==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 16-JAN-13 4ISH . COMPND 2 MOLECULE: FACTOR VII HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.WEI . 309 2 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14145.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 58.9 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 . 86 27.8 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 . 19 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 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 . 4 4 1 5 2 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 1 0, 0.0 2,-0.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 123.3 18.6 34.3 29.3 2 17 H V B +A 186 0A 12 184,-3.1 184,-1.8 1,-0.2 134,-0.1 -0.871 360.0 2.4-102.3 127.0 18.6 35.0 33.0 3 18 H G S S+ 0 0 47 132,-0.5 -1,-0.2 -2,-0.5 184,-0.1 0.661 103.7 104.7 80.8 16.4 21.0 33.1 35.4 4 19 H G - 0 0 34 -3,-0.3 2,-0.3 182,-0.1 144,-0.2 0.023 62.8-110.9-104.0-146.8 22.9 31.1 32.7 5 20 H K E -B 147 0B 122 142,-2.3 142,-2.9 -3,-0.1 2,-0.2 -0.917 38.0 -75.1-143.7 168.9 26.3 31.4 31.2 6 21 H V E -B 146 0B 53 -2,-0.3 140,-0.3 140,-0.2 139,-0.1 -0.522 45.9-125.4 -64.0 130.6 28.0 32.2 27.9 7 22 H a - 0 0 4 138,-2.9 138,-0.2 -2,-0.2 5,-0.2 -0.724 35.5-112.1 -72.5 115.2 27.6 29.4 25.4 8 23 H P > - 0 0 51 0, 0.0 3,-2.9 0, 0.0 4,-0.3 -0.252 46.7 -87.0 -52.5 135.0 31.2 28.7 24.4 9 24 H K T 3 S+ 0 0 64 1,-0.3 50,-0.1 2,-0.1 49,-0.0 -0.168 115.6 15.8 -50.2 123.7 31.5 29.7 20.8 10 25 H G T 3 S+ 0 0 10 48,-0.2 296,-0.3 95,-0.2 -1,-0.3 0.252 99.2 95.6 97.8 -13.0 30.5 26.8 18.6 11 26 H E S < S+ 0 0 53 -3,-2.9 -2,-0.1 1,-0.2 3,-0.1 0.530 88.2 45.3 -90.3 -5.5 28.8 24.8 21.3 12 27 H a S > S+ 0 0 14 -4,-0.3 3,-2.0 -5,-0.2 -1,-0.2 -0.413 72.7 154.2-122.4 54.7 25.4 26.1 20.3 13 28 H P T 3 + 0 0 3 0, 0.0 94,-1.2 0, 0.0 44,-0.4 0.600 65.9 55.9 -72.2 -11.7 25.8 25.7 16.5 14 29 H W T 3 S+ 0 0 12 92,-0.2 16,-2.5 94,-0.1 95,-0.2 0.478 78.5 119.0 -93.1 -5.2 22.1 25.4 15.7 15 30 H Q E < -J 29 0C 3 -3,-2.0 42,-0.5 14,-0.2 2,-0.4 -0.400 48.7-158.8 -64.7 134.5 21.2 28.7 17.3 16 31 H V E -JK 28 56C 0 12,-2.5 12,-1.3 40,-0.1 2,-0.5 -0.916 8.6-151.7-113.3 141.9 19.7 31.2 14.9 17 32 H L E -JK 27 55C 7 38,-2.2 38,-2.9 -2,-0.4 2,-0.5 -0.970 12.6-154.6-107.4 125.8 19.5 35.0 15.2 18 33 H L E -JK 26 54C 0 8,-2.9 7,-3.1 -2,-0.5 8,-1.1 -0.881 13.4-173.1-101.5 131.3 16.6 36.6 13.5 19 34 H L E -JK 24 53C 35 34,-2.9 34,-2.7 -2,-0.5 2,-0.4 -0.924 14.9-164.9-120.7 144.8 17.0 40.3 12.5 20 35 H V E > S-JK 23 52C 22 3,-2.3 3,-2.0 -2,-0.4 32,-0.2 -0.988 86.0 -13.3-126.9 124.6 14.5 42.8 11.0 21 37 H N T 3 S- 0 0 105 30,-1.5 31,-0.1 -2,-0.4 3,-0.1 0.837 129.9 -57.7 52.7 33.8 16.1 45.9 9.5 22 38 H G T 3 S+ 0 0 64 29,-0.4 2,-0.3 1,-0.2 -1,-0.3 0.320 114.0 115.8 85.8 -9.3 19.3 44.9 11.3 23 39 H A E < S-J 20 0C 60 -3,-2.0 -3,-2.3 1,-0.1 -1,-0.2 -0.730 75.4-101.9 -98.4 142.2 17.7 44.8 14.8 24 40 H Q E +J 19 0C 71 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.386 44.7 166.0 -68.4 135.6 17.5 41.7 16.8 25 41 H L E - 0 0 53 -7,-3.1 2,-0.3 1,-0.4 -6,-0.2 0.761 54.0 -37.1-111.9 -50.4 14.0 40.2 16.7 26 42 H b E -J 18 0C 7 -8,-1.1 -8,-2.9 165,-0.1 -1,-0.4 -0.954 53.4-101.0-167.7 170.2 14.0 36.6 18.0 27 43 H G E +J 17 0C 3 165,-3.1 12,-0.4 -2,-0.3 2,-0.3 -0.480 33.7 179.8 -97.6 179.7 16.0 33.4 18.1 28 44 H G E -J 16 0C 0 -12,-1.3 -12,-2.5 -2,-0.2 2,-0.4 -0.963 24.0-114.0-165.6 177.5 15.4 30.2 16.1 29 45 H T E -JL 15 37C 0 8,-2.4 8,-2.8 -2,-0.3 2,-0.4 -0.984 17.2-138.7-130.0 124.9 16.7 26.7 15.6 30 46 H L E + L 0 36C 0 -16,-2.5 79,-3.1 -2,-0.4 6,-0.2 -0.647 23.1 173.6 -75.7 129.5 18.3 25.3 12.4 31 47 H I - 0 0 6 4,-2.4 80,-0.4 -2,-0.4 2,-0.3 0.506 68.1 -12.8-118.5 -7.4 17.1 21.8 11.7 32 48 H N S S- 0 0 51 3,-1.0 -1,-0.3 78,-0.1 68,-0.1 -0.899 94.6 -68.1-163.9-163.8 18.7 21.2 8.3 33 49 H T S S+ 0 0 55 -2,-0.3 67,-2.5 1,-0.2 65,-0.1 0.680 127.5 21.7 -75.0 -14.1 20.5 23.4 5.7 34 50 H I S S+ 0 0 48 65,-0.2 62,-3.1 1,-0.1 2,-0.4 0.554 107.1 77.9-124.9 -9.4 17.4 25.4 4.7 35 51 H W E - M 0 95C 7 60,-0.2 -4,-2.4 58,-0.0 -3,-1.0 -0.877 47.6-175.7-114.6 137.3 14.8 25.2 7.4 36 52 H V E -LM 30 94C 0 58,-2.5 58,-3.4 -2,-0.4 2,-0.5 -0.974 14.6-146.8-125.9 138.3 14.6 27.1 10.7 37 53 H V E +LM 29 93C 0 -8,-2.8 -8,-2.4 -2,-0.4 56,-0.2 -0.913 32.8 148.6-105.6 130.2 12.0 26.6 13.5 38 54 H S E - M 0 92C 0 54,-2.7 54,-2.3 -2,-0.5 2,-0.4 -0.635 48.9 -70.5-137.7-163.8 11.0 29.7 15.5 39 55 H A > - 0 0 0 -12,-0.4 3,-1.3 52,-0.3 52,-0.3 -0.846 28.7-137.7-101.5 136.7 8.0 31.1 17.4 40 56 H A G > S+ 0 0 0 -2,-0.4 3,-2.0 1,-0.2 -1,-0.1 0.877 101.3 63.4 -55.4 -40.0 4.9 32.3 15.5 41 57 H H G > S+ 0 0 51 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.697 84.3 76.3 -65.6 -17.7 4.5 35.4 17.8 42 58 H b G < S+ 0 0 8 -3,-1.3 -1,-0.3 1,-0.2 3,-0.2 0.690 98.4 46.2 -59.9 -18.4 7.9 36.7 16.6 43 59 H F G X S+ 0 0 7 -3,-2.0 3,-0.8 -4,-0.2 -1,-0.2 0.280 77.2 104.5-114.3 9.2 6.1 37.7 13.4 44 60 H D T < S+ 0 0 61 -3,-1.3 -1,-0.1 1,-0.2 -2,-0.1 0.818 91.7 32.7 -58.4 -35.6 3.0 39.4 14.7 45 60AH K T 3 S+ 0 0 179 -4,-0.3 2,-0.3 -3,-0.2 -1,-0.2 0.263 84.2 125.8-112.7 10.2 4.2 42.9 14.0 46 60BH I < + 0 0 18 -3,-0.8 3,-0.2 1,-0.2 -3,-0.0 -0.549 20.3 163.6 -75.1 131.4 6.4 42.5 10.9 47 60CH K + 0 0 161 -2,-0.3 2,-1.0 1,-0.2 -1,-0.2 0.724 69.0 52.1-111.4 -44.6 5.4 44.8 8.0 48 60DH N > + 0 0 58 1,-0.2 3,-1.5 3,-0.1 -1,-0.2 -0.762 61.6 176.9 -97.9 91.5 8.4 44.6 5.7 49 61 H W G > S+ 0 0 50 -2,-1.0 3,-1.1 1,-0.3 24,-0.2 0.695 72.6 69.7 -68.4 -19.8 9.0 40.9 5.2 50 62 H R G 3 S+ 0 0 173 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.598 92.5 58.7 -75.2 -11.3 11.8 41.5 2.7 51 63 H N G < S+ 0 0 70 -3,-1.5 -30,-1.5 21,-0.1 2,-0.6 0.155 76.3 116.3-103.1 17.0 14.1 42.8 5.6 52 64 H L E < -K 20 0C 1 -3,-1.1 21,-2.1 21,-0.2 2,-0.4 -0.788 43.5-178.7 -90.5 122.7 13.8 39.6 7.6 53 65 H I E -KN 19 72C 44 -34,-2.7 -34,-2.9 -2,-0.6 2,-0.5 -0.956 19.9-152.7-127.5 137.6 17.3 37.9 8.0 54 66 H A E -KN 18 71C 0 17,-3.0 17,-2.5 -2,-0.4 2,-0.5 -0.940 12.4-160.3-106.8 132.7 18.5 34.8 9.7 55 67 H V E -KN 17 70C 9 -38,-2.9 -38,-2.2 -2,-0.5 2,-0.3 -0.956 6.4-170.8-115.3 126.6 22.1 34.6 10.9 56 68 H L E +KN 16 69C 0 13,-3.1 13,-2.5 -2,-0.5 -40,-0.1 -0.766 69.0 30.3-107.6 157.2 23.8 31.3 11.6 57 69 H G S S+ 0 0 8 -42,-0.5 -1,-0.2 -44,-0.4 10,-0.2 0.654 83.8 150.3 71.4 14.1 27.2 30.8 13.3 58 70 H E + 0 0 34 -43,-0.4 -1,-0.2 -3,-0.3 -48,-0.2 -0.473 8.7 145.0 -77.9 148.7 26.6 33.9 15.3 59 71 H H + 0 0 19 1,-0.2 86,-1.7 4,-0.2 2,-0.6 0.369 64.1 34.9-142.7 -58.7 28.2 34.3 18.8 60 72 H D B > -Q 144 0D 36 84,-0.2 3,-1.2 3,-0.1 84,-0.2 -0.934 59.8-159.0-113.7 116.1 29.3 37.8 19.7 61 73 H L T 3 S+ 0 0 53 82,-2.9 -1,-0.1 -2,-0.6 83,-0.1 0.610 86.3 63.2 -72.0 -11.1 27.1 40.6 18.3 62 74 H S T 3 S+ 0 0 89 81,-0.3 2,-0.3 2,-0.0 -1,-0.2 0.621 105.4 39.3 -87.5 -13.6 29.8 43.3 18.6 63 75 H E < - 0 0 123 -3,-1.2 2,-0.5 0, 0.0 -4,-0.2 -0.865 67.2-134.7-134.9 157.1 32.3 41.7 16.2 64 76 H H + 0 0 140 -2,-0.3 -3,-0.1 1,-0.1 -6,-0.0 -0.985 25.5 170.4-112.3 119.4 32.4 39.9 12.8 65 77 H D - 0 0 64 -2,-0.5 -1,-0.1 -5,-0.1 -7,-0.0 0.464 52.3-107.0-109.3 0.0 34.7 36.9 13.0 66 78 H G S S+ 0 0 48 -9,-0.0 -2,-0.0 0, 0.0 -9,-0.0 0.291 100.0 92.3 99.3 -11.0 33.9 35.3 9.7 67 79 H D + 0 0 49 -10,-0.2 2,-0.2 2,-0.0 -9,-0.1 0.565 61.8 104.7 -89.1 -10.9 31.8 32.3 10.9 68 80 H E - 0 0 25 -13,-0.1 2,-0.4 38,-0.0 -11,-0.2 -0.478 50.3-169.9 -71.8 139.6 28.6 34.2 10.6 69 81 H Q E -N 56 0C 27 -13,-2.5 -13,-3.1 -2,-0.2 2,-0.4 -0.985 4.4-161.6-130.3 122.0 26.3 33.3 7.6 70 82 H S E +N 55 0C 76 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.850 10.0 178.8-107.4 140.6 23.3 35.4 6.8 71 83 H R E -N 54 0C 41 -17,-2.5 -17,-3.0 -2,-0.4 2,-0.1 -0.993 30.1-116.2-136.8 142.1 20.3 34.4 4.7 72 84 H R E -N 53 0C 129 -2,-0.4 25,-2.6 -19,-0.2 2,-0.7 -0.501 33.0-119.5 -69.9 146.7 17.1 36.1 3.7 73 85 H V E -O 96 0C 7 -21,-2.1 23,-0.2 -24,-0.2 -21,-0.2 -0.836 30.2-176.8 -90.8 114.2 14.0 34.4 5.0 74 86 H A E + 0 0 39 21,-2.1 2,-0.3 -2,-0.7 22,-0.2 0.807 65.5 14.7 -83.9 -32.7 12.0 33.4 1.9 75 87 H Q E -O 95 0C 3 20,-1.5 20,-2.1 2,-0.0 2,-0.5 -0.996 53.1-162.1-147.0 139.3 8.9 32.0 3.7 76 88 H V E -Op 94 248C 0 171,-2.6 173,-2.8 -2,-0.3 2,-0.5 -0.983 17.8-165.3-117.6 116.2 7.4 32.1 7.2 77 89 H I E -Op 93 249C 0 16,-2.8 16,-2.7 -2,-0.5 173,-0.2 -0.901 8.4-179.5-109.2 126.5 4.9 29.3 7.7 78 90 H I E - p 0 250C 13 171,-2.4 173,-2.4 -2,-0.5 14,-0.2 -0.941 33.6-100.9-126.6 143.0 2.5 29.4 10.7 79 91 H P E > - p 0 251C 0 0, 0.0 3,-1.6 0, 0.0 12,-0.1 -0.341 25.7-128.8 -60.9 140.9 -0.2 27.0 11.9 80 92 H S T 3 S+ 0 0 38 171,-2.3 170,-0.0 1,-0.3 -2,-0.0 0.796 107.7 63.0 -59.1 -28.7 -3.8 28.1 11.0 81 93 H T T 3 S+ 0 0 53 170,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.592 79.9 101.1 -77.4 -12.0 -4.7 27.5 14.6 82 94 H Y < - 0 0 9 -3,-1.6 7,-0.1 7,-0.1 8,-0.0 -0.592 58.0-159.1 -74.6 132.3 -2.3 30.3 15.9 83 95 H V > - 0 0 84 5,-0.5 3,-1.9 -2,-0.3 5,-0.1 -0.960 25.1-113.3-114.3 120.3 -4.0 33.5 16.7 84 96 H P T 3 S+ 0 0 90 0, 0.0 3,-0.1 0, 0.0 -43,-0.1 -0.175 100.7 24.1 -53.3 137.1 -1.8 36.7 16.7 85 97 H G T 3 S+ 0 0 67 1,-0.3 2,-0.2 -44,-0.0 -44,-0.0 0.401 109.0 89.5 88.1 -3.3 -1.4 38.2 20.2 86 98 H T S < S- 0 0 65 -3,-1.9 -1,-0.3 2,-0.1 -45,-0.1 -0.509 74.7-123.0-116.8-171.2 -2.2 34.9 22.0 87 99 H T > + 0 0 34 -2,-0.2 3,-0.5 -3,-0.1 -46,-0.1 0.743 68.1 100.0-108.7 -29.3 -0.1 32.0 23.3 88 100 H N T 3 S+ 0 0 43 1,-0.2 -5,-0.5 -7,-0.1 3,-0.2 -0.299 88.7 12.0 -71.9 146.5 -1.4 28.7 21.8 89 101 H H T 3 S+ 0 0 15 1,-0.2 2,-1.9 -7,-0.1 -1,-0.2 0.897 75.8 178.2 60.8 45.6 0.4 27.0 18.8 90 102 H D < + 0 0 3 -3,-0.5 2,-0.3 84,-0.2 -1,-0.2 -0.497 32.9 111.8 -86.7 76.1 3.4 29.3 19.1 91 103 H I - 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