54.5-120.5-171.9 168.2 11.3 12.1 -0.3 92 92 A W E -E 56 0C 99 -2,-0.3 2,-0.5 -36,-0.2 -38,-0.0 -0.916 21.0-131.4-123.0 148.8 8.6 9.4 -0.5 93 93 A I E E 55 0C 93 -38,-1.6 -38,-1.6 -2,-0.3 -2,-0.0 -0.876 360.0 360.0-104.1 127.2 8.6 5.8 0.8 94 94 A I 0 0 145 -2,-0.5 -40,-0.1 -40,-0.2 -42,-0.1 -0.879 360.0 360.0-167.8 360.0 7.5 3.0 -1.5