==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BLOOD CLOTTING 15-APR-10 2XC0 . COMPND 2 MOLECULE: ACTIVATED FACTOR XA HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.W.BANNER,J.BENZ,D.SCHLATTER,L.ANSELM,W.HAAP . 278 3 8 6 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13725.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 61.5 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 . 81 29.1 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 . 3 1.1 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 . 17 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 2 1 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 . 5 4 1 5 2 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 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 0.000 360.0 360.0 360.0 125.6 20.1 71.1 6.7 2 17 A V B -A 179 0A 7 177,-3.4 177,-1.6 142,-0.0 2,-0.1 -0.873 360.0 -17.6 -93.6 126.7 18.1 72.7 9.6 3 18 A G S S+ 0 0 27 -2,-0.5 175,-0.1 130,-0.5 142,-0.1 -0.489 97.0 103.5 73.5-146.4 20.5 73.9 12.3 4 19 A G S S- 0 0 24 -2,-0.1 2,-0.3 143,-0.1 142,-0.2 -0.224 71.2 -90.2 65.3-162.1 24.0 72.4 12.0 5 20 A Q E -B 145 0B 134 140,-2.0 140,-3.1 3,-0.0 3,-0.1 -0.956 38.4 -84.9-144.8 155.3 27.0 74.4 10.6 6 21 A E E -B 144 0B 105 -2,-0.3 138,-0.3 138,-0.3 2,-0.2 -0.371 55.2-105.7 -55.8 138.6 28.7 75.0 7.2 7 22 A a - 0 0 2 136,-2.7 136,-0.1 50,-0.1 2,-0.1 -0.542 33.8-124.6 -66.8 138.0 31.2 72.2 6.4 8 23 A K > - 0 0 133 -2,-0.2 3,-2.5 1,-0.2 4,-0.5 -0.421 47.8 -68.5 -75.7 159.0 34.8 73.3 6.8 9 24 A D T 3 S+ 0 0 74 1,-0.3 -1,-0.2 2,-0.1 94,-0.0 -0.259 122.3 3.5 -51.1 124.8 37.1 72.9 3.9 10 25 A G T 3 S+ 0 0 1 -3,-0.1 268,-2.1 2,-0.1 -1,-0.3 0.474 99.9 108.7 76.9 4.9 37.8 69.2 3.3 11 26 A E S < S+ 0 0 47 -3,-2.5 -2,-0.1 1,-0.2 3,-0.1 0.718 85.8 31.3 -86.3 -23.4 35.4 68.0 6.0 12 27 A a S > S+ 0 0 6 -4,-0.5 3,-1.7 1,-0.1 -1,-0.2 -0.404 70.7 148.9-128.8 54.7 32.6 66.6 3.7 13 28 A P T 3 + 0 0 0 0, 0.0 92,-1.6 0, 0.0 42,-0.2 0.667 67.2 61.7 -72.4 -17.4 34.6 65.4 0.7 14 29 A W T 3 S+ 0 0 5 90,-0.2 17,-2.9 92,-0.1 93,-0.2 0.446 77.2 118.7 -83.8 -4.6 32.2 62.6 -0.1 15 30 A Q E < -J 30 0C 8 -3,-1.7 40,-0.6 15,-0.2 2,-0.3 -0.449 40.7-177.3 -62.9 128.9 29.3 65.0 -0.7 16 31 A A E -JK 29 54C 1 13,-2.5 13,-1.3 -2,-0.2 2,-0.4 -0.920 13.4-147.7-121.3 154.4 27.9 65.0 -4.3 17 32 A L E -JK 28 53C 3 36,-2.5 36,-3.3 -2,-0.3 2,-0.5 -0.991 5.8-144.7-123.7 127.2 25.2 67.2 -5.6 18 33 A L E -JK 27 52C 0 9,-2.8 8,-2.1 -2,-0.4 9,-1.0 -0.772 21.8-162.0 -86.3 129.8 22.7 66.2 -8.2 19 34 A I E -JK 25 51C 6 32,-3.1 32,-2.2 -2,-0.5 6,-0.2 -0.951 4.7-143.4-119.9 136.6 21.8 69.1 -10.5 20 35 A N > - 0 0 34 4,-2.9 3,-1.8 -2,-0.4 30,-0.2 -0.131 40.8 -83.8 -86.6-175.0 18.8 69.4 -12.7 21 36 A E T 3 S+ 0 0 129 28,-0.5 29,-0.1 1,-0.3 -1,-0.1 0.820 128.7 61.2 -59.5 -34.7 18.5 71.1 -16.2 22 37 A E T 3 S- 0 0 153 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.305 119.0-113.8 -73.8 9.3 18.0 74.5 -14.6 23 38 A N S < S+ 0 0 119 -3,-1.8 2,-0.4 1,-0.2 -2,-0.2 0.653 74.6 137.0 63.1 20.1 21.5 73.9 -13.1 24 39 A E - 0 0 100 1,-0.0 -4,-2.9 2,-0.0 2,-0.3 -0.803 58.8-120.1-103.9 135.2 19.9 73.8 -9.6 25 40 A G E +J 19 0C 13 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.542 38.2 163.0 -70.4 131.6 20.8 71.2 -6.9 26 41 A F E + 0 0 20 -8,-2.1 157,-0.3 1,-0.4 2,-0.3 0.513 60.5 14.3-126.7 -15.3 17.8 69.1 -6.0 27 42 A b E -J 18 0C 0 -9,-1.0 -9,-2.8 157,-0.1 -1,-0.4 -0.976 66.8-123.2-156.3 158.9 19.3 66.1 -4.2 28 43 A G E -J 17 0C 0 157,-3.1 12,-0.4 -2,-0.3 2,-0.3 -0.396 20.8-171.7 -96.9-178.1 22.6 64.9 -2.6 29 44 A G E -J 16 0C 0 -13,-1.3 -13,-2.5 -2,-0.1 2,-0.5 -0.945 20.3-122.9-164.9 163.1 24.8 61.8 -3.2 30 45 A T E -JL 15 38C 0 8,-2.5 8,-3.2 -2,-0.3 2,-0.5 -0.985 23.4-125.8-120.4 127.7 27.8 60.1 -1.6 31 46 A I E + L 0 37C 0 -17,-2.9 76,-2.4 -2,-0.5 6,-0.2 -0.610 33.8 168.7 -68.5 121.5 31.0 59.5 -3.5 32 47 A L - 0 0 11 4,-2.7 2,-0.3 -2,-0.5 5,-0.2 0.706 64.3 -21.3-104.0 -33.9 31.7 55.8 -3.3 33 48 A S S S- 0 0 7 3,-1.5 -1,-0.4 72,-0.1 3,-0.2 -0.908 82.2 -76.3-159.0-175.7 34.5 55.4 -5.9 34 49 A E S S+ 0 0 91 -2,-0.3 64,-2.6 1,-0.2 62,-0.1 0.819 132.3 30.3 -64.3 -26.2 35.9 57.3 -8.9 35 50 A F S S+ 0 0 45 62,-0.2 59,-2.8 1,-0.1 2,-0.4 0.553 110.4 74.4-106.8 -9.7 33.0 55.9 -11.0 36 51 A Y E - M 0 93C 9 57,-0.2 -4,-2.7 -3,-0.2 -3,-1.5 -0.921 45.6-174.8-125.7 134.0 30.1 55.5 -8.4 37 52 A I E -LM 31 92C 0 55,-2.2 55,-3.0 -2,-0.4 2,-0.5 -0.955 17.5-145.3-115.3 136.1 27.7 57.8 -6.6 38 53 A L E +LM 30 91C 0 -8,-3.2 -8,-2.5 -2,-0.4 2,-0.2 -0.871 34.5 148.9-100.6 129.6 25.3 56.5 -4.0 39 54 A T E - M 0 90C 0 51,-2.7 51,-2.5 -2,-0.5 2,-0.4 -0.784 47.5 -78.8-144.4-171.9 21.9 58.3 -3.8 40 55 A A > - 0 0 0 -12,-0.4 3,-0.9 49,-0.3 4,-0.4 -0.781 28.9-134.0 -96.0 140.4 18.2 57.8 -3.0 41 56 A A G > S+ 0 0 0 -2,-0.4 3,-1.5 1,-0.2 4,-0.4 0.860 104.9 61.3 -54.4 -38.4 15.9 56.0 -5.5 42 57 A H G >> S+ 0 0 9 1,-0.3 3,-0.9 2,-0.2 4,-0.5 0.759 92.4 66.8 -67.3 -21.4 13.2 58.7 -5.0 43 58 A b G X4 S+ 0 0 0 -3,-0.9 3,-0.6 1,-0.2 4,-0.4 0.762 87.6 67.8 -65.2 -26.4 15.6 61.4 -6.2 44 59 A L G <4 S+ 0 0 28 -3,-1.5 3,-0.3 -4,-0.4 -1,-0.2 0.714 96.5 54.5 -69.2 -21.1 15.6 59.9 -9.7 45 60 A Y G <4 S+ 0 0 110 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.2 0.755 94.1 69.5 -81.9 -26.0 11.9 60.9 -10.2 46 61 A Q S << S+ 0 0 92 -3,-0.6 2,-0.3 -4,-0.5 -1,-0.2 0.610 106.3 30.2 -75.7 -17.6 12.5 64.6 -9.4 47 61AA A - 0 0 10 -4,-0.4 -1,-0.2 -3,-0.3 3,-0.1 -0.937 61.2-152.8-146.4 121.8 14.4 65.5 -12.5 48 62 A K S S+ 0 0 206 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.856 93.5 23.1 -60.0 -35.7 14.1 63.8 -16.0 49 63 A R S S+ 0 0 175 -3,-0.1 -28,-0.5 2,-0.0 2,-0.3 -0.998 77.6 160.7-133.4 135.5 17.7 64.7 -16.6 50 64 A F - 0 0 30 -2,-0.4 21,-0.5 -30,-0.2 2,-0.3 -0.988 21.1-153.0-149.5 162.0 20.5 65.4 -14.1 51 65 A K E -KN 19 70C 82 -32,-2.2 -32,-3.1 -2,-0.3 2,-0.5 -0.802 23.3-117.0-124.5 170.2 24.2 65.7 -13.6 52 66 A V E -KN 18 69C 0 17,-2.4 17,-3.0 -2,-0.3 2,-0.5 -0.935 20.6-164.1-111.4 126.9 26.5 65.2 -10.6 53 67 A R E -KN 17 68C 33 -36,-3.3 -36,-2.5 -2,-0.5 2,-0.3 -0.946 9.8-174.0-107.9 134.2 28.7 68.0 -9.2 54 68 A V E +KN 16 67C 0 13,-2.5 13,-1.9 -2,-0.5 -38,-0.1 -0.844 60.8 31.2-118.7 159.7 31.5 67.2 -6.9 55 69 A G S S+ 0 0 9 -40,-0.6 2,-0.3 48,-0.6 11,-0.2 0.500 80.4 137.5 77.8 3.6 33.8 69.5 -4.9 56 70 A D + 0 0 9 -41,-0.2 -1,-0.2 1,-0.2 3,-0.1 -0.642 18.8 158.9 -88.5 141.0 31.3 72.2 -4.5 57 71 A R S S+ 0 0 60 -2,-0.3 86,-2.7 1,-0.3 2,-0.4 0.516 75.4 35.8-126.1 -23.0 30.9 74.0 -1.1 58 72 A N B > -P 142 0D 16 3,-0.3 3,-1.0 84,-0.2 -1,-0.3 -0.948 62.4-163.0-137.9 110.7 29.2 77.2 -2.2 59 73 A T T 3 S+ 0 0 54 82,-2.9 83,-0.1 -2,-0.4 -1,-0.1 0.616 89.7 57.4 -74.5 -10.4 26.7 76.9 -5.1 60 74 A E T 3 S+ 0 0 144 81,-0.4 2,-0.4 1,-0.1 -1,-0.2 0.619 106.2 51.8 -90.5 -15.1 26.8 80.7 -5.7 61 75 A Q S < S- 0 0 113 -3,-1.0 2,-0.8 2,-0.0 -3,-0.3 -0.970 76.1-134.0-126.7 135.1 30.5 80.9 -6.3 62 76 A E + 0 0 184 -2,-0.4 2,-0.3 -6,-0.1 -3,-0.1 -0.817 36.9 174.3 -86.9 113.9 32.7 78.8 -8.7 63 77 A E > - 0 0 102 -2,-0.8 3,-1.6 -5,-0.2 -5,-0.0 -0.822 39.1 -77.5-118.4 160.2 35.7 77.8 -6.7 64 78 A G T 3 S+ 0 0 77 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 -0.203 111.7 35.3 -54.9 142.2 38.6 75.5 -7.5 65 79 A G T 3 S+ 0 0 28 1,-0.4 -1,-0.2 -3,-0.0 2,-0.2 0.137 79.5 129.2 98.8 -18.9 37.9 71.8 -7.4 66 80 A E < + 0 0 48 -3,-1.6 -1,-0.4 -11,-0.2 2,-0.3 -0.498 30.6 170.6 -66.3 137.2 34.3 71.9 -8.6 67 81 A A E -N 54 0C 28 -13,-1.9 -13,-2.5 -2,-0.2 2,-0.4 -0.994 24.8-140.6-151.3 142.4 33.6 69.4 -11.5 68 82 A V E -N 53 0C 85 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.857 17.1-166.7-106.7 139.3 30.5 68.2 -13.3 69 83 A H E -N 52 0C 13 -17,-3.0 -17,-2.4 -2,-0.4 2,-0.2 -0.984 17.2-132.5-127.2 136.0 30.0 64.6 -14.4 70 84 A E E -N 51 0C 96 -2,-0.4 25,-2.7 -19,-0.2 2,-0.5 -0.575 28.3-122.6 -76.1 145.0 27.4 63.1 -16.7 71 85 A V E -O 94 0C 33 -21,-0.5 23,-0.3 23,-0.2 3,-0.1 -0.816 25.3-174.9 -90.2 127.2 25.8 60.0 -15.4 72 86 A E E + 0 0 113 21,-2.4 2,-0.4 -2,-0.5 22,-0.2 0.881 69.3 16.1 -85.5 -42.8 26.2 56.9 -17.7 73 87 A V E -O 93 0C 64 20,-2.0 20,-2.9 2,-0.0 2,-0.6 -0.997 60.2-153.6-138.5 133.9 24.0 54.4 -15.9 74 88 A V E -O 92 0C 71 -2,-0.4 2,-0.6 18,-0.2 18,-0.2 -0.928 9.3-170.6-104.8 121.3 21.3 54.7 -13.3 75 89 A I E -O 91 0C 40 16,-3.0 16,-2.9 -2,-0.6 2,-0.4 -0.907 11.3-179.4-112.3 99.2 20.9 51.6 -11.1 76 90 A K E -O 90 0C 79 -2,-0.6 2,-0.2 14,-0.2 14,-0.2 -0.804 38.8-101.0 -98.5 138.7 17.7 52.1 -9.0 77 91 A H > - 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