==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 09-JAN-10 3LC3 . COMPND 2 MOLECULE: COAGULATION FACTOR IX; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.WANG,R.BECK . 584 4 14 12 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28406.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 347 59.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 166 28.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 34 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 6.3 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 2 2 0 2 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 . 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 PARALLEL BRIDGES PER LADDER . 8 6 6 12 2 4 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 . 4 0 0 0 0 2 0 2 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 16 A V 0 0 1 0, 0.0 3,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 122.3 26.0 -9.9 26.8 2 17 A V B +A 179 0A 14 177,-2.9 177,-2.1 1,-0.2 132,-0.1 -0.793 360.0 1.4 -90.9 130.8 29.3 -11.7 27.5 3 18 A G S S+ 0 0 45 130,-0.6 -1,-0.2 -2,-0.4 177,-0.1 0.787 100.4 123.5 67.9 30.0 31.9 -9.7 29.5 4 19 A G - 0 0 21 -3,-0.5 2,-0.3 175,-0.1 142,-0.2 -0.044 54.5-112.0 -99.2-155.1 29.7 -6.6 30.1 5 20 A E E -B 145 0B 119 140,-1.9 140,-2.3 -2,-0.0 2,-0.2 -0.954 33.2 -86.1-141.0 159.3 28.6 -4.8 33.2 6 21 A D E -B 144 0B 100 -2,-0.3 138,-0.2 138,-0.2 2,-0.1 -0.472 41.0-132.6 -63.1 129.6 25.4 -4.2 35.1 7 22 A A - 0 0 5 136,-3.0 136,-0.1 -2,-0.2 3,-0.1 -0.455 20.2-120.7 -65.4 156.7 23.4 -1.2 33.9 8 23 A K > - 0 0 105 1,-0.1 3,-2.1 -2,-0.1 4,-0.4 -0.729 46.0 -79.6 -87.4 151.9 22.1 1.2 36.6 9 24 A P T 3 S+ 0 0 57 0, 0.0 -1,-0.1 0, 0.0 47,-0.1 -0.243 119.0 11.7 -51.1 134.5 18.3 1.7 36.7 10 25 A G T 3 S+ 0 0 12 45,-0.2 278,-0.5 94,-0.2 277,-0.3 0.535 91.0 117.3 74.5 8.9 17.3 4.2 34.0 11 26 A Q S < S+ 0 0 36 -3,-2.1 -1,-0.1 1,-0.3 3,-0.1 0.854 90.1 24.3 -72.3 -38.3 20.7 4.0 32.2 12 27 A F S > S+ 0 0 18 -4,-0.4 3,-1.8 1,-0.1 -1,-0.3 -0.656 73.6 165.9-124.8 74.2 19.0 2.6 29.1 13 28 A P T 3 S+ 0 0 2 0, 0.0 93,-2.2 0, 0.0 41,-0.2 0.495 72.7 61.0 -77.1 -1.4 15.4 3.7 29.4 14 29 A W T 3 S+ 0 0 3 91,-0.2 16,-2.2 93,-0.1 2,-0.2 0.483 83.0 106.0 -91.8 -8.9 14.7 2.8 25.7 15 30 A Q E < +J 29 0C 4 -3,-1.8 39,-0.6 14,-0.2 40,-0.4 -0.526 46.9 178.5 -76.0 135.7 15.5 -0.8 26.3 16 31 A V E -JK 28 53C 0 12,-2.3 12,-1.5 -2,-0.2 2,-0.4 -0.903 19.5-136.3-128.5 164.5 12.6 -3.3 26.6 17 32 A V E -JK 27 52C 2 35,-2.0 35,-2.6 -2,-0.3 2,-0.5 -0.914 12.9-139.7-119.6 145.3 12.4 -7.1 27.1 18 33 A L E -JK 26 51C 0 8,-2.5 7,-1.8 -2,-0.4 8,-0.8 -0.925 19.8-175.1-108.2 129.1 10.2 -9.5 25.2 19 34 A N E + K 0 50C 26 31,-2.9 31,-3.0 -2,-0.5 4,-0.3 -0.926 22.3 119.9-120.4 147.3 8.5 -12.4 26.9 20 35 A G S S- 0 0 29 2,-2.6 28,-0.1 -2,-0.3 29,-0.1 -0.530 83.0 -11.9-159.8-125.1 6.4 -15.2 25.6 21 36 A K S S+ 0 0 146 26,-0.2 2,-0.3 -2,-0.2 27,-0.1 0.656 143.9 33.8 -65.5 -17.5 6.5 -19.0 25.5 22 38 A V S S- 0 0 93 -4,-0.0 -2,-2.6 0, 0.0 3,-0.5 -0.970 95.8-123.4-128.2 140.8 10.0 -18.3 26.8 23 39 A D S S+ 0 0 119 -2,-0.3 -4,-0.2 -4,-0.3 -2,-0.0 -0.652 86.9 5.5 -88.2 151.4 10.8 -15.3 29.1 24 40 A A S S+ 0 0 15 -2,-0.2 -1,-0.2 1,-0.1 -5,-0.2 0.880 78.7 149.7 49.6 51.3 13.4 -12.7 28.1 25 41 A F - 0 0 54 -7,-1.8 158,-0.4 -3,-0.5 2,-0.3 0.646 64.9 -0.9 -90.8 -13.2 13.9 -14.3 24.7 26 42 A a E -J 18 0C 7 -8,-0.8 -8,-2.5 158,-0.1 160,-0.2 -0.963 65.7-128.3-165.0 161.0 14.8 -11.1 22.9 27 43 A G E +J 17 0C 1 158,-2.8 12,-0.4 -2,-0.3 2,-0.3 -0.466 21.6 178.6-102.5-179.0 15.2 -7.3 23.5 28 44 A G E -J 16 0C 0 -12,-1.5 -12,-2.3 -2,-0.2 2,-0.3 -0.951 21.6-118.5-165.5-178.8 13.9 -4.3 21.7 29 45 A S E -JL 15 37C 0 8,-2.4 8,-2.8 -2,-0.3 2,-0.6 -0.984 27.1-110.0-132.0 146.3 13.9 -0.5 21.8 30 46 A I E + L 0 36C 0 -16,-2.2 78,-2.5 -2,-0.3 6,-0.2 -0.623 29.2 175.8 -76.7 117.3 11.1 2.1 22.3 31 47 A V E S- 0 0 20 4,-2.4 2,-0.3 -2,-0.6 5,-0.2 0.867 71.4 -35.4 -80.3 -47.4 10.4 4.1 19.1 32 48 A N E > S- L 0 35C 27 3,-1.5 3,-0.9 75,-0.1 -1,-0.4 -0.912 82.3 -65.1-159.9-173.9 7.5 5.9 20.8 33 49 A E T 3 S+ 0 0 83 -2,-0.3 66,-2.4 1,-0.2 64,-0.1 0.740 132.8 30.4 -53.8 -26.6 4.7 5.4 23.3 34 50 A K T 3 S+ 0 0 40 64,-0.2 61,-2.6 198,-0.2 2,-0.4 0.501 112.3 66.0-109.6 -7.5 3.0 2.8 20.9 35 51 A W E < -LM 32 94C 7 -3,-0.9 -4,-2.4 59,-0.2 -3,-1.5 -0.967 48.7-171.0-133.9 133.5 5.9 1.2 19.0 36 52 A I E -LM 30 93C 0 57,-2.4 57,-3.1 -2,-0.4 2,-0.4 -0.916 15.6-146.3-114.6 141.1 8.9 -1.0 19.7 37 53 A V E +LM 29 92C 0 -8,-2.8 -8,-2.4 -2,-0.4 2,-0.2 -0.923 34.7 143.2-107.7 136.5 11.7 -1.9 17.2 38 54 A T E - M 0 91C 0 53,-2.7 53,-2.5 -2,-0.4 2,-0.4 -0.787 52.8 -64.3-149.1-170.7 13.3 -5.3 17.4 39 55 A A > - 0 0 0 -12,-0.4 3,-1.2 51,-0.3 4,-0.4 -0.739 34.8-137.8 -89.2 138.1 14.7 -8.1 15.2 40 56 A A G > S+ 0 0 1 -2,-0.4 3,-1.6 1,-0.3 -1,-0.1 0.853 102.4 64.7 -65.3 -32.2 12.3 -9.8 12.9 41 57 A H G 3 S+ 0 0 41 1,-0.3 3,-0.4 2,-0.2 -1,-0.3 0.709 97.2 59.3 -63.7 -18.3 13.8 -13.2 13.7 42 58 A a G < S+ 0 0 13 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.706 111.8 35.9 -75.3 -22.4 12.5 -12.6 17.3 43 59 A V < + 0 0 8 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 -0.064 62.6 126.8-136.2 32.8 8.9 -12.3 16.3 44 60 A E S S+ 0 0 119 -3,-0.4 2,-0.3 -4,-0.1 -1,-0.1 0.709 86.3 42.7 -58.5 -23.6 8.2 -14.7 13.5 45 60AA T - 0 0 84 -3,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.918 66.2-167.5-124.6 160.3 5.4 -15.8 15.9 46 61 A G > + 0 0 41 -2,-0.3 3,-1.5 2,-0.0 24,-0.2 0.359 27.0 147.4-127.0 2.5 3.1 -13.7 18.1 47 62 A V T 3 S- 0 0 95 1,-0.3 -26,-0.2 -27,-0.0 -2,-0.1 -0.255 89.8 -37.6 -60.1 131.8 1.4 -15.9 20.6 48 63 A K T 3 S+ 0 0 171 1,-0.1 2,-0.4 -28,-0.1 -1,-0.3 0.671 81.7 177.9 1.7 68.2 0.9 -13.6 23.6 49 64 A I < - 0 0 8 -3,-1.5 21,-1.4 21,-0.2 2,-0.4 -0.715 10.9-161.6 -75.9 135.7 4.2 -11.9 23.2 50 65 A T E -KN 19 69C 33 -31,-3.0 -31,-2.9 -2,-0.4 2,-0.4 -0.934 9.6-145.9-120.7 144.8 4.5 -9.3 25.9 51 66 A V E -KN 18 68C 0 17,-2.6 17,-2.6 -2,-0.4 2,-0.5 -0.932 7.3-161.9-107.3 133.1 6.8 -6.3 26.1 52 67 A V E -KN 17 67C 1 -35,-2.6 -35,-2.0 -2,-0.4 3,-0.3 -0.969 8.3-174.6-117.8 116.7 8.2 -5.0 29.4 53 68 A A E +KN 16 66C 0 13,-2.8 13,-2.8 -2,-0.5 -37,-0.1 -0.659 68.5 36.2 -95.0 162.7 9.5 -1.4 29.5 54 69 A G S S+ 0 0 5 -39,-0.6 10,-0.3 50,-0.5 2,-0.3 0.743 83.1 150.7 65.1 24.6 11.2 -0.0 32.6 55 70 A E + 0 0 26 -40,-0.4 -1,-0.2 -3,-0.3 -45,-0.2 -0.635 14.4 151.1 -90.1 148.8 12.8 -3.3 33.4 56 71 A H S S+ 0 0 31 -2,-0.3 87,-2.1 1,-0.2 2,-0.6 0.498 71.0 27.6-137.3 -65.4 16.1 -3.6 35.3 57 72 A N B > -P 142 0D 17 85,-0.2 3,-1.3 3,-0.1 85,-0.2 -0.948 65.6-154.8-112.8 117.6 16.2 -6.9 37.3 58 73 A I T 3 S+ 0 0 56 83,-2.8 84,-0.1 -2,-0.6 -1,-0.1 0.627 92.1 47.2 -67.6 -19.0 14.1 -9.7 35.8 59 74 A E T 3 S+ 0 0 133 82,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.456 110.5 58.1-102.5 -2.7 13.6 -11.6 39.1 60 75 A E S < S- 0 0 115 -3,-1.3 2,-0.5 81,-0.2 -4,-0.2 -0.755 78.8-117.0-123.2 169.2 12.7 -8.5 41.2 61 76 A T + 0 0 100 -2,-0.2 -3,-0.1 1,-0.1 -6,-0.0 -0.935 26.6 171.7-107.3 125.5 10.1 -5.7 41.2 62 77 A E - 0 0 45 -2,-0.5 -1,-0.1 -8,-0.1 -7,-0.0 0.466 44.2-126.6-105.2 -8.5 11.4 -2.2 40.8 63 78 A H S S+ 0 0 173 1,-0.1 -8,-0.1 0, 0.0 -2,-0.1 0.654 95.1 89.0 57.3 22.9 7.9 -0.6 40.4 64 79 A T + 0 0 25 -10,-0.3 -9,-0.1 40,-0.1 2,-0.1 0.424 57.9 117.2-110.2 -6.8 9.1 1.0 37.2 65 80 A E - 0 0 37 -13,-0.1 2,-0.5 1,-0.0 -11,-0.3 -0.373 43.7-167.8 -74.8 137.2 8.1 -1.9 34.9 66 81 A Q E -N 53 0C 24 -13,-2.8 -13,-2.8 -2,-0.1 2,-0.4 -0.983 7.2-162.4-123.6 112.2 5.4 -1.3 32.3 67 82 A K E +N 52 0C 144 -2,-0.5 2,-0.3 -15,-0.2 -15,-0.2 -0.836 13.7 173.5-100.1 136.3 4.0 -4.5 30.7 68 83 A R E -N 51 0C 42 -17,-2.6 -17,-2.6 -2,-0.4 2,-0.2 -0.972 27.8-123.9-138.7 151.6 2.1 -4.3 27.4 69 84 A N E -N 50 0C 74 -2,-0.3 27,-2.2 -19,-0.2 2,-0.6 -0.623 27.1-122.6 -89.9 152.9 0.6 -6.8 24.9 70 85 A V E +O 95 0C 27 -21,-1.4 25,-0.2 -2,-0.2 -21,-0.2 -0.878 29.4 174.8 -97.0 124.8 1.6 -6.7 21.3 71 86 A I E + 0 0 97 23,-3.0 2,-0.3 -2,-0.6 24,-0.2 0.646 67.4 24.9-102.5 -20.0 -1.3 -6.2 18.9 72 87 A R E -O 94 0C 121 22,-1.1 22,-3.2 2,-0.0 2,-0.4 -0.969 58.9-165.3-149.3 135.2 0.5 -5.9 15.6 73 88 A I E -O 93 0C 49 -2,-0.3 20,-0.2 20,-0.2 -27,-0.0 -0.982 4.6-172.8-121.7 123.7 3.9 -7.1 14.3 74 89 A I E -O 92 0C 26 18,-2.7 18,-2.0 -2,-0.4 2,-0.2 -0.844 4.2-168.2-118.2 98.4 5.4 -5.8 11.2 75 90 A P E -O 91 0C 61 0, 0.0 16,-0.3 0, 0.0 14,-0.1 -0.524 46.4 -84.1 -71.0 147.2 8.5 -7.6 10.0 76 91 A H > - 0 0 15 14,-2.6 3,-1.9 12,-0.3 14,-0.1 -0.256 40.8-120.9 -48.1 134.6 10.4 -5.8 7.3 77 92 A H T 3 S+ 0 0 128 1,-0.3 -1,-0.1 -3,-0.1 11,-0.0 0.783 111.3 48.5 -54.8 -28.6 8.7 -6.8 4.0 78 93 A N T > S+ 0 0 71 10,-0.1 3,-1.6 2,-0.1 -1,-0.3 0.424 81.3 113.7 -93.8 -1.9 12.0 -8.2 2.6 79 94 A Y T < S+ 0 0 21 -3,-1.9 9,-0.1 1,-0.3 10,-0.1 -0.509 87.2 14.9 -66.0 138.8 12.9 -10.3 5.7 80 95 A N T 3 S+ 0 0 87 7,-0.5 -1,-0.3 2,-0.3 3,-0.1 0.679 85.9 122.0 62.6 20.5 12.7 -14.0 4.8 81 95AA A S < S+ 0 0 81 -3,-1.6 2,-0.4 1,-0.2 -2,-0.1 0.644 83.3 37.3 -73.1 -19.9 12.8 -13.1 1.1 82 95BA A S > S- 0 0 39 -4,-0.3 3,-1.2 5,-0.2 4,-0.3 -0.997 106.0-102.9-135.6 126.8 15.9 -15.3 1.1 83 96 A I T 3 S- 0 0 126 -2,-0.4 -2,-0.1 1,-0.2 0, 0.0 -0.223 88.6 -16.1 -60.2 131.2 16.1 -18.4 3.3 84 97 A N T 3 S+ 0 0 132 1,-0.1 -1,-0.2 2,-0.0 0, 0.0 0.639 96.1 118.8 53.8 26.8 18.1 -18.3 6.6 85 98 A K < - 0 0 72 -3,-1.2 80,-0.2 2,-0.1 -1,-0.1 0.689 63.6-143.8 -86.7 -27.7 20.0 -15.1 5.7 86 99 A Y > + 0 0 90 -4,-0.3 3,-1.0 1,-0.2 2,-0.1 0.639 46.1 155.2 60.0 16.9 18.9 -12.8 8.5 87 100 A N T 3 + 0 0 25 1,-0.3 -7,-0.5 -5,-0.2 -1,-0.2 -0.502 66.8 15.9 -69.9 140.3 19.0 -10.0 5.8 88 101 A H T 3 S+ 0 0 31 1,-0.2 2,-2.1 -2,-0.1 -12,-0.3 0.848 83.1 177.8 61.5 39.1 16.6 -7.2 6.7 89 102 A D < + 0 0 0 -3,-1.0 2,-0.3 78,-0.1 -1,-0.2 -0.476 35.2 107.8 -78.3 75.2 16.4 -8.5 10.4 90 103 A I + 0 0 0 -2,-2.1 -14,-2.6 -51,-0.3 2,-0.3 -0.988 38.0 174.0-152.6 146.1 14.1 -5.8 11.8 91 104 A A E -MO 38 75C 0 -53,-2.5 -53,-2.7 -2,-0.3 2,-0.4 -0.984 21.8-133.0-151.7 156.1 10.5 -5.6 12.9 92 105 A L E -MO 37 74C 0 -18,-2.0 -18,-2.7 -2,-0.3 2,-0.5 -0.923 13.5-157.4-115.6 139.5 8.1 -3.3 14.6 93 106 A L E -MO 36 73C 0 -57,-3.1 -57,-2.4 -2,-0.4 2,-0.5 -0.969 5.5-151.5-118.6 127.8 5.7 -4.1 17.4 94 107 A E E -MO 35 72C 38 -22,-3.2 -23,-3.0 -2,-0.5 -22,-1.1 -0.826 18.7-137.7 -98.7 131.8 2.5 -2.1 18.1 95 108 A L E - 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