==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BLOOD CLOTTING 02-FEB-11 2Y7X . COMPND 2 MOLECULE: ACTIVATED FACTOR XA HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.S.WATSON,C.ADAMS,D.BELTON,D.BROWN,C.L.BURNS-KURTIS,L.CHAUD . 286 2 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13502.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 87 30.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 . 22 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 3 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 . 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 0 PARALLEL BRIDGES PER LADDER . 6 3 1 4 4 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 . 2 0 0 0 0 1 0 1 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 I 0 0 0 0, 0.0 2,-0.5 0, 0.0 179,-0.2 0.000 360.0 360.0 360.0 118.7 10.5 13.8 31.7 2 17 A V B -A 179 0A 11 177,-3.4 177,-1.4 142,-0.0 2,-0.2 -0.783 360.0 -20.7 -88.2 124.2 8.4 11.9 34.2 3 18 A G S S+ 0 0 27 130,-0.5 175,-0.1 -2,-0.5 142,-0.1 -0.491 95.0 102.4 75.9-147.4 9.7 12.5 37.7 4 19 A G S S- 0 0 18 -2,-0.2 2,-0.3 143,-0.1 142,-0.2 -0.241 70.8 -77.1 66.6-155.3 13.3 13.7 38.0 5 20 A Q E -B 145 0B 112 140,-3.0 140,-3.1 3,-0.0 2,-0.1 -0.896 39.9 -86.2-140.6 164.7 14.2 17.3 38.8 6 21 A E E -B 144 0B 69 -2,-0.3 2,-0.6 138,-0.2 138,-0.3 -0.476 45.5-114.1 -66.8 142.7 14.5 20.8 37.2 7 22 A a - 0 0 1 136,-2.8 136,-0.2 50,-0.2 3,-0.1 -0.741 38.8-144.0 -75.3 122.4 17.8 21.5 35.6 8 23 A K > - 0 0 108 -2,-0.6 3,-2.4 1,-0.2 4,-0.5 -0.258 42.8 -50.9 -80.5 175.2 19.2 24.2 37.8 9 24 A D T 3 S- 0 0 90 1,-0.3 -1,-0.2 2,-0.1 93,-0.0 -0.214 126.6 -3.7 -52.1 125.0 21.3 27.1 36.5 10 25 A G T 3 S+ 0 0 1 -3,-0.1 276,-1.8 2,-0.1 -1,-0.3 0.368 102.4 112.6 75.5 -2.8 24.1 25.9 34.3 11 26 A E S < S+ 0 0 59 -3,-2.4 -2,-0.1 1,-0.2 3,-0.1 0.768 83.1 26.4 -76.6 -30.8 23.3 22.2 34.9 12 27 A a S > S+ 0 0 8 -4,-0.5 3,-1.7 1,-0.1 -1,-0.2 -0.409 70.5 151.8-127.7 59.1 22.1 21.0 31.5 13 28 A P T 3 + 0 0 0 0, 0.0 92,-1.6 0, 0.0 42,-0.3 0.692 67.4 61.8 -68.7 -19.0 24.0 23.5 29.1 14 29 A W T 3 S+ 0 0 5 90,-0.2 17,-3.0 92,-0.1 2,-0.3 0.363 76.2 119.6 -84.3 -0.1 24.1 21.0 26.2 15 30 A Q E < -J 30 0C 8 -3,-1.7 40,-0.5 15,-0.2 2,-0.3 -0.517 40.4-175.9 -70.2 131.6 20.3 20.8 25.9 16 31 A A E -JK 29 54C 0 13,-2.4 13,-1.8 -2,-0.3 2,-0.4 -0.914 11.4-150.9-122.2 154.0 18.8 21.9 22.6 17 32 A L E -JK 28 53C 5 36,-2.3 36,-2.9 -2,-0.3 2,-0.6 -0.996 9.7-140.3-127.8 126.7 15.1 22.1 21.8 18 33 A L E -JK 27 52C 0 9,-3.3 8,-2.5 -2,-0.4 9,-1.0 -0.772 26.4-164.4 -86.3 124.2 13.7 21.7 18.3 19 34 A I E -JK 25 51C 1 32,-2.7 32,-2.3 -2,-0.6 6,-0.2 -0.930 8.3-140.9-117.5 135.4 10.9 24.2 17.8 20 35 A N > - 0 0 40 4,-2.4 3,-2.0 -2,-0.4 30,-0.2 -0.047 45.5 -79.1 -76.4-175.1 8.2 24.3 15.2 21 36 A E T 3 S+ 0 0 129 28,-0.4 29,-0.1 1,-0.3 -1,-0.1 0.765 132.0 55.5 -60.1 -27.3 6.8 27.4 13.3 22 37 A E T 3 S- 0 0 148 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.191 119.6-110.6 -90.5 15.8 4.7 28.2 16.4 23 38 A N S < S+ 0 0 104 -3,-2.0 2,-0.4 1,-0.2 -2,-0.1 0.789 72.9 140.5 57.9 33.4 7.8 28.2 18.6 24 39 A E - 0 0 120 -4,-0.0 -4,-2.4 2,-0.0 -1,-0.2 -0.899 55.5-119.0-107.2 132.5 6.7 25.1 20.4 25 40 A G E +J 19 0C 21 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.460 36.9 165.5 -66.3 135.0 9.2 22.4 21.3 26 41 A F E + 0 0 16 -8,-2.5 2,-0.3 1,-0.4 157,-0.3 0.455 66.2 6.4-123.9 -14.5 8.5 19.0 19.7 27 42 A b E -J 18 0C 0 -9,-1.0 -9,-3.3 157,-0.1 -1,-0.4 -0.972 67.4-121.8-158.6 163.8 11.9 17.3 20.3 28 43 A G E -J 17 0C 1 157,-3.3 12,-0.4 -2,-0.3 2,-0.3 -0.447 22.0-173.4 -99.8 177.5 15.2 17.7 22.1 29 44 A G E -J 16 0C 0 -13,-1.8 -13,-2.4 -2,-0.2 2,-0.4 -0.929 21.8-119.9-158.2 171.4 18.8 17.7 20.8 30 45 A T E -JL 15 38C 0 8,-2.1 8,-2.8 -2,-0.3 2,-0.5 -0.993 23.7-125.0-123.0 129.4 22.3 17.8 22.2 31 46 A I E + L 0 37C 0 -17,-3.0 76,-2.2 -2,-0.4 6,-0.2 -0.593 32.5 171.2 -70.7 121.0 24.8 20.6 21.5 32 47 A L - 0 0 14 4,-2.9 2,-0.3 -2,-0.5 5,-0.2 0.655 64.4 -25.3 -99.8 -25.1 27.9 18.9 20.1 33 48 A S S S- 0 0 28 3,-1.3 -1,-0.4 72,-0.1 65,-0.1 -0.955 82.7 -71.2-171.6 178.3 29.8 22.0 19.0 34 49 A E S S+ 0 0 97 -2,-0.3 64,-2.8 1,-0.2 62,-0.1 0.793 132.7 29.4 -58.2 -26.9 29.2 25.6 17.9 35 50 A F S S+ 0 0 48 62,-0.2 59,-2.7 1,-0.1 2,-0.4 0.634 109.7 72.6-108.4 -15.7 27.8 24.3 14.6 36 51 A Y E - M 0 93C 7 57,-0.2 -4,-2.9 -3,-0.1 -3,-1.3 -0.882 45.4-172.8-122.8 140.1 26.3 20.9 15.4 37 52 A I E -LM 31 92C 0 55,-1.9 55,-2.7 -2,-0.4 2,-0.4 -0.967 17.3-144.5-118.8 131.6 23.2 19.4 17.1 38 53 A L E +LM 30 91C 0 -8,-2.8 -8,-2.1 -2,-0.4 2,-0.3 -0.797 35.6 149.4 -91.4 135.4 22.7 15.7 17.7 39 54 A T E - M 0 90C 0 51,-2.7 51,-2.2 -2,-0.4 2,-0.4 -0.908 47.9 -78.0-151.9-178.8 19.0 14.6 17.5 40 55 A A > - 0 0 0 -12,-0.4 3,-1.4 -2,-0.3 4,-0.4 -0.742 27.3-139.0 -88.3 135.1 16.8 11.6 16.6 41 56 A A G > S+ 0 0 0 -2,-0.4 3,-1.7 1,-0.2 -1,-0.1 0.857 103.4 64.0 -56.1 -36.4 16.1 10.9 13.0 42 57 A H G > S+ 0 0 11 1,-0.3 3,-0.9 2,-0.1 -1,-0.2 0.698 91.3 65.6 -64.9 -18.6 12.4 10.2 13.9 43 58 A b G X S+ 0 0 0 -3,-1.4 3,-1.2 1,-0.2 -1,-0.3 0.674 85.0 73.4 -72.3 -20.2 12.1 13.9 15.0 44 59 A L G < S+ 0 0 22 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.1 0.344 93.1 53.1 -80.9 6.2 12.6 15.1 11.4 45 60 A Y G < S+ 0 0 143 -3,-0.9 -1,-0.2 1,-0.1 -2,-0.1 0.352 92.5 74.6-115.1 -0.8 9.1 13.9 10.3 46 61 A Q S < S+ 0 0 96 -3,-1.2 2,-0.3 1,-0.2 -2,-0.1 0.500 103.3 26.5 -92.2 -9.2 7.2 15.8 13.1 47 61AA A - 0 0 20 -4,-0.2 -1,-0.2 1,-0.1 3,-0.1 -0.970 60.9-145.5-155.0 140.1 7.6 19.3 11.7 48 62 A K S S+ 0 0 216 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.921 93.2 14.5 -71.5 -46.8 8.0 20.7 8.2 49 63 A R S S+ 0 0 130 2,-0.0 -28,-0.4 0, 0.0 2,-0.3 -0.994 78.1 165.9-132.3 135.1 10.2 23.6 9.2 50 64 A F - 0 0 27 -2,-0.4 21,-0.5 -30,-0.2 2,-0.3 -0.966 20.3-154.3-147.2 163.5 12.0 24.0 12.5 51 65 A K E -KN 19 70C 57 -32,-2.3 -32,-2.7 -2,-0.3 2,-0.5 -0.770 24.0-115.6-127.8 173.8 14.6 25.9 14.4 52 66 A V E -KN 18 69C 0 17,-2.9 17,-3.2 -2,-0.3 2,-0.4 -0.970 21.0-162.2-118.3 129.8 16.8 25.0 17.3 53 67 A R E +KN 17 68C 34 -36,-2.9 -36,-2.3 -2,-0.5 2,-0.3 -0.936 12.5 175.9-110.6 136.4 16.7 26.8 20.7 54 68 A V E +KN 16 67C 1 13,-2.4 13,-2.1 -2,-0.4 -38,-0.1 -0.803 55.3 41.3-128.1 167.5 19.5 26.7 23.3 55 69 A G S S+ 0 0 2 48,-0.7 2,-0.4 -40,-0.5 10,-0.4 0.753 81.7 128.2 65.9 31.0 20.1 28.3 26.7 56 70 A D + 0 0 14 -41,-0.2 -1,-0.2 47,-0.2 3,-0.1 -0.957 23.4 157.7-123.1 130.6 16.6 28.0 27.8 57 71 A R S S+ 0 0 47 -2,-0.4 86,-2.5 1,-0.3 2,-0.4 0.545 76.8 38.5-120.0 -18.9 15.3 26.4 31.1 58 72 A N B > -P 142 0D 4 3,-0.3 3,-1.4 84,-0.2 -1,-0.3 -0.932 59.3-163.4-138.9 108.0 11.9 28.1 31.4 59 73 A T T 3 S+ 0 0 63 82,-2.5 83,-0.1 -2,-0.4 -1,-0.1 0.526 90.2 59.7 -69.7 -4.6 9.7 28.6 28.2 60 74 A E T 3 S+ 0 0 127 81,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.326 106.3 42.0-103.9 1.7 7.5 31.1 30.2 61 75 A Q S < S- 0 0 126 -3,-1.4 2,-0.6 0, 0.0 -3,-0.3 -0.996 77.6-119.4-148.5 145.1 10.3 33.7 31.1 62 76 A E + 0 0 173 -2,-0.3 -3,-0.1 1,-0.1 -6,-0.1 -0.773 29.5 177.7 -87.4 120.2 13.2 35.3 29.4 63 77 A E - 0 0 62 -2,-0.6 -1,-0.1 -8,-0.2 -7,-0.1 0.589 47.6-108.9 -99.7 -15.5 16.3 34.4 31.4 64 78 A G S S+ 0 0 56 -9,-0.0 -8,-0.1 2,-0.0 -2,-0.1 0.399 102.4 77.0 102.7 0.8 19.0 36.1 29.3 65 79 A G + 0 0 7 -10,-0.4 -9,-0.1 36,-0.1 -11,-0.1 0.549 60.2 121.3-117.5 -9.8 20.6 33.0 27.8 66 80 A E + 0 0 46 -13,-0.1 2,-0.3 -11,-0.1 -11,-0.2 -0.250 32.0 174.6 -62.3 136.0 18.2 32.0 25.1 67 81 A A E -N 54 0C 35 -13,-2.1 -13,-2.4 2,-0.0 2,-0.4 -0.983 18.1-151.4-145.4 132.6 19.3 31.8 21.4 68 82 A V E -N 53 0C 75 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.864 15.4-167.6-103.2 136.3 17.4 30.5 18.4 69 83 A H E -N 52 0C 13 -17,-3.2 -17,-2.9 -2,-0.4 2,-0.2 -0.985 14.7-135.2-128.2 134.9 19.4 29.1 15.5 70 84 A E E -N 51 0C 72 -2,-0.4 25,-2.8 -19,-0.2 26,-0.5 -0.593 26.5-117.4 -82.7 152.0 18.3 28.2 12.0 71 85 A V E -O 94 0C 28 -21,-0.5 23,-0.3 23,-0.3 3,-0.1 -0.813 26.3-178.9 -95.9 126.4 19.3 24.9 10.4 72 86 A E E S+ 0 0 108 21,-2.7 2,-0.4 -2,-0.5 22,-0.2 0.849 72.8 14.0 -87.0 -44.6 21.5 25.0 7.3 73 87 A V E -O 93 0C 51 20,-1.8 20,-2.5 2,-0.0 2,-0.6 -0.998 57.9-151.3-139.7 138.2 21.7 21.2 6.8 74 88 A V E -O 92 0C 68 -2,-0.4 2,-0.7 18,-0.2 18,-0.2 -0.950 13.1-169.4-106.0 120.7 19.8 18.1 8.1 75 89 A I E -O 91 0C 36 16,-3.2 16,-2.9 -2,-0.6 2,-0.3 -0.866 12.0-179.7-112.6 94.6 22.1 15.0 8.1 76 90 A K E -O 90 0C 64 -2,-0.7 2,-0.4 14,-0.2 14,-0.2 -0.665 38.1-102.0 -91.9 145.8 19.8 12.0 8.8 77 91 A H > - 0 0 16 12,-2.2 3,-1.8 -2,-0.3 12,-0.1 -0.571 27.0-143.7 -68.1 125.3 21.2 8.5 9.0 78 92 A N T 3 S+ 0 0 151 -2,-0.4 -1,-0.2 1,-0.3 -2,-0.0 0.701 97.5 58.6 -64.7 -18.5 20.3 6.8 5.6 79 93 A R T 3 S+ 0 0 153 8,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.337 74.8 133.9 -92.6 8.3 19.7 3.5 7.3 80 94 A F < - 0 0 24 -3,-1.8 2,-0.5 7,-0.1 7,-0.2 -0.398 39.6-161.7 -60.2 128.3 17.0 5.0 9.6 81 95 A T B >> -Q 86 0E 57 5,-1.8 4,-2.8 -2,-0.2 5,-0.5 -0.961 13.6-156.7-120.6 120.0 13.9 2.7 9.6 82 96 A K T 45S+ 0 0 158 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.764 90.7 58.4 -64.2 -30.9 10.6 4.1 10.8 83 97 A E T 45S+ 0 0 188 1,-0.2 -1,-0.2 2,-0.0 -2,-0.0 0.939 126.0 15.4 -66.3 -45.2 9.1 0.7 11.7 84 98 A T T 45S- 0 0 40 -3,-0.2 -2,-0.2 2,-0.1 81,-0.2 0.589 91.4-128.5-105.6 -13.8 11.9 -0.2 14.2 85 99 A Y T ><5 + 0 0 60 -4,-2.8 3,-0.8 1,-0.2 -3,-0.2 0.682 50.9 161.7 65.0 19.2 13.6 3.2 14.9 86 100 A D B 3 < +Q 81 0E 20 -5,-0.5 -5,-1.8 1,-0.3 -1,-0.2 -0.424 66.0 20.0 -63.6 148.8 16.8 1.4 14.1 87 101 A F T 3 S+ 0 0 13 -7,-0.2 2,-1.9 1,-0.2 -1,-0.3 0.891 81.8 175.4 53.3 43.6 19.6 4.0 13.2 88 102 A D < + 0 0 1 -3,-0.8 2,-0.3 79,-0.2 -1,-0.2 -0.562 34.1 111.1 -80.8 80.0 17.5 6.7 15.0 89 103 A I + 0 0 0 -2,-1.9 -12,-2.2 -49,-0.2 2,-0.3 -0.996 34.8 168.2-156.5 146.2 20.0 9.5 14.7 90 104 A A E -MO 39 76C 0 -51,-2.2 -51,-2.7 -2,-0.3 2,-0.4 -0.979 19.7-145.1-155.6 151.3 20.6 12.8 12.9 91 105 A V E -MO 38 75C 0 -16,-2.9 -16,-3.2 -2,-0.3 2,-0.5 -0.956 13.2-152.7-120.6 139.6 23.0 15.7 13.0 92 106 A L E -MO 37 74C 0 -55,-2.7 -55,-1.9 -2,-0.4 2,-0.6 -0.952 3.1-152.1-113.2 128.9 22.0 19.3 12.3 93 107 A R E -MO 36 73C 57 -20,-2.5 -21,-2.7 -2,-0.5 -20,-1.8 -0.898 21.3-140.8 -97.5 125.8 24.4 21.9 11.0 94 108 A L E - 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