==== 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 PROTEIN BINDING 02-OCT-01 1IRH . COMPND 2 MOLECULE: TISSUE FACTOR PATHWAY INHIBITOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.MINE,T.YAMAZAKI,T.MIYATA,S.HARA,H.KATO . 61 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5021.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 26 42.6 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 . 7 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.6 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 . 1 1.6 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 . 7 11.5 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+3), SAME NUMBER PER 100 RESIDUES . 6 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 3.3 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 1 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 . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 E 0 0 226 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -52.7 41.9 21.2 3.0 2 2 A F - 0 0 190 1,-0.1 0, 0.0 3,-0.0 0, 0.0 -0.623 360.0-127.1 -89.9 150.1 42.3 17.7 4.6 3 3 A H - 0 0 194 -2,-0.2 -1,-0.1 1,-0.0 0, 0.0 0.915 45.1-123.3 -61.8 -40.0 43.6 17.3 8.2 4 4 A G - 0 0 51 -3,-0.0 -1,-0.0 2,-0.0 -2,-0.0 0.886 27.7-157.1 95.3 74.6 46.3 14.8 6.9 5 5 A P - 0 0 84 0, 0.0 4,-0.0 0, 0.0 -3,-0.0 0.330 20.2-118.2 -62.0-156.3 45.9 11.5 8.7 6 6 A S S S+ 0 0 106 2,-0.0 -2,-0.0 4,-0.0 0, 0.0 -0.041 95.0 53.6-142.2 37.0 48.9 9.1 9.0 7 7 A W S S+ 0 0 108 37,-0.1 37,-0.0 38,-0.1 -1,-0.0 0.263 91.6 63.9-155.1 15.8 47.9 5.9 7.2 8 8 A a S S+ 0 0 12 17,-0.0 18,-0.1 50,-0.0 50,-0.1 0.669 110.7 34.0-113.7 -27.7 46.7 6.8 3.6 9 9 A L S S+ 0 0 125 2,-0.1 19,-0.1 19,-0.0 3,-0.1 0.226 91.0 119.3-110.0 13.1 49.9 8.2 2.1 10 10 A T S S- 0 0 29 1,-0.1 16,-0.1 3,-0.0 3,-0.1 -0.487 77.1 -91.7 -78.1 151.4 52.4 5.9 4.0 11 11 A P - 0 0 99 0, 0.0 2,-0.4 0, 0.0 33,-0.2 -0.303 53.0 -91.9 -60.8 142.6 54.7 3.6 2.0 12 12 A A - 0 0 30 1,-0.1 2,-0.5 -3,-0.1 13,-0.1 -0.380 42.8-126.1 -58.3 111.9 53.1 0.1 1.4 13 13 A D + 0 0 35 -2,-0.4 26,-0.4 1,-0.1 -1,-0.1 -0.451 47.4 155.1 -63.6 112.7 54.4 -2.0 4.4 14 14 A R + 0 0 174 -2,-0.5 -1,-0.1 24,-0.2 29,-0.1 -0.447 44.7 70.5-139.2 64.9 56.0 -5.0 2.7 15 15 A G S S+ 0 0 53 27,-0.1 -1,-0.1 25,-0.1 3,-0.1 -0.207 71.5 68.8-176.9 75.6 58.6 -6.5 5.1 16 16 A L S S+ 0 0 99 1,-0.5 26,-0.1 -3,-0.1 27,-0.1 0.095 86.1 33.5-155.8 -81.7 57.5 -8.3 8.3 17 17 A b S S- 0 0 49 24,-0.7 -1,-0.5 25,-0.2 23,-0.2 0.057 79.1-114.3 -73.6-165.9 55.7 -11.7 8.3 18 18 A R + 0 0 253 21,-0.1 2,-0.4 -3,-0.1 22,-0.1 -0.428 68.5 115.4-132.6 61.8 56.4 -14.3 5.7 19 19 A A - 0 0 47 20,-0.8 2,-1.7 22,-0.1 -2,-0.1 -0.991 58.7-137.7-132.9 131.2 53.2 -14.7 3.6 20 20 A N + 0 0 141 -2,-0.4 19,-0.2 2,-0.1 18,-0.1 -0.542 46.6 154.4 -86.5 77.3 52.8 -13.9 -0.1 21 21 A E - 0 0 76 17,-1.8 2,-0.1 -2,-1.7 18,-0.0 0.010 42.5-127.0 -87.1-161.2 49.3 -12.2 0.1 22 22 A N + 0 0 94 15,-0.2 15,-0.2 2,-0.0 2,-0.2 -0.484 33.3 168.9-152.4 74.8 47.9 -9.6 -2.3 23 23 A R E -A 36 0A 72 13,-1.6 13,-3.1 -2,-0.1 2,-0.8 -0.563 38.5-114.1 -89.5 155.1 46.6 -6.4 -0.6 24 24 A F E -AB 35 48A 43 24,-2.7 24,-1.0 11,-0.3 2,-0.4 -0.768 30.9-161.7 -91.8 108.6 45.6 -3.2 -2.5 25 25 A Y E -A 34 0A 35 9,-2.0 9,-1.8 -2,-0.8 2,-0.8 -0.741 18.7-126.9 -91.0 132.8 48.0 -0.4 -1.7 26 26 A Y E -A 33 0A 37 -2,-0.4 2,-0.4 20,-0.3 7,-0.2 -0.654 23.2-144.9 -79.6 110.6 46.9 3.2 -2.4 27 27 A N > - 0 0 43 5,-1.4 4,-1.0 -2,-0.8 -18,-0.0 -0.600 4.5-153.4 -77.2 128.6 49.6 4.8 -4.6 28 28 A S T 4 S+ 0 0 67 -2,-0.4 -1,-0.1 2,-0.1 5,-0.1 0.432 90.2 53.8 -82.1 4.3 50.1 8.5 -3.8 29 29 A V T 4 S+ 0 0 120 3,-0.2 -1,-0.1 0, 0.0 -2,-0.0 0.853 124.8 15.3-101.8 -56.1 51.4 9.2 -7.3 30 30 A I T 4 S- 0 0 99 2,-0.2 -2,-0.1 1,-0.0 3,-0.1 0.763 91.7-135.8 -90.5 -26.0 48.8 7.8 -9.7 31 31 A G < + 0 0 18 -4,-1.0 2,-0.1 1,-0.3 -3,-0.1 -0.005 65.8 119.1 95.9 -31.9 46.0 7.5 -7.1 32 32 A K S S- 0 0 107 -6,-0.1 -5,-1.4 1,-0.1 2,-1.0 -0.396 74.7-112.0 -68.2 144.3 44.9 4.0 -8.2 33 33 A c E -A 26 0A 4 -7,-0.2 -7,-0.3 18,-0.1 -1,-0.1 -0.648 33.2-157.7 -79.9 105.0 45.3 1.2 -5.6 34 34 A R E -A 25 0A 134 -9,-1.8 -9,-2.0 -2,-1.0 2,-0.1 -0.738 17.8-123.1 -86.4 123.1 48.1 -1.0 -6.9 35 35 A P E -A 24 0A 77 0, 0.0 2,-0.3 0, 0.0 -11,-0.3 -0.384 35.1-177.4 -64.2 136.5 47.9 -4.6 -5.5 36 36 A F E -A 23 0A 30 -13,-3.1 -13,-1.6 -2,-0.1 2,-1.4 -0.970 38.0-100.0-135.2 150.8 51.2 -5.6 -3.7 37 37 A K - 0 0 148 -2,-0.3 -15,-0.2 -15,-0.2 2,-0.2 -0.515 43.8-155.9 -71.7 94.6 52.4 -8.9 -2.0 38 38 A Y - 0 0 16 -2,-1.4 -17,-1.8 1,-0.1 -24,-0.2 -0.504 12.5-140.1 -72.8 136.6 51.7 -8.0 1.7 39 39 A S - 0 0 17 -26,-0.4 -20,-0.8 -2,-0.2 2,-0.4 0.970 38.3-132.0 -62.8 -51.8 53.9 -9.9 4.1 40 40 A G + 0 0 21 2,-0.3 -1,-0.2 -23,-0.2 -25,-0.1 -0.932 68.5 54.2 141.3-118.6 51.0 -10.4 6.7 41 41 A b S S+ 0 0 81 -2,-0.4 -24,-0.7 -25,-0.1 -1,-0.1 -0.157 102.7 19.2 -52.8 145.9 51.2 -9.8 10.5 42 42 A G S S+ 0 0 46 -26,-0.1 -2,-0.3 1,-0.1 2,-0.2 0.285 78.1 105.4 72.0 153.6 52.4 -6.3 11.5 43 43 A G - 0 0 36 -27,-0.1 -1,-0.1 -4,-0.1 -31,-0.1 -0.812 69.8 -45.6 133.0-174.8 52.4 -3.2 9.2 44 44 A N - 0 0 62 -2,-0.2 3,-0.3 -33,-0.2 -37,-0.1 -0.056 54.5-106.0 -78.6-172.6 50.4 -0.0 8.7 45 45 A E S S+ 0 0 168 1,-0.2 -38,-0.1 3,-0.0 -1,-0.1 -0.069 97.9 88.4-107.6 34.0 46.6 0.2 8.7 46 46 A N + 0 0 6 2,-0.1 2,-1.2 -33,-0.0 -20,-0.3 -0.014 47.7 127.8-118.3 29.6 46.2 0.8 5.0 47 47 A N - 0 0 30 -3,-0.3 2,-0.2 -22,-0.1 -22,-0.1 -0.697 37.4-176.5 -89.6 94.4 46.1 -2.9 3.9 48 48 A F B -B 24 0A 18 -2,-1.2 -24,-2.7 -24,-1.0 -2,-0.1 -0.578 22.1-158.1 -89.2 154.1 42.9 -3.1 1.8 49 49 A T S S+ 0 0 93 -26,-0.2 2,-0.2 -2,-0.2 -1,-0.1 0.690 76.0 31.4-102.7 -24.1 41.6 -6.4 0.3 50 50 A S S S- 0 0 44 -26,-0.1 4,-0.3 1,-0.1 -26,-0.1 -0.575 72.7-126.0-121.4-173.4 39.5 -5.0 -2.6 51 51 A K S > S+ 0 0 94 -2,-0.2 4,-2.0 2,-0.1 5,-0.3 0.733 102.1 61.2-106.9 -32.2 39.6 -1.9 -4.8 52 52 A Q H > S+ 0 0 169 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.838 108.5 46.9 -65.4 -29.1 36.2 -0.4 -4.3 53 53 A E H > S+ 0 0 82 2,-0.2 4,-1.1 3,-0.1 5,-0.2 0.874 107.2 55.8 -80.3 -37.3 37.0 0.0 -0.6 54 54 A c H >>S+ 0 0 0 -4,-0.3 4,-1.9 2,-0.2 5,-0.6 0.948 115.9 37.0 -60.8 -47.0 40.5 1.6 -1.2 55 55 A L H X>S+ 0 0 48 -4,-2.0 5,-2.7 1,-0.2 4,-1.2 0.933 114.7 54.3 -72.2 -44.1 39.0 4.3 -3.4 56 56 A R H <5S+ 0 0 166 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.689 116.3 42.5 -63.9 -14.5 35.8 4.7 -1.3 57 57 A A H <5S+ 0 0 45 -4,-1.1 -2,-0.2 -3,-0.3 -3,-0.2 0.892 127.1 21.1 -96.5 -67.8 38.2 5.3 1.7 58 58 A a H <5S+ 0 0 41 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.1 0.856 139.7 32.4 -73.4 -31.9 41.1 7.5 0.7 59 59 A K T <