==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BLOOD CLOTTING 02-NOV-02 1N4Y . COMPND 2 MOLECULE: KISTRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CALLOSELASMA RHODOSTOMA; . AUTHOR A.M.KREZEL,J.KRANE,M.S.DENNIS,R.A.LAZARUS,G.WAGNER . 68 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5000.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 25 36.8 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 . 9 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.5 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 . 1 1.5 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 . 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 . 3 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 1.5 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 63 0, 0.0 3,-0.1 0, 0.0 17,-0.1 0.000 360.0 360.0 360.0-152.2 -21.7 -0.7 1.7 2 2 A K + 0 0 219 1,-0.1 2,-0.3 2,-0.0 17,-0.1 0.240 360.0 48.1 -99.9 10.5 -21.6 2.5 3.7 3 3 A E S S- 0 0 143 15,-0.4 2,-0.3 0, 0.0 -1,-0.1 -0.963 70.1-160.0-153.6 137.2 -18.1 1.8 4.9 4 4 A a - 0 0 61 -2,-0.3 16,-0.2 1,-0.1 15,-0.1 -0.865 24.2-166.4-121.6 145.9 -15.0 0.7 2.9 5 5 A D S S+ 0 0 78 14,-2.0 23,-0.8 -2,-0.3 24,-0.7 0.526 88.8 48.1 -95.8 -15.5 -11.7 -0.9 3.7 6 6 A b S S- 0 0 7 13,-1.1 -2,-0.0 22,-0.2 15,-0.0 -0.722 72.1-141.7-115.7 167.8 -10.5 0.2 0.3 7 7 A S S S+ 0 0 103 -2,-0.2 -1,-0.1 1,-0.1 3,-0.0 0.688 86.9 60.2 -93.6 -27.5 -10.7 3.4 -1.6 8 8 A S - 0 0 42 1,-0.1 3,-0.5 11,-0.0 6,-0.2 -0.817 63.2-152.7-109.6 140.9 -11.4 1.8 -4.9 9 9 A P S S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 10,-0.1 0.647 104.1 61.8 -74.9 -18.4 -14.3 -0.5 -6.0 10 10 A E S S+ 0 0 162 5,-0.1 6,-0.1 6,-0.1 -2,-0.0 0.589 78.5 119.2 -78.6 -12.2 -11.8 -1.9 -8.4 11 11 A N - 0 0 20 -3,-0.5 3,-0.2 1,-0.2 8,-0.1 -0.343 58.2-151.6 -62.5 131.0 -9.8 -3.0 -5.4 12 12 A P S S+ 0 0 101 0, 0.0 10,-0.2 0, 0.0 -1,-0.2 0.781 93.1 62.9 -75.0 -28.5 -9.4 -6.8 -5.4 13 13 A c S S+ 0 0 8 15,-0.2 9,-2.3 8,-0.1 2,-0.3 0.843 105.7 54.1 -65.3 -33.9 -9.1 -6.9 -1.6 14 14 A b B S-A 21 0A 6 7,-0.3 2,-0.3 -3,-0.2 7,-0.2 -0.723 83.3-127.8 -98.4 148.4 -12.6 -5.5 -1.4 15 15 A D > - 0 0 57 5,-2.0 4,-2.5 -2,-0.3 5,-0.4 -0.693 23.3-128.1 -79.3 150.4 -15.8 -6.8 -3.0 16 16 A A T 4 S+ 0 0 69 -2,-0.3 -1,-0.1 2,-0.2 -6,-0.1 0.852 106.5 51.1 -68.9 -35.6 -17.5 -4.1 -4.9 17 17 A A T 4 S+ 0 0 74 1,-0.2 -1,-0.2 3,-0.1 -3,-0.0 0.935 122.3 28.9 -71.1 -48.7 -20.8 -4.7 -3.1 18 18 A T T 4 S- 0 0 62 2,-0.2 -15,-0.4 -16,-0.1 -2,-0.2 0.808 87.5-145.8 -78.6 -32.3 -19.4 -4.6 0.4 19 19 A a S < S+ 0 0 19 -4,-2.5 -14,-2.0 1,-0.3 -13,-1.1 0.662 70.4 108.4 70.4 18.3 -16.6 -2.2 -0.4 20 20 A K S S- 0 0 97 -5,-0.4 -5,-2.0 -16,-0.2 -1,-0.3 -0.870 82.5 -72.1-140.5 154.7 -15.0 -4.3 2.2 21 21 A L B +A 14 0A 41 -2,-0.3 -7,-0.3 -7,-0.2 -8,-0.1 -0.191 36.4 178.0 -58.1 125.7 -12.4 -7.1 2.6 22 22 A R + 0 0 157 -9,-2.3 -1,-0.1 -10,-0.2 -8,-0.1 0.919 59.8 62.5 -74.4 -59.3 -13.4 -10.4 1.3 23 23 A P S S- 0 0 62 0, 0.0 2,-2.2 0, 0.0 -10,-0.0 0.255 104.5 -83.6 -75.0-176.8 -10.2 -12.4 1.9 24 24 A G S S+ 0 0 77 2,-0.0 2,-0.2 0, 0.0 -2,-0.0 -0.462 88.9 137.3 -73.9 63.0 -8.3 -13.3 5.0 25 25 A A - 0 0 24 -2,-2.2 12,-0.2 1,-0.1 11,-0.1 -0.592 56.1-152.4-118.0 168.2 -6.8 -9.9 4.7 26 26 A Q S S+ 0 0 109 10,-2.7 2,-0.3 1,-0.4 11,-0.2 0.802 76.8 1.1-104.0 -49.9 -5.8 -7.0 6.9 27 27 A d - 0 0 10 9,-2.0 -1,-0.4 1,-0.1 -21,-0.1 -0.811 45.8-151.7-137.8 171.2 -6.1 -3.9 4.6 28 28 A G S S+ 0 0 8 -23,-0.8 2,-0.3 1,-0.4 8,-0.2 0.714 78.8 15.4-113.1 -42.6 -7.0 -3.0 1.1 29 29 A E S S+ 0 0 70 -24,-0.7 -1,-0.4 7,-0.1 2,-0.2 -0.915 70.8 104.1-140.1 160.9 -5.0 0.1 0.3 30 30 A G S > S- 0 0 33 -2,-0.3 3,-1.1 3,-0.2 33,-0.2 -0.521 70.2 -97.1 134.9 150.2 -2.1 2.0 1.8 31 31 A L T 3 S+ 0 0 73 1,-0.3 32,-0.2 -2,-0.2 -1,-0.1 0.761 128.7 38.3 -70.2 -25.3 1.6 2.5 1.0 32 32 A e T 3 S+ 0 0 0 30,-2.6 7,-2.9 -3,-0.1 2,-1.0 0.254 92.9 104.9-106.9 7.6 2.5 -0.2 3.4 33 33 A d E < +B 38 0B 10 -3,-1.1 2,-0.4 29,-0.6 3,-0.2 -0.800 46.1 164.8 -95.0 99.5 -0.5 -2.3 2.5 34 34 A E E > +B 37 0B 102 3,-2.4 3,-1.1 -2,-1.0 -7,-0.1 -0.961 65.5 5.1-121.4 136.0 0.9 -5.2 0.4 35 35 A Q T 3 S- 0 0 132 -2,-0.4 -1,-0.2 1,-0.3 -9,-0.1 0.832 129.2 -66.0 60.4 34.0 -1.0 -8.3 -0.5 36 36 A c T 3 S+ 0 0 18 1,-0.3 -10,-2.7 -3,-0.2 -9,-2.0 0.751 123.0 99.5 62.4 23.3 -3.9 -6.8 1.2 37 37 A K E < S-B 34 0B 80 -3,-1.1 -3,-2.4 -11,-0.2 2,-0.7 -0.862 88.3 -87.1-138.7 164.7 -1.7 -7.1 4.3 38 38 A F E -B 33 0B 77 -2,-0.3 -5,-0.2 -5,-0.2 24,-0.1 -0.693 49.3-131.8 -80.2 113.2 0.6 -5.1 6.5 39 39 A S - 0 0 12 -7,-2.9 22,-0.2 -2,-0.7 3,-0.1 -0.103 30.6 -87.4 -63.9 163.2 4.1 -5.3 4.9 40 40 A R > - 0 0 164 1,-0.1 3,-1.2 20,-0.1 19,-0.3 -0.255 50.0 -88.8 -73.0 158.7 7.1 -6.1 7.0 41 41 A A T 3 S+ 0 0 49 17,-0.3 17,-0.2 1,-0.2 -1,-0.1 -0.476 109.9 22.7 -68.1 132.2 9.1 -3.5 8.9 42 42 A G T 3 S+ 0 0 33 15,-2.4 -1,-0.2 1,-0.4 2,-0.1 0.148 85.2 133.3 104.0 -16.5 11.9 -1.9 6.9 43 43 A K < - 0 0 110 -3,-1.2 14,-2.8 1,-0.1 2,-0.4 -0.413 68.5 -99.9 -69.1 142.7 10.5 -2.6 3.5 44 44 A I E +C 56 0C 82 12,-0.2 12,-0.2 1,-0.2 -1,-0.1 -0.498 43.3 171.4 -71.2 119.7 10.6 0.3 1.1 45 45 A f E S+ 0 0 22 10,-2.0 2,-0.4 -2,-0.4 11,-0.2 0.728 70.2 26.6 -95.4 -30.0 7.2 1.9 1.0 46 46 A R E S-C 55 0C 105 9,-1.3 9,-0.9 -14,-0.0 -1,-0.3 -0.997 72.7-131.1-139.2 138.2 8.3 4.9 -1.1 47 47 A I - 0 0 142 -2,-0.4 7,-0.1 7,-0.2 0, 0.0 -0.765 31.0-135.3 -86.4 132.6 11.1 5.6 -3.5 48 48 A P - 0 0 51 0, 0.0 2,-0.3 0, 0.0 6,-0.1 -0.141 11.2-149.5 -74.9 174.2 13.1 8.7 -2.8 49 49 A R > - 0 0 198 4,-0.1 3,-1.3 0, 0.0 2,-0.5 -0.976 59.4 -14.4-145.5 147.8 14.2 11.4 -5.2 50 50 A G T 3 S- 0 0 84 -2,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.563 129.8 -17.8 66.7-119.0 17.3 13.7 -5.0 51 51 A D T 3 S+ 0 0 145 -2,-0.5 -1,-0.2 2,-0.0 0, 0.0 0.290 103.1 123.2-106.4 5.9 18.9 13.6 -1.6 52 52 A M < - 0 0 107 -3,-1.3 2,-0.2 1,-0.1 3,-0.0 -0.334 61.7-116.6 -75.4 150.1 16.0 12.2 0.3 53 53 A P - 0 0 91 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 -0.500 35.5-102.1 -75.0 152.9 16.0 9.0 2.4 54 54 A D - 0 0 44 -2,-0.2 2,-0.3 -6,-0.1 -7,-0.2 -0.582 35.6-123.6 -73.0 138.2 13.9 6.1 1.4 55 55 A D E -C 46 0C 6 -9,-0.9 -10,-2.0 -2,-0.3 -9,-1.3 -0.658 29.5-155.0 -86.8 143.1 10.7 5.7 3.4 56 56 A R E -C 44 0C 90 -2,-0.3 10,-0.3 -12,-0.2 -12,-0.2 -0.881 18.4-103.8-126.9 147.6 10.3 2.4 5.2 57 57 A e - 0 0 2 -14,-2.8 -15,-2.4 -2,-0.3 7,-0.1 -0.406 16.2-154.0 -64.4 141.0 7.4 0.4 6.5 58 58 A T - 0 0 28 5,-0.2 -17,-0.3 -17,-0.2 -1,-0.1 0.806 27.9-133.7 -73.7 -35.1 6.9 0.4 10.3 59 59 A G S S+ 0 0 38 2,-0.4 -18,-0.2 -19,-0.3 -21,-0.1 0.624 95.0 80.8 75.9 18.8 5.2 -3.0 10.1 60 60 A Q S S+ 0 0 179 1,-0.2 2,-0.3 3,-0.2 3,-0.1 0.042 88.2 46.4-140.6 23.5 2.7 -1.3 12.4 61 61 A S - 0 0 42 -22,-0.2 -2,-0.4 -29,-0.1 -22,-0.2 -0.973 62.5-139.1-163.2 151.3 0.6 0.6 9.8 62 62 A A S S+ 0 0 20 -2,-0.3 -30,-2.6 -24,-0.1 -29,-0.6 0.730 98.4 53.8 -82.7 -26.6 -1.1 0.1 6.5 63 63 A D S S- 0 0 87 -33,-0.2 -5,-0.2 -32,-0.2 -3,-0.2 -0.788 93.3-113.3-105.6 153.6 0.1 3.6 5.6 64 64 A f - 0 0 2 -2,-0.3 -7,-0.1 1,-0.2 -33,-0.1 -0.667 21.3-160.5 -86.0 138.9 3.7 4.8 5.7 65 65 A P - 0 0 69 0, 0.0 -1,-0.2 0, 0.0 -8,-0.1 0.966 54.6 -67.6 -75.1 -77.9 4.6 7.5 8.3 66 66 A R S S- 0 0 205 -10,-0.3 -2,-0.1 -12,-0.1 -9,-0.1 0.461 99.8 -32.8-155.0 -55.1 7.9 9.1 7.3 67 67 A Y 0 0 102 -12,-0.2 -10,-0.1 -11,-0.1 -13,-0.1 0.244 360.0 360.0-151.5 4.7 10.9 6.8 7.5 68 68 A H 0 0 147 -13,-0.1 -11,-0.1 -27,-0.0 -13,-0.0 0.424 360.0 360.0 73.3 360.0 9.8 4.9 10.3