==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-AUG-06 2J34 . COMPND 2 MOLECULE: ACTIVATED FACTOR XA HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.SENGER,M.A.CONVERY,C.CHAN,N.S.WATSON . 286 2 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14589.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 167 58.4 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 . 85 29.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 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 . 15 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 5.9 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 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 2 4 3 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 1 0, 0.0 2,-0.5 0, 0.0 179,-0.2 0.000 360.0 360.0 360.0 124.3 10.8 14.2 32.4 2 17 A V B -A 179 0A 7 177,-3.4 177,-1.3 142,-0.0 2,-0.2 -0.856 360.0 -18.4 -93.0 122.6 8.7 12.3 35.0 3 18 A G S S+ 0 0 28 -2,-0.5 175,-0.1 130,-0.4 142,-0.1 -0.549 93.5 102.0 81.7-149.1 10.1 12.9 38.4 4 19 A G S S- 0 0 25 -2,-0.2 2,-0.3 143,-0.1 142,-0.2 -0.206 71.3 -76.3 66.7-154.4 13.6 14.1 38.8 5 20 A Q E -B 145 0B 147 140,-2.9 140,-2.9 3,-0.0 2,-0.2 -0.899 40.3 -88.8-141.2 163.2 14.5 17.7 39.6 6 21 A E E -B 144 0B 71 -2,-0.3 2,-0.6 138,-0.2 138,-0.3 -0.518 46.2-111.9 -68.1 140.7 14.7 21.2 38.0 7 22 A a - 0 0 2 136,-2.4 136,-0.2 -2,-0.2 3,-0.1 -0.687 37.9-142.0 -70.7 123.2 18.1 22.0 36.4 8 23 A K > - 0 0 113 -2,-0.6 3,-2.6 1,-0.2 4,-0.4 -0.320 43.6 -54.6 -79.2 168.8 19.5 24.8 38.6 9 24 A D T 3 S- 0 0 87 1,-0.3 -1,-0.2 2,-0.1 94,-0.0 -0.143 125.8 -1.3 -51.8 122.0 21.5 27.7 37.2 10 25 A G T 3 S+ 0 0 1 -3,-0.1 275,-1.6 2,-0.1 -1,-0.3 0.400 101.3 110.6 81.0 -0.6 24.4 26.4 35.1 11 26 A E S < S+ 0 0 65 -3,-2.6 -2,-0.1 1,-0.2 3,-0.1 0.702 83.3 28.5 -81.3 -25.6 23.7 22.7 35.7 12 27 A a > + 0 0 10 -4,-0.4 3,-1.5 1,-0.1 -1,-0.2 -0.419 69.5 151.3-131.6 57.3 22.5 21.6 32.2 13 28 A P T 3 + 0 0 1 0, 0.0 92,-1.8 0, 0.0 42,-0.2 0.627 65.1 63.3 -72.9 -14.4 24.3 23.9 29.8 14 29 A W T 3 S+ 0 0 5 90,-0.2 17,-2.4 92,-0.1 2,-0.3 0.341 75.4 120.0 -86.9 1.2 24.5 21.5 26.8 15 30 A Q E < -J 30 0C 11 -3,-1.5 40,-0.5 15,-0.2 2,-0.3 -0.520 39.2-177.0 -71.3 131.6 20.7 21.3 26.5 16 31 A A E -JK 29 54C 0 13,-2.1 13,-1.5 -2,-0.3 2,-0.4 -0.892 11.6-151.4-120.1 158.1 19.2 22.5 23.1 17 32 A L E -JK 28 53C 10 36,-1.8 36,-2.8 -2,-0.3 2,-0.5 -0.999 10.0-139.5-130.9 127.1 15.5 22.7 22.3 18 33 A L E -JK 27 52C 0 9,-3.0 8,-2.0 -2,-0.4 9,-0.9 -0.789 26.7-164.9 -88.7 127.7 14.0 22.3 18.7 19 34 A I E -JK 25 51C 2 32,-2.3 32,-1.9 -2,-0.5 6,-0.2 -0.916 7.3-139.2-118.7 141.0 11.2 24.9 18.3 20 35 A N > - 0 0 48 4,-2.5 3,-2.5 -2,-0.4 30,-0.1 -0.170 43.4 -79.1 -87.1-177.1 8.5 25.0 15.6 21 36 A E T 3 S+ 0 0 141 28,-0.4 29,-0.1 1,-0.3 -1,-0.0 0.757 131.7 53.1 -53.1 -30.2 7.0 27.9 13.6 22 37 A E T 3 S- 0 0 168 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.193 120.5-108.0 -91.5 15.6 4.9 28.8 16.7 23 38 A N S < S+ 0 0 110 -3,-2.5 2,-0.4 1,-0.2 -2,-0.1 0.821 75.5 138.5 58.9 35.5 7.9 28.9 19.0 24 39 A E - 0 0 109 -4,-0.1 -4,-2.5 2,-0.0 -1,-0.2 -0.933 54.3-120.2-112.3 133.0 6.9 25.7 20.7 25 40 A G E +J 19 0C 10 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.388 35.5 163.2 -65.5 140.6 9.4 22.9 21.6 26 41 A F E + 0 0 22 -8,-2.0 2,-0.3 1,-0.4 157,-0.2 0.393 65.9 5.5-132.9 -7.7 8.8 19.4 20.1 27 42 A b E -J 18 0C 0 -9,-0.9 -9,-3.0 157,-0.1 -1,-0.4 -0.976 66.1-121.5-167.0 165.2 12.2 17.7 20.7 28 43 A G E -J 17 0C 2 157,-3.2 12,-0.4 -2,-0.3 2,-0.3 -0.455 19.6-171.9-107.5-177.3 15.6 18.2 22.4 29 44 A G E -J 16 0C 0 -13,-1.5 -13,-2.1 -2,-0.2 2,-0.4 -0.952 20.9-119.4-161.3 171.0 19.3 18.2 21.3 30 45 A T E -JL 15 38C 0 8,-2.1 8,-2.9 -2,-0.3 2,-0.5 -0.991 24.0-125.8-124.2 129.3 22.8 18.3 22.7 31 46 A I E + L 0 37C 0 -17,-2.4 76,-2.1 -2,-0.4 6,-0.2 -0.610 32.1 170.8 -71.1 120.0 25.4 21.0 22.0 32 47 A L - 0 0 15 4,-2.7 2,-0.3 -2,-0.5 5,-0.2 0.681 63.8 -26.0-101.5 -26.3 28.5 19.3 20.7 33 48 A S S S- 0 0 34 3,-1.3 -1,-0.4 72,-0.1 3,-0.2 -0.939 83.2 -70.2-172.3-178.4 30.5 22.5 19.6 34 49 A E S S+ 0 0 100 -2,-0.3 64,-2.5 1,-0.2 62,-0.0 0.791 132.2 28.6 -64.8 -25.2 29.9 26.1 18.4 35 50 A F S S+ 0 0 50 62,-0.2 59,-2.3 1,-0.1 2,-0.4 0.554 110.3 76.3-107.8 -12.3 28.4 24.9 15.1 36 51 A Y E - M 0 93C 8 57,-0.2 -4,-2.7 -3,-0.2 -3,-1.3 -0.899 45.0-175.5-123.3 138.6 26.9 21.5 15.8 37 52 A I E -LM 31 92C 0 55,-1.9 55,-2.5 -2,-0.4 2,-0.4 -0.957 17.3-145.0-116.8 132.7 23.8 20.0 17.6 38 53 A L E +LM 30 91C 0 -8,-2.9 -8,-2.1 -2,-0.4 2,-0.2 -0.824 34.8 147.1 -94.0 134.9 23.2 16.2 18.1 39 54 A T E - M 0 90C 0 51,-2.7 51,-2.2 -2,-0.4 2,-0.4 -0.847 48.0 -75.2-151.1-175.6 19.5 15.0 17.9 40 55 A A > - 0 0 0 -12,-0.4 3,-1.2 49,-0.2 4,-0.4 -0.785 28.5-137.4 -92.7 136.9 17.3 12.0 16.9 41 56 A A G > S+ 0 0 0 -2,-0.4 3,-1.4 1,-0.2 4,-0.3 0.858 103.9 60.9 -54.1 -41.3 16.6 11.3 13.3 42 57 A H G > S+ 0 0 11 1,-0.3 3,-1.2 2,-0.2 -1,-0.2 0.744 91.2 69.0 -64.1 -21.2 12.9 10.7 14.0 43 58 A b G X S+ 0 0 0 -3,-1.2 3,-1.5 1,-0.2 -1,-0.3 0.746 85.4 69.8 -66.8 -24.7 12.5 14.3 15.3 44 59 A L G < S+ 0 0 26 -3,-1.4 3,-0.5 -4,-0.4 -1,-0.2 0.648 91.1 58.3 -70.0 -19.0 13.0 15.7 11.8 45 60 A Y G < S+ 0 0 115 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.1 0.277 90.8 77.0 -92.6 11.8 9.6 14.3 10.6 46 61 A Q S < S+ 0 0 94 -3,-1.5 2,-0.2 1,-0.2 -1,-0.2 0.264 100.7 18.2-107.7 10.8 7.8 16.4 13.3 47 61AA A - 0 0 28 -3,-0.5 -1,-0.2 1,-0.1 3,-0.2 -0.833 58.7-138.4-176.7 139.0 7.9 19.9 11.8 48 62 A K S S+ 0 0 210 1,-0.3 2,-0.4 -2,-0.2 -1,-0.1 0.932 94.9 17.0 -69.2 -49.5 8.4 21.5 8.3 49 63 A R S S+ 0 0 194 2,-0.0 -28,-0.4 0, 0.0 2,-0.3 -0.991 75.9 165.8-130.7 128.8 10.6 24.4 9.5 50 64 A F - 0 0 35 -2,-0.4 21,-0.5 -3,-0.2 2,-0.2 -0.934 18.7-158.3-139.4 161.6 12.4 24.6 12.8 51 65 A K E -K 19 0C 89 -32,-1.9 -32,-2.3 -2,-0.3 2,-0.4 -0.756 24.6-114.9-126.0 174.3 15.1 26.5 14.7 52 66 A V E -KN 18 69C 0 17,-2.6 17,-2.8 -2,-0.2 2,-0.4 -0.966 21.1-160.6-120.5 130.6 17.3 25.7 17.7 53 67 A R E +KN 17 68C 40 -36,-2.8 -36,-1.8 -2,-0.4 2,-0.3 -0.913 12.1 177.1-112.0 134.6 17.2 27.5 21.1 54 68 A V E +KN 16 67C 3 13,-2.6 13,-2.1 -2,-0.4 -38,-0.1 -0.852 55.2 39.0-127.6 164.1 19.9 27.4 23.7 55 69 A G S S+ 0 0 3 48,-0.6 2,-0.4 -40,-0.5 10,-0.4 0.678 80.8 128.6 73.7 22.8 20.5 29.0 27.2 56 70 A D + 0 0 17 -41,-0.2 -1,-0.2 -3,-0.1 3,-0.1 -0.914 22.5 157.7-117.2 134.0 16.9 28.6 28.4 57 71 A R S S+ 0 0 56 -2,-0.4 86,-2.4 1,-0.3 2,-0.4 0.514 76.5 38.0-122.3 -18.7 15.7 27.1 31.7 58 72 A N B > -P 142 0D 6 3,-0.2 3,-1.2 84,-0.2 -1,-0.3 -0.928 61.7-162.0-138.8 108.0 12.2 28.7 32.1 59 73 A T T 3 S+ 0 0 58 82,-2.4 83,-0.1 -2,-0.4 -1,-0.1 0.541 87.2 60.2 -70.5 -5.9 10.1 29.3 28.9 60 74 A E T 3 S+ 0 0 138 81,-0.4 2,-0.3 2,-0.0 -1,-0.2 0.492 106.3 40.2 -97.6 -7.8 7.8 31.9 30.6 61 75 A Q S < S- 0 0 125 -3,-1.2 2,-0.6 0, 0.0 -3,-0.2 -0.928 79.4-113.5-138.3 160.0 10.5 34.5 31.5 62 76 A E + 0 0 186 -2,-0.3 -3,-0.1 1,-0.1 -6,-0.1 -0.894 28.6 175.9 -99.4 120.4 13.6 36.1 30.0 63 77 A E - 0 0 71 -2,-0.6 -1,-0.1 -8,-0.1 -7,-0.1 0.654 47.1-113.3 -97.2 -22.0 16.7 35.1 32.0 64 78 A G S S+ 0 0 58 -9,-0.0 -8,-0.1 0, 0.0 -2,-0.1 0.220 99.0 78.0 108.4 -12.5 19.3 36.8 29.8 65 79 A G + 0 0 7 -10,-0.4 -9,-0.1 36,-0.0 -11,-0.1 0.476 61.1 123.9-105.1 -5.2 21.2 33.9 28.3 66 80 A E + 0 0 54 -11,-0.1 2,-0.3 -13,-0.1 -11,-0.2 -0.235 32.0 176.0 -61.8 138.6 18.7 32.7 25.6 67 81 A A E -N 54 0C 36 -13,-2.1 -13,-2.6 2,-0.0 2,-0.4 -0.956 17.6-152.4-146.6 130.8 19.8 32.5 21.9 68 82 A V E -N 53 0C 77 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.858 16.5-167.4 -99.2 135.9 17.9 31.3 18.8 69 83 A H E -N 52 0C 14 -17,-2.8 -17,-2.6 -2,-0.4 2,-0.2 -0.984 15.3-132.7-129.4 134.7 19.9 29.8 15.9 70 84 A E - 0 0 89 -2,-0.4 25,-2.9 -19,-0.2 2,-0.5 -0.556 25.7-119.6 -80.8 147.4 18.9 28.9 12.3 71 85 A V E -O 94 0C 29 -21,-0.5 23,-0.3 23,-0.3 3,-0.1 -0.785 25.1-178.7 -92.9 124.6 19.9 25.6 10.8 72 86 A E E S+ 0 0 107 21,-2.6 2,-0.3 -2,-0.5 22,-0.2 0.889 71.4 10.0 -84.1 -44.8 22.2 25.6 7.6 73 87 A V E -O 93 0C 61 20,-1.6 20,-2.5 2,-0.0 2,-0.5 -0.995 58.8-149.0-142.1 140.5 22.3 21.8 7.0 74 88 A V E -O 92 0C 71 -2,-0.3 2,-0.6 18,-0.2 18,-0.2 -0.959 11.9-167.2-108.0 125.6 20.6 18.6 8.3 75 89 A I E -O 91 0C 35 16,-2.8 16,-2.6 -2,-0.5 2,-0.3 -0.907 12.4-179.7-115.3 99.9 22.7 15.4 8.4 76 90 A K E -O 90 0C 71 -2,-0.6 14,-0.2 14,-0.2 2,-0.2 -0.768 37.3-102.6-101.0 143.6 20.5 12.4 9.0 77 91 A H > - 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