==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BLOOD CLOTTING 13-JAN-11 2Y5F . COMPND 2 MOLECULE: ACTIVATED FACTOR XA HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.W.BANNER,L.M.SALONEN,M.C.HOLLAND,W.HAAP,J.BENZ,F.DIEDERICH . 287 2 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13691.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 60.6 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 . 83 28.9 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 . 20 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 10.5 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 . 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 . 4 4 2 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 . 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 0.000 360.0 360.0 360.0 122.6 2.5 11.8 34.0 2 17 A V B -A 179 0A 13 177,-3.2 177,-1.5 142,-0.0 2,-0.2 -0.850 360.0 -16.7 -94.9 125.1 -0.7 12.4 36.0 3 18 A G S S+ 0 0 29 -2,-0.5 175,-0.1 130,-0.5 142,-0.1 -0.518 96.0 100.0 73.5-146.7 -0.1 11.4 39.7 4 19 A G S S- 0 0 34 -2,-0.2 2,-0.3 143,-0.1 142,-0.2 -0.308 73.1 -83.4 66.3-153.0 3.0 9.2 40.4 5 20 A Q E -B 145 0B 110 140,-2.4 140,-2.9 3,-0.0 2,-0.2 -0.962 38.7 -83.6-147.3 160.9 6.2 10.8 41.7 6 21 A E E -B 144 0B 104 -2,-0.3 138,-0.3 138,-0.2 2,-0.2 -0.487 54.4-107.8 -64.5 135.6 9.3 12.7 40.6 7 22 A a - 0 0 2 136,-2.7 2,-0.1 -2,-0.2 136,-0.1 -0.506 34.8-127.0 -62.7 135.3 12.0 10.2 39.5 8 23 A K > - 0 0 132 -2,-0.2 3,-2.5 1,-0.2 4,-0.4 -0.452 42.6 -71.4 -81.2 160.0 14.8 10.1 42.0 9 24 A D T 3 S+ 0 0 54 1,-0.3 -1,-0.2 -2,-0.1 48,-0.0 -0.252 120.6 5.0 -56.2 128.9 18.4 10.6 41.0 10 25 A G T 3 S+ 0 0 0 -3,-0.1 274,-2.1 2,-0.1 -1,-0.3 0.350 102.9 104.3 82.0 -4.5 19.6 7.6 38.9 11 26 A E S < S+ 0 0 57 -3,-2.5 -2,-0.1 1,-0.2 3,-0.1 0.645 84.1 32.9 -91.9 -14.0 16.2 5.9 38.9 12 27 A a > + 0 0 9 -4,-0.4 3,-1.7 1,-0.1 -1,-0.2 -0.372 69.7 147.1-129.5 52.5 15.1 6.6 35.3 13 28 A P T 3 + 0 0 0 0, 0.0 92,-1.6 0, 0.0 42,-0.2 0.649 65.9 61.7 -75.5 -11.9 18.4 6.6 33.4 14 29 A W T 3 S+ 0 0 5 90,-0.2 17,-2.5 92,-0.1 2,-0.2 0.418 76.7 118.8 -88.1 -2.3 16.9 5.1 30.2 15 30 A Q E < -J 30 0C 8 -3,-1.7 40,-0.6 15,-0.2 2,-0.3 -0.502 40.7-176.4 -67.0 132.4 14.6 8.1 29.7 16 31 A A E -JK 29 54C 0 13,-2.4 13,-1.7 -2,-0.2 2,-0.4 -0.891 12.5-148.9-121.0 156.5 15.1 10.1 26.5 17 32 A L E -JK 28 53C 6 36,-2.3 36,-3.0 -2,-0.3 2,-0.5 -0.994 8.2-141.9-128.1 125.4 13.3 13.3 25.5 18 33 A L E -JK 27 52C 0 9,-2.9 8,-2.2 -2,-0.4 9,-0.9 -0.785 22.0-159.1 -84.4 128.9 12.6 14.3 21.9 19 34 A I E -JK 25 51C 2 32,-2.5 32,-2.2 -2,-0.5 6,-0.2 -0.918 2.1-150.9-118.1 130.0 13.0 18.0 21.5 20 35 A N > - 0 0 43 4,-2.6 2,-2.6 -2,-0.4 3,-2.4 -0.068 52.5 -51.9 -89.0-169.0 11.4 20.1 18.7 21 36 A E T 3 S+ 0 0 140 28,-0.4 -1,-0.1 1,-0.3 29,-0.1 -0.363 136.5 39.7 -70.3 72.4 12.5 23.3 16.9 22 37 A E T 3 S- 0 0 122 -2,-2.6 -1,-0.3 2,-0.1 3,-0.1 0.213 117.7 -97.3 164.6 -8.9 12.9 25.2 20.3 23 38 A N S < S+ 0 0 104 -3,-2.4 2,-0.5 1,-0.3 -2,-0.1 0.840 81.1 141.1 59.3 33.5 14.5 22.6 22.7 24 39 A E - 0 0 88 -4,-0.3 -4,-2.6 2,-0.0 -1,-0.3 -0.910 54.0-122.0-100.9 133.7 10.9 21.9 23.9 25 40 A G E +J 19 0C 9 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.481 39.0 161.4 -73.0 141.5 10.1 18.3 24.7 26 41 A F E + 0 0 15 -8,-2.2 157,-0.4 1,-0.5 2,-0.3 0.427 65.0 11.9-133.2 -11.4 7.1 16.8 22.8 27 42 A b E -J 18 0C 0 -9,-0.9 -9,-2.9 157,-0.1 -1,-0.5 -0.974 67.1-124.6-160.5 158.9 7.7 13.0 23.2 28 43 A G E -J 17 0C 0 157,-2.7 12,-0.4 -2,-0.3 2,-0.3 -0.442 19.6-172.6 -98.4 176.6 9.7 10.5 25.1 29 44 A G E -J 16 0C 0 -13,-1.7 -13,-2.4 -2,-0.2 2,-0.4 -0.940 21.1-120.6-155.9 174.4 12.0 7.7 24.1 30 45 A T E -JL 15 38C 0 8,-2.2 8,-3.0 -2,-0.3 2,-0.5 -0.990 23.9-124.6-126.1 127.4 14.0 4.8 25.7 31 46 A I E + L 0 37C 0 -17,-2.5 76,-2.3 -2,-0.4 6,-0.2 -0.611 33.0 169.6 -69.4 124.0 17.7 4.4 25.5 32 47 A L - 0 0 12 4,-2.8 2,-0.3 -2,-0.5 5,-0.2 0.674 63.9 -24.3-103.3 -31.2 18.5 0.9 24.0 33 48 A S S S- 0 0 17 3,-1.4 -1,-0.4 72,-0.1 3,-0.2 -0.932 83.1 -71.3-164.8-177.1 22.2 1.3 23.4 34 49 A E S S+ 0 0 94 -2,-0.3 64,-3.0 1,-0.2 62,-0.1 0.821 132.4 27.2 -61.3 -28.8 24.9 3.9 22.7 35 50 A F S S+ 0 0 43 62,-0.2 59,-2.9 1,-0.1 2,-0.4 0.550 110.4 74.5-107.2 -13.9 23.5 4.5 19.2 36 51 A Y E - M 0 93C 12 57,-0.2 -4,-2.8 -3,-0.2 -3,-1.4 -0.917 45.5-175.5-122.4 136.7 19.8 3.6 19.5 37 52 A I E -LM 31 92C 0 55,-2.2 55,-2.6 -2,-0.4 2,-0.4 -0.968 18.3-142.8-119.8 136.6 16.6 5.1 20.9 38 53 A L E +LM 30 91C 0 -8,-3.0 -8,-2.2 -2,-0.4 2,-0.3 -0.807 35.5 147.9 -95.6 132.8 13.2 3.5 21.0 39 54 A T E - M 0 90C 0 51,-2.8 51,-2.2 -2,-0.4 2,-0.4 -0.848 48.0 -78.2-147.7-174.9 10.2 5.7 20.4 40 55 A A > - 0 0 0 -12,-0.4 3,-1.1 -2,-0.3 4,-0.4 -0.777 28.2-136.3 -91.2 139.2 6.7 5.8 19.0 41 56 A A G > S+ 0 0 0 -2,-0.4 3,-1.7 1,-0.2 4,-0.3 0.848 103.9 64.0 -58.2 -35.0 6.2 6.1 15.2 42 57 A H G > S+ 0 0 7 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.765 91.1 66.1 -66.6 -21.9 3.4 8.7 15.8 43 58 A b G X S+ 0 0 0 -3,-1.1 3,-1.2 1,-0.2 -1,-0.3 0.754 87.4 69.4 -66.1 -22.9 6.0 11.0 17.4 44 59 A L G < S+ 0 0 29 -3,-1.7 3,-0.3 -4,-0.4 -1,-0.2 0.690 99.3 47.9 -71.8 -18.9 7.7 11.3 14.0 45 60 A Y G < S+ 0 0 110 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.435 96.5 74.1 -96.4 -2.6 4.7 13.3 12.6 46 61 A Q S < S+ 0 0 76 -3,-1.2 2,-0.3 -4,-0.2 -2,-0.2 0.414 102.1 29.6-103.4 1.8 4.5 15.7 15.6 47 61AA A - 0 0 17 -3,-0.3 -1,-0.2 -4,-0.2 3,-0.1 -0.935 68.2-137.9-154.6 138.9 7.6 17.8 14.8 48 62 A K S S+ 0 0 196 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.933 93.4 1.7 -60.4 -49.2 9.2 18.7 11.5 49 63 A R S S+ 0 0 103 -3,-0.1 -28,-0.4 2,-0.0 2,-0.3 -0.964 75.7 171.3-135.5 153.5 12.7 18.2 12.9 50 64 A F - 0 0 22 -2,-0.3 21,-0.5 -30,-0.2 2,-0.2 -0.987 18.8-149.3-157.1 165.4 13.9 17.1 16.3 51 65 A K E -K 19 0C 63 -32,-2.2 -32,-2.5 -2,-0.3 2,-0.5 -0.715 25.8-114.2-126.0 177.5 16.9 16.0 18.5 52 66 A V E -KN 18 69C 0 17,-2.6 17,-3.1 -34,-0.2 2,-0.4 -0.974 20.6-161.2-122.9 126.8 17.2 13.7 21.5 53 67 A R E -KN 17 68C 34 -36,-3.0 -36,-2.3 -2,-0.5 2,-0.3 -0.902 10.4-177.0-106.9 136.6 18.2 14.7 25.0 54 68 A V E +KN 16 67C 0 13,-2.7 13,-2.2 -2,-0.4 -38,-0.1 -0.877 58.8 34.0-123.5 157.3 19.5 12.3 27.6 55 69 A G S S+ 0 0 7 -40,-0.6 2,-0.4 48,-0.6 10,-0.2 0.582 79.7 134.7 80.7 9.5 20.5 12.7 31.2 56 70 A D + 0 0 15 -41,-0.2 -1,-0.3 1,-0.1 3,-0.1 -0.738 20.6 158.6 -96.4 136.8 18.0 15.3 32.1 57 71 A R S S+ 0 0 75 -2,-0.4 86,-2.4 1,-0.3 2,-0.4 0.494 77.3 35.3-117.5 -21.3 15.8 15.3 35.2 58 72 A N B > -P 142 0D 19 3,-0.3 3,-1.6 84,-0.2 -1,-0.3 -0.934 62.2-161.0-141.3 110.7 14.9 19.0 35.3 59 73 A T T 3 S+ 0 0 50 82,-2.7 83,-0.1 -2,-0.4 -1,-0.1 0.585 92.2 53.2 -75.3 -6.9 14.3 20.9 32.1 60 74 A E T 3 S+ 0 0 153 81,-0.3 2,-0.4 1,-0.1 -1,-0.3 0.253 102.0 66.6-106.3 9.0 14.8 24.3 33.9 61 75 A Q S < S- 0 0 95 -3,-1.6 2,-1.1 0, 0.0 -3,-0.3 -0.998 70.9-140.8-134.4 132.6 18.2 23.5 35.5 62 76 A E + 0 0 164 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.782 27.1 174.1 -89.0 95.7 21.6 22.9 33.8 63 77 A E - 0 0 121 -2,-1.1 -1,-0.2 -5,-0.2 -7,-0.1 0.925 44.2-117.3 -70.2 -44.5 22.8 20.1 36.1 64 78 A G S S+ 0 0 70 -3,-0.2 -2,-0.1 0, 0.0 -1,-0.1 0.003 97.6 78.0 128.5 -27.5 25.9 19.3 34.1 65 79 A G + 0 0 23 -10,-0.2 2,-0.1 2,-0.0 -9,-0.1 0.444 65.7 111.9 -94.9 -2.4 25.2 15.7 32.9 66 80 A E - 0 0 37 -11,-0.1 2,-0.3 -13,-0.0 -11,-0.2 -0.394 42.1-174.7 -70.5 147.6 22.8 16.4 30.1 67 81 A A E -N 54 0C 28 -13,-2.2 -13,-2.7 -2,-0.1 2,-0.4 -0.998 15.3-147.1-144.9 146.6 23.6 15.8 26.4 68 82 A V E -N 53 0C 72 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.914 16.3-168.4-111.8 133.4 21.8 16.4 23.2 69 83 A H E -N 52 0C 12 -17,-3.1 -17,-2.6 -2,-0.4 2,-0.2 -0.966 15.5-132.5-124.8 137.2 22.2 14.1 20.2 70 84 A E - 0 0 82 -2,-0.4 25,-3.0 -19,-0.2 2,-0.5 -0.588 27.4-113.9 -81.2 154.7 21.2 14.5 16.5 71 85 A V E -O 94 0C 24 -21,-0.5 23,-0.3 23,-0.3 3,-0.1 -0.757 27.9-179.8 -93.2 123.9 19.4 11.7 14.7 72 86 A E E S+ 0 0 94 21,-2.7 2,-0.3 -2,-0.5 22,-0.2 0.857 71.9 10.5 -84.4 -45.4 21.2 10.0 11.8 73 87 A V E -O 93 0C 61 20,-1.8 20,-2.6 2,-0.0 2,-0.5 -0.999 59.2-151.3-140.5 137.4 18.5 7.6 10.7 74 88 A V E -O 92 0C 69 -2,-0.3 2,-0.6 18,-0.2 18,-0.2 -0.956 10.7-167.1-106.3 125.6 14.8 7.2 11.6 75 89 A I E -O 91 0C 44 16,-3.1 16,-2.4 -2,-0.5 2,-0.3 -0.894 12.4-177.2-114.3 94.7 13.6 3.5 11.3 76 90 A K E -O 90 0C 91 -2,-0.6 2,-0.3 14,-0.2 14,-0.2 -0.653 37.1-100.7 -87.5 147.2 9.8 3.6 11.4 77 91 A H > - 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