==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-SEP-04 1W8B . COMPND 2 MOLECULE: BLOOD COAGULATION FACTOR VIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.ACKERMANN,L.ALIG,D.W.BANNER,H.-J.BOEHM,K.GROEBKE-ZBINDEN, . 302 3 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14050.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 80 26.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 . 25 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 5.6 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 1 1 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 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 PARALLEL BRIDGES PER LADDER . 2 4 2 5 1 3 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 0 1 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 H I > 0 0 25 0, 0.0 3,-0.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 107.3 5.4 25.7 50.6 2 17 H V B 3 -A 180 0A 56 178,-2.1 178,-1.7 1,-0.2 209,-0.1 -0.617 360.0 -0.6 -74.8 129.9 7.1 23.2 48.4 3 18 H G T 3 S+ 0 0 54 -2,-0.3 -1,-0.2 176,-0.2 2,-0.2 0.628 100.5 127.9 69.9 18.0 5.6 19.7 48.5 4 19 H G < - 0 0 22 -3,-0.8 -1,-0.2 176,-0.2 138,-0.2 -0.535 54.9-118.7 -99.7 166.6 2.8 20.4 51.0 5 20 H K E -B 141 0B 115 136,-0.8 136,-2.8 -2,-0.2 2,-0.2 -0.543 41.0 -86.8 -92.7 168.4 -0.9 19.9 51.0 6 21 H V E -B 140 0B 53 134,-0.2 134,-0.3 -2,-0.2 -1,-0.1 -0.551 38.1-123.8 -71.4 137.1 -3.6 22.6 51.3 7 22 H a - 0 0 3 132,-2.8 132,-0.2 -2,-0.2 5,-0.2 -0.786 33.6-116.9 -81.7 111.0 -4.5 23.6 54.8 8 23 H P > - 0 0 51 0, 0.0 3,-3.2 0, 0.0 4,-0.3 -0.283 42.7 -91.4 -52.9 124.3 -8.3 23.0 55.0 9 24 H K T 3 S+ 0 0 63 1,-0.3 50,-0.1 2,-0.1 49,-0.0 -0.106 115.9 23.6 -41.1 119.1 -9.9 26.4 55.6 10 25 H G T 3 S+ 0 0 10 95,-0.1 -1,-0.3 -3,-0.1 292,-0.2 -0.034 97.7 91.6 110.9 -27.2 -10.2 26.7 59.4 11 26 H E S < S+ 0 0 62 -3,-3.2 -2,-0.1 1,-0.3 3,-0.1 0.509 92.0 41.9 -81.6 -3.0 -7.4 24.3 60.3 12 27 H a > + 0 0 12 -4,-0.3 3,-1.5 -5,-0.2 -1,-0.3 -0.444 68.9 153.7-132.6 60.1 -4.8 27.0 60.4 13 28 H P T 3 + 0 0 5 0, 0.0 94,-0.5 0, 0.0 44,-0.4 0.591 66.6 60.8 -75.2 -7.6 -6.7 29.9 62.2 14 29 H W T 3 S+ 0 0 9 92,-0.2 16,-2.0 94,-0.1 95,-0.2 0.537 75.3 121.6 -91.0 -7.7 -3.6 31.6 63.6 15 30 H Q E < -J 29 0C 2 -3,-1.5 42,-0.5 14,-0.2 2,-0.4 -0.331 47.2-158.6 -62.6 130.9 -2.1 32.2 60.2 16 31 H V E -J 28 0C 0 12,-1.9 12,-2.5 40,-0.1 2,-0.5 -0.931 8.6-154.8-111.7 136.5 -1.4 35.9 59.5 17 32 H L E -JK 27 55C 7 38,-2.5 38,-3.1 -2,-0.4 2,-0.5 -0.939 14.1-152.8-102.6 131.6 -1.0 37.6 56.1 18 33 H L E -JK 26 54C 2 8,-2.9 7,-3.0 -2,-0.5 8,-1.1 -0.925 12.9-173.6-110.0 124.9 1.0 40.8 56.1 19 34 H L E -JK 24 53C 37 34,-3.1 34,-2.9 -2,-0.5 2,-0.4 -0.897 15.9-166.9-115.3 142.9 0.5 43.5 53.5 20 35 H V E > S-JK 23 52C 24 3,-2.3 3,-1.8 -2,-0.4 32,-0.2 -0.967 86.6 -24.0-123.8 115.1 2.3 46.7 52.7 21 37 H N T 3 S- 0 0 113 30,-1.4 3,-0.1 -2,-0.4 31,-0.1 0.826 126.3 -53.4 51.1 38.1 0.3 48.9 50.4 22 38 H G T 3 S+ 0 0 60 29,-0.3 -1,-0.3 1,-0.3 2,-0.2 0.046 111.8 124.1 89.4 -25.3 -1.6 45.8 49.1 23 39 H A E < S-J 20 0C 55 -3,-1.8 -3,-2.3 1,-0.1 2,-0.4 -0.478 71.3-110.2 -72.6 136.5 1.7 44.0 48.3 24 40 H Q E +J 19 0C 83 -5,-0.2 -5,-0.2 -2,-0.2 -1,-0.1 -0.533 44.9 166.4 -69.8 120.3 2.2 40.6 49.9 25 41 H L E - 0 0 21 -7,-3.0 2,-0.3 -2,-0.4 -6,-0.2 0.872 49.7 -45.1-101.1 -55.6 5.0 41.0 52.5 26 42 H b E -J 18 0C 4 -8,-1.1 -8,-2.9 159,-0.1 -1,-0.4 -0.954 49.0 -95.7-166.8 172.2 5.1 38.0 54.8 27 43 H G E -J 17 0C 3 159,-2.5 12,-0.5 -2,-0.3 -10,-0.2 -0.811 40.5-173.3-101.6 151.9 3.2 35.5 56.9 28 44 H G E -J 16 0C 0 -12,-2.5 -12,-1.9 -2,-0.3 2,-0.4 -0.678 19.5-116.5-131.1-172.7 2.8 36.0 60.6 29 45 H T E -JL 15 37C 0 8,-0.6 8,-4.0 -2,-0.2 2,-0.4 -0.997 14.9-141.5-136.0 129.2 1.5 34.3 63.7 30 46 H L E + L 0 36C 0 -16,-2.0 79,-3.2 -2,-0.4 6,-0.2 -0.719 25.3 165.7 -84.1 133.4 -1.4 35.3 66.0 31 47 H I - 0 0 15 4,-1.7 2,-0.2 1,-0.5 80,-0.2 0.617 69.1 -5.6-121.0 -27.0 -0.8 34.7 69.7 32 48 H N S S- 0 0 51 3,-1.0 -1,-0.5 78,-0.1 3,-0.2 -0.863 89.4 -78.5-149.0-173.2 -3.6 36.8 71.3 33 49 H T S S+ 0 0 54 -2,-0.2 67,-2.7 1,-0.2 3,-0.0 0.605 126.4 27.0 -67.1 -11.5 -6.3 39.2 70.1 34 50 H I S S+ 0 0 56 65,-0.2 62,-2.4 1,-0.1 2,-0.3 0.544 108.0 70.8-129.5 -13.6 -3.8 42.1 69.7 35 51 H W E - M 0 95C 8 60,-0.2 -4,-1.7 -3,-0.2 -3,-1.0 -0.880 50.1-168.0-122.5 145.5 -0.3 40.7 69.1 36 52 H V E -LM 30 94C 0 58,-2.1 58,-3.3 -2,-0.3 2,-0.6 -0.983 11.1-147.4-133.6 139.2 1.3 39.0 66.1 37 53 H V E +LM 29 93C 0 -8,-4.0 -8,-0.6 -2,-0.4 2,-0.2 -0.923 33.5 144.9-114.2 115.2 4.7 37.2 65.8 38 54 H S E - M 0 92C 0 54,-2.5 54,-3.8 -2,-0.6 2,-0.3 -0.682 50.3 -71.6-133.7-176.9 6.6 37.3 62.5 39 55 H A > - 0 0 0 -12,-0.5 3,-0.9 52,-0.3 52,-0.3 -0.611 28.2-138.6 -86.3 142.3 10.2 37.4 61.2 40 56 H A G > S+ 0 0 0 -2,-0.3 3,-1.9 1,-0.2 -1,-0.1 0.836 99.8 65.9 -62.4 -35.5 12.4 40.5 61.6 41 57 H H G > S+ 0 0 54 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.680 83.1 75.4 -66.8 -19.3 13.8 40.2 58.1 42 58 H b G < S+ 0 0 6 -3,-0.9 4,-0.3 1,-0.2 -1,-0.3 0.652 97.0 49.5 -60.3 -17.1 10.3 40.9 56.6 43 59 H F G < S+ 0 0 11 -3,-1.9 -1,-0.2 -4,-0.1 -2,-0.2 0.268 77.1 102.7-113.4 8.9 10.9 44.6 57.5 44 60 H D S < S+ 0 0 80 -3,-1.4 -1,-0.1 1,-0.1 -2,-0.1 0.946 93.2 30.1 -53.8 -56.1 14.4 45.1 56.0 45 60AH K S S+ 0 0 163 -4,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.935 84.6 130.5 -73.7 -48.6 13.1 47.0 53.0 46 60BH I + 0 0 17 -4,-0.3 3,-0.1 1,-0.1 -3,-0.1 0.390 17.2 160.1 -16.4 116.1 10.0 48.7 54.4 47 60CH K + 0 0 164 1,-0.1 2,-2.2 2,-0.0 -1,-0.1 0.746 66.2 58.0-103.5 -64.6 9.9 52.4 53.6 48 60DH N > + 0 0 68 1,-0.2 3,-1.8 2,-0.1 -1,-0.1 -0.431 66.1 176.1 -71.0 75.8 6.2 53.4 54.0 49 61 H W G > + 0 0 65 -2,-2.2 3,-0.6 1,-0.3 -1,-0.2 0.640 68.9 63.6 -55.0 -21.1 5.9 52.3 57.6 50 62 H R G 3 S+ 0 0 226 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.520 89.8 65.6 -90.4 -4.1 2.3 53.5 58.0 51 63 H N G < + 0 0 55 -3,-1.8 -30,-1.4 21,-0.1 -29,-0.3 0.157 66.4 131.6-105.2 18.5 0.7 51.2 55.4 52 64 H L E < -K 20 0C 5 -3,-0.6 21,-1.8 21,-0.3 2,-0.4 -0.495 32.9-172.2 -75.2 137.0 1.2 47.8 57.1 53 65 H I E -KN 19 72C 47 -34,-2.9 -34,-3.1 19,-0.2 2,-0.5 -0.997 15.6-154.6-131.5 133.1 -1.9 45.5 57.3 54 66 H A E -KN 18 71C 0 17,-2.8 17,-2.5 -2,-0.4 2,-0.5 -0.933 15.5-161.7-102.2 127.8 -2.3 42.2 59.2 55 67 H V E -KN 17 70C 6 -38,-3.1 -38,-2.5 -2,-0.5 2,-0.3 -0.943 9.3-175.1-113.3 129.7 -5.0 40.0 57.6 56 68 H L E + N 0 69C 0 13,-2.8 13,-2.8 -2,-0.5 -40,-0.1 -0.840 62.5 30.5-126.0 160.7 -6.6 37.2 59.6 57 69 H G S S+ 0 0 10 -42,-0.5 11,-0.2 -44,-0.4 -1,-0.1 0.499 85.2 148.3 67.7 4.3 -9.1 34.4 58.9 58 70 H E + 0 0 24 -43,-0.3 -1,-0.3 11,-0.2 3,-0.1 -0.426 12.5 150.6 -70.0 140.9 -7.6 34.6 55.4 59 71 H H + 0 0 19 1,-0.3 80,-0.7 4,-0.2 2,-0.6 0.502 64.7 32.9-133.1 -59.1 -7.5 31.4 53.4 60 72 H D B > -Q 138 0D 11 3,-0.3 3,-1.5 78,-0.2 -1,-0.3 -0.937 61.4-157.5-112.3 114.1 -7.8 31.9 49.6 61 73 H L T 3 S+ 0 0 47 76,-2.7 77,-0.1 -2,-0.6 3,-0.1 0.463 89.2 63.1 -69.9 -1.7 -6.2 35.2 48.4 62 74 H S T 3 S+ 0 0 59 1,-0.2 2,-0.3 75,-0.2 -1,-0.3 0.507 106.0 38.1-101.7 -7.7 -8.4 35.2 45.3 63 75 H E < - 0 0 116 -3,-1.5 2,-0.8 74,-0.2 -3,-0.3 -0.973 68.6-138.1-145.0 129.9 -11.8 35.5 47.0 64 76 H H - 0 0 168 -2,-0.3 -3,-0.1 1,-0.1 -6,-0.0 -0.779 23.0-179.8 -79.9 108.9 -13.0 37.5 50.1 65 77 H D - 0 0 54 -2,-0.8 -1,-0.1 -5,-0.1 -7,-0.0 0.455 47.9-107.7 -93.6 1.1 -15.3 34.9 51.8 66 78 H G S S+ 0 0 60 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.244 103.4 90.1 108.2 -41.9 -16.3 37.2 54.7 67 79 H D + 0 0 51 -10,-0.1 -9,-0.1 2,-0.1 38,-0.1 0.692 61.3 111.3 -60.1 -24.1 -14.2 35.6 57.4 68 80 H E - 0 0 26 -11,-0.2 2,-0.4 -13,-0.1 -11,-0.2 -0.249 50.0-166.0 -55.5 136.0 -11.2 37.8 56.7 69 81 H Q E -N 56 0C 26 -13,-2.8 -13,-2.8 2,-0.0 2,-0.5 -0.986 2.3-162.7-129.3 121.1 -10.4 40.4 59.4 70 82 H S E +N 55 0C 67 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.910 10.9 174.5-114.1 129.7 -8.0 43.2 58.6 71 83 H R E -N 54 0C 51 -17,-2.5 -17,-2.8 -2,-0.5 2,-0.2 -0.965 31.0-115.0-131.2 143.6 -6.3 45.4 61.1 72 84 H R E -N 53 0C 147 -2,-0.3 25,-2.9 -19,-0.2 2,-0.8 -0.479 32.0-116.7 -73.8 145.1 -3.7 48.1 60.8 73 85 H V E -O 96 0C 12 -21,-1.8 -21,-0.3 23,-0.2 23,-0.2 -0.788 29.4-177.8 -87.5 113.8 -0.3 47.5 62.3 74 86 H A E + 0 0 44 21,-1.6 2,-0.3 -2,-0.8 22,-0.2 0.718 66.3 10.2 -79.2 -24.3 0.3 50.0 65.1 75 87 H Q E -O 95 0C 3 20,-1.5 20,-1.5 2,-0.0 2,-0.5 -0.974 48.7-156.1-162.9 140.1 3.8 48.8 65.9 76 88 H V E -Op 94 242C 0 165,-2.7 167,-3.3 -2,-0.3 2,-0.5 -0.960 20.7-167.2-117.5 111.8 6.7 46.6 64.9 77 89 H I E +Op 93 243C 0 16,-4.0 16,-3.2 -2,-0.5 167,-0.2 -0.877 9.2 176.9-103.3 130.1 9.0 45.5 67.7 78 90 H I E - p 0 244C 5 165,-2.7 167,-0.5 -2,-0.5 14,-0.1 -0.950 34.1-102.3-129.9 144.2 12.4 43.9 67.0 79 91 H P E > - p 0 245C 0 0, 0.0 3,-1.3 0, 0.0 12,-0.1 -0.383 24.5-128.3 -65.2 149.6 15.2 42.8 69.2 80 92 H S T 3 S+ 0 0 58 165,-1.4 164,-0.0 1,-0.3 165,-0.0 0.622 107.8 63.7 -69.3 -15.5 18.2 45.1 69.5 81 93 H T T 3 S+ 0 0 58 8,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.418 82.1 95.0 -91.9 -0.3 20.5 42.1 68.7 82 94 H Y < + 0 0 5 -3,-1.3 7,-0.1 7,-0.1 5,-0.1 -0.811 51.0 176.3 -89.0 133.7 18.9 41.7 65.2 83 95 H V > - 0 0 84 -2,-0.5 3,-1.5 5,-0.4 5,-0.2 -0.982 33.4-112.8-139.4 122.6 20.8 43.4 62.4 84 96 H P T 3 S+ 0 0 63 0, 0.0 3,-0.1 0, 0.0 -43,-0.0 -0.154 103.6 41.3 -54.7 149.4 19.8 43.2 58.7 85 97 H G T 3 S+ 0 0 83 1,-0.2 2,-0.4 -44,-0.0 -44,-0.0 0.310 105.2 82.0 89.0 -8.0 22.3 41.3 56.6 86 98 H T S < S- 0 0 84 -3,-1.5 -3,-0.3 2,-0.1 -1,-0.2 -0.992 72.5-145.7-128.4 139.0 22.7 38.8 59.5 87 99 H T > + 0 0 39 -2,-0.4 3,-0.6 -3,-0.1 -46,-0.1 0.516 63.0 111.1 -81.6 -7.8 20.1 35.9 60.0 88 100 H N T 3 S+ 0 0 31 1,-0.2 -5,-0.4 -5,-0.2 3,-0.1 -0.335 76.3 15.6 -74.8 150.4 20.3 35.9 63.8 89 101 H H T 3 S+ 0 0 14 1,-0.2 2,-2.0 -7,-0.1 -1,-0.2 0.846 74.5 175.9 59.7 40.4 17.5 37.0 66.0 90 102 H D < + 0 0 4 -3,-0.6 2,-0.3 78,-0.2 -1,-0.2 -0.487 32.7 113.1 -81.6 74.8 15.0 36.8 63.2 91 103 H I - 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