==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 20-JAN-00 1DVA . COMPND 2 MOLECULE: DES-GLA FACTOR VIIA (HEAVY CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.EIGENBROT,M.H.ULTSCH . 746 8 24 22 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34813.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 444 59.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 182 24.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.6 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 . 64 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 10 10 2 10 6 4 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 . 8 0 0 0 0 0 2 2 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 24 0, 0.0 2,-0.4 0, 0.0 186,-0.2 0.000 360.0 360.0 360.0 150.0 33.7 -9.7 9.6 2 17 H V B +A 186 0A 47 184,-2.2 184,-1.0 1,-0.2 3,-0.1 -0.950 360.0 5.7-121.6 141.1 34.2 -13.5 9.6 3 18 H G S S+ 0 0 45 -2,-0.4 -1,-0.2 182,-0.2 182,-0.1 0.709 98.5 139.2 64.4 19.2 31.8 -16.0 8.3 4 19 H G - 0 0 25 182,-0.1 2,-0.3 -3,-0.1 144,-0.2 -0.135 48.5-135.7 -89.9-173.6 29.5 -13.3 7.0 5 20 H K E -B 147 0B 167 142,-1.4 142,-2.4 -3,-0.1 -3,-0.0 -0.957 39.8 -91.7-134.3 148.9 27.4 -12.6 3.9 6 21 H V E -B 146 0B 51 -2,-0.3 140,-0.3 140,-0.2 139,-0.1 -0.344 42.6-115.9 -63.9 144.3 27.3 -9.3 2.0 7 22 H a - 0 0 1 138,-2.5 4,-0.3 52,-0.1 3,-0.2 -0.744 31.8-109.4 -87.9 114.7 24.5 -6.9 3.2 8 23 H P > - 0 0 61 0, 0.0 3,-2.3 0, 0.0 4,-0.1 -0.094 52.5 -91.1 -42.5 125.0 22.0 -6.3 0.5 9 24 H K T 3 S+ 0 0 56 1,-0.3 50,-0.1 2,-0.2 49,-0.0 -0.179 115.2 15.6 -48.0 119.7 22.7 -2.7 -0.4 10 25 H G T 3 S+ 0 0 8 48,-0.2 344,-0.4 -3,-0.2 -1,-0.3 0.594 98.3 102.1 89.4 10.8 20.6 -0.4 1.7 11 26 H E S < S+ 0 0 76 -3,-2.3 -2,-0.2 -4,-0.3 341,-0.1 0.130 89.2 40.3-106.8 12.7 19.8 -3.2 4.1 12 27 H a S > S+ 0 0 11 -5,-0.2 3,-2.4 -4,-0.1 -1,-0.2 -0.183 72.7 153.3-150.0 42.1 22.4 -1.7 6.4 13 28 H P T 3 + 0 0 5 0, 0.0 94,-2.0 0, 0.0 44,-0.1 0.549 68.1 58.5 -57.8 -8.8 21.5 2.0 6.0 14 29 H W T 3 S+ 0 0 8 92,-0.2 16,-1.6 94,-0.1 2,-0.3 0.322 78.1 112.0-103.5 8.1 22.8 3.0 9.4 15 30 H Q E < -I 29 0C 6 -3,-2.4 42,-0.6 14,-0.2 2,-0.3 -0.623 48.1-165.7 -82.6 141.8 26.3 1.7 9.0 16 31 H V E -IJ 28 56C 0 12,-2.3 12,-0.9 -2,-0.3 2,-0.5 -0.853 14.8-143.9-122.0 155.1 29.0 4.3 8.8 17 32 H L E -IJ 27 55C 0 38,-2.7 38,-2.4 -2,-0.3 2,-0.6 -0.974 18.7-151.4-123.8 116.8 32.6 4.0 7.7 18 33 H L E -IJ 26 54C 4 8,-2.0 7,-2.5 -2,-0.5 8,-1.4 -0.801 14.1-172.5 -97.1 117.0 35.0 6.2 9.8 19 34 H L E -IJ 24 53C 0 34,-0.9 34,-1.5 -2,-0.6 2,-0.4 -0.721 18.0-164.1-106.8 153.9 38.2 7.6 8.2 20 35 H V E S- J 0 52C 22 3,-1.1 3,-0.3 -2,-0.3 32,-0.2 -0.883 89.5 -14.6-135.0 97.2 41.2 9.4 9.6 21 37 H N S S- 0 0 64 30,-1.7 -1,-0.1 -2,-0.4 3,-0.1 0.971 130.0 -51.5 70.9 54.9 43.1 10.9 6.8 22 38 H G S S+ 0 0 0 350,-0.3 337,-3.1 29,-0.3 338,-0.3 0.494 115.8 123.2 61.4 5.3 41.4 8.9 4.1 23 39 H A S S- 0 0 26 -3,-0.3 -3,-1.1 335,-0.3 2,-0.5 -0.567 72.3-103.3 -98.1 158.5 42.2 5.8 6.1 24 40 H Q E +I 19 0C 44 -5,-0.2 -5,-0.2 -2,-0.2 3,-0.1 -0.683 46.2 159.4 -79.7 125.7 40.0 3.2 7.6 25 41 H L E - 0 0 39 -7,-2.5 2,-0.2 -2,-0.5 165,-0.2 0.751 55.3 -61.8-109.2 -58.5 39.6 3.7 11.3 26 42 H b E -I 18 0C 8 -8,-1.4 -8,-2.0 165,-0.1 -1,-0.5 -0.811 47.9 -91.3-164.9-158.6 36.5 1.9 12.3 27 43 H G E +I 17 0C 1 165,-2.5 12,-0.4 -2,-0.2 2,-0.3 -0.661 36.2 176.2-125.4 179.3 32.8 1.6 11.8 28 44 H G E -I 16 0C 0 -12,-0.9 -12,-2.3 -2,-0.2 2,-0.3 -0.951 25.6-102.3-176.1 167.9 29.9 3.3 13.6 29 45 H T E -IK 15 37C 0 8,-2.7 8,-1.1 -2,-0.3 2,-0.7 -0.758 18.0-136.0-108.5 153.5 26.1 3.7 13.7 30 46 H L E + K 0 36C 0 -16,-1.6 79,-2.2 -2,-0.3 6,-0.2 -0.888 25.3 169.6-107.9 109.6 23.9 6.5 12.6 31 47 H I - 0 0 14 4,-1.2 2,-0.3 -2,-0.7 80,-0.2 0.841 68.5 -8.4 -88.8 -32.4 21.2 7.4 15.1 32 48 H N S S- 0 0 50 3,-1.0 3,-0.5 76,-0.1 2,-0.4 -0.933 92.7 -73.5-151.9 171.2 19.9 10.6 13.6 33 49 H T S S+ 0 0 45 -2,-0.3 67,-1.4 1,-0.2 3,-0.1 0.324 127.9 22.7 -53.1 9.1 20.9 13.0 10.9 34 50 H I S S+ 0 0 23 -2,-0.4 62,-2.1 65,-0.2 2,-0.3 0.521 106.1 75.7-148.9 -24.8 23.8 14.3 12.9 35 51 H W E - L 0 95C 16 -3,-0.5 -4,-1.2 60,-0.2 -3,-1.0 -0.730 46.9-175.3-106.1 152.4 24.9 11.9 15.6 36 52 H V E -KL 30 94C 0 58,-1.4 58,-1.2 -2,-0.3 2,-0.2 -0.951 10.5-154.3-146.5 120.7 26.9 8.7 15.3 37 53 H V E +KL 29 93C 0 -8,-1.1 -8,-2.7 -2,-0.4 2,-0.3 -0.626 28.4 148.9 -91.0 156.6 27.8 6.2 18.0 38 54 H S E - L 0 92C 0 54,-1.5 54,-2.2 -10,-0.2 2,-0.2 -0.952 51.2 -62.1-170.5 173.6 30.9 4.1 17.7 39 55 H A > - 0 0 0 -12,-0.4 3,-1.0 -2,-0.3 52,-0.3 -0.475 36.1-139.2 -74.1 139.6 33.4 2.5 19.9 40 56 H A G > S+ 0 0 0 1,-0.2 3,-1.6 -2,-0.2 -1,-0.1 0.858 92.4 71.2 -65.1 -37.6 35.6 4.7 22.0 41 57 H H G > S+ 0 0 23 1,-0.3 3,-0.7 2,-0.1 4,-0.2 0.578 80.4 74.2 -63.4 -6.9 38.8 2.8 21.5 42 58 H b G X S+ 0 0 12 -3,-1.0 3,-0.5 1,-0.3 2,-0.5 0.831 93.4 55.3 -70.6 -31.8 39.2 4.0 17.8 43 59 H F G < S+ 0 0 11 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.1 -0.289 78.9 99.4 -96.6 48.6 40.2 7.5 19.0 44 60 H D G < S+ 0 0 63 -3,-0.7 -1,-0.2 -2,-0.5 -2,-0.1 0.797 92.4 27.9 -98.8 -41.5 43.0 6.2 21.2 45 60AH K S < S+ 0 0 198 -3,-0.5 2,-0.5 -4,-0.2 -2,-0.1 0.086 85.0 136.5-109.5 23.4 45.9 7.0 18.9 46 60BH I + 0 0 18 1,-0.2 3,-0.2 3,-0.0 -3,-0.0 -0.607 12.5 156.5 -76.2 122.0 44.3 9.9 17.0 47 60CH K + 0 0 184 -2,-0.5 2,-1.6 1,-0.2 3,-0.2 0.707 67.4 58.0-111.1 -43.1 46.8 12.7 16.5 48 60DH N > + 0 0 93 1,-0.2 3,-1.5 3,-0.1 -1,-0.2 -0.539 65.0 166.7 -92.0 72.4 45.4 14.5 13.6 49 61 H W G > + 0 0 59 -2,-1.6 3,-0.6 1,-0.3 -1,-0.2 0.655 65.8 66.2 -58.9 -22.6 42.0 15.3 15.1 50 62 H R G 3 S+ 0 0 189 1,-0.2 -1,-0.3 -3,-0.2 23,-0.1 0.721 92.5 64.3 -75.2 -18.3 41.1 17.8 12.4 51 63 H N G < + 0 0 36 -3,-1.5 -30,-1.7 21,-0.1 2,-0.8 -0.160 64.4 133.0-100.9 41.7 40.9 15.2 9.8 52 64 H L E < -J 20 0C 6 -3,-0.6 21,-1.5 21,-0.2 -32,-0.2 -0.799 29.9-178.3 -97.9 107.7 38.1 12.8 10.9 53 65 H I E -JM 19 72C 12 -34,-1.5 -34,-0.9 -2,-0.8 2,-0.3 -0.509 14.9-156.3 -96.3 167.5 35.6 11.9 8.1 54 66 H A E -J 18 0C 0 17,-0.9 2,-0.4 -36,-0.2 17,-0.3 -0.776 8.0-159.5-150.0 98.6 32.5 9.8 8.3 55 67 H V E +J 17 0C 0 -38,-2.4 -38,-2.7 -2,-0.3 2,-0.3 -0.674 13.3 179.4 -83.6 127.4 31.3 8.2 5.1 56 68 H L E +JN 16 69C 0 13,-2.2 13,-3.0 -2,-0.4 -40,-0.1 -0.944 61.4 41.0-126.2 150.2 27.6 7.1 5.0 57 69 H G S S+ 0 0 7 -42,-0.6 11,-0.2 -2,-0.3 -1,-0.1 0.221 83.5 139.0 95.8 -10.0 25.7 5.5 2.2 58 70 H E + 0 0 14 -43,-0.2 -1,-0.3 11,-0.2 -48,-0.2 -0.030 12.1 143.6 -63.3 167.8 28.7 3.3 1.5 59 71 H H S S+ 0 0 22 84,-0.1 86,-1.6 -50,-0.1 2,-0.7 -0.016 71.4 30.9-161.8 -72.8 28.5 -0.4 0.5 60 72 H D B > -Q 144 0D 21 84,-0.2 3,-1.3 3,-0.1 84,-0.2 -0.877 62.3-163.5-105.3 102.2 31.1 -1.4 -2.0 61 73 H L T 3 S+ 0 0 2 82,-1.8 305,-2.6 -2,-0.7 308,-0.1 0.363 81.8 67.8 -71.6 13.9 34.3 0.7 -1.7 62 74 H S T 3 S+ 0 0 52 81,-0.4 2,-0.3 303,-0.3 -1,-0.2 0.673 104.6 28.4-104.7 -18.8 35.5 -0.3 -5.1 63 75 H E S < S- 0 0 113 -3,-1.3 2,-0.4 303,-0.1 303,-0.2 -0.863 78.3-112.8-134.3 167.1 32.9 1.4 -7.3 64 76 H H + 0 0 80 -2,-0.3 2,-0.2 -3,-0.1 -3,-0.0 -0.834 28.6 165.6-111.0 149.6 30.6 4.5 -7.1 65 77 H D > - 0 0 33 -2,-0.4 2,-0.7 -5,-0.0 3,-0.6 -0.786 52.4-104.4-157.2 102.6 26.8 4.9 -6.8 66 78 H G T 3 S+ 0 0 48 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.060 100.2 88.2 -32.6 76.3 25.5 8.3 -5.8 67 79 H D T 3 + 0 0 23 -2,-0.7 -1,-0.2 -11,-0.1 2,-0.2 0.332 56.3 105.4-149.0 -24.1 24.6 7.3 -2.3 68 80 H E < - 0 0 18 -3,-0.6 2,-0.4 -11,-0.2 -11,-0.2 -0.462 47.3-173.7 -71.6 138.5 27.9 8.0 -0.5 69 81 H Q B -N 56 0C 23 -13,-3.0 -13,-2.2 -2,-0.2 2,-0.3 -0.998 9.9-153.5-134.3 133.6 27.9 11.1 1.7 70 82 H S + 0 0 33 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.831 16.8 171.0-109.4 150.5 30.9 12.6 3.5 71 83 H R - 0 0 59 -2,-0.3 -17,-0.9 -17,-0.3 29,-0.0 -0.964 31.2-118.5-154.8 137.8 30.6 14.7 6.6 72 84 H R B -M 53 0C 135 -2,-0.3 25,-1.4 -19,-0.2 2,-0.6 -0.311 24.3-126.9 -74.2 163.4 33.3 16.0 8.9 73 85 H V E +O 96 0C 10 -21,-1.5 23,-0.3 23,-0.2 -21,-0.2 -0.841 25.4 179.6-115.4 96.3 33.3 14.9 12.6 74 86 H A E + 0 0 37 21,-1.0 2,-0.4 -2,-0.6 22,-0.2 0.878 67.4 24.0 -63.4 -39.6 33.3 17.9 14.9 75 87 H Q E -O 95 0C 2 20,-1.7 20,-1.6 2,-0.0 2,-0.5 -0.976 48.1-170.4-135.4 148.1 33.3 16.0 18.1 76 88 H V E -Op 94 248C 0 171,-2.5 173,-1.7 -2,-0.4 2,-0.4 -0.919 24.0-173.2-132.0 98.8 34.2 12.6 19.5 77 89 H I E +Op 93 249C 0 16,-2.9 16,-2.8 -2,-0.5 173,-0.2 -0.819 7.7 169.5-100.3 138.8 32.8 12.3 23.0 78 90 H I - 0 0 4 171,-1.5 173,-0.2 -2,-0.4 14,-0.2 -0.989 40.6 -66.5-147.3 155.3 33.6 9.4 25.3 79 91 H P - 0 0 0 0, 0.0 3,-0.5 0, 0.0 172,-0.0 0.042 29.6-138.8 -40.7 133.0 33.2 8.3 29.0 80 92 H S S S+ 0 0 54 171,-0.8 170,-0.1 1,-0.3 171,-0.0 0.772 111.4 52.4 -63.3 -27.0 35.2 10.2 31.6 81 93 H T S S+ 0 0 57 170,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.681 80.3 113.4 -81.7 -24.2 35.7 6.7 33.0 82 94 H Y - 0 0 6 -3,-0.5 7,-0.1 1,-0.1 8,-0.1 -0.344 55.0-159.6 -54.9 122.6 36.9 5.4 29.7 83 95 H V > - 0 0 82 5,-0.5 3,-1.1 -2,-0.1 5,-0.1 -0.914 24.9-110.2-112.1 105.4 40.5 4.6 30.3 84 96 H P T 3 S+ 0 0 72 0, 0.0 3,-0.1 0, 0.0 -43,-0.0 0.089 99.6 20.0 -32.1 133.5 42.6 4.4 27.1 85 97 H G T 3 S+ 0 0 47 1,-0.3 2,-0.2 -44,-0.1 -3,-0.0 0.595 103.1 103.1 79.1 11.6 43.7 0.8 26.3 86 98 H T S < S- 0 0 50 -3,-1.1 -1,-0.3 2,-0.2 -45,-0.1 -0.710 72.7-122.7-119.9 172.5 41.1 -1.1 28.4 87 99 H T S S+ 0 0 25 -2,-0.2 3,-0.4 -3,-0.1 2,-0.3 0.714 76.5 98.3 -91.1 -19.2 37.9 -2.9 27.7 88 100 H N S S+ 0 0 46 1,-0.2 -5,-0.5 -5,-0.1 -2,-0.2 -0.529 89.4 5.4 -80.1 137.7 35.5 -1.0 29.9 89 101 H H + 0 0 17 -2,-0.3 2,-1.1 1,-0.2 -1,-0.2 0.984 68.7 176.5 60.0 66.9 33.2 1.7 28.5 90 102 H D + 0 0 0 -3,-0.4 2,-0.3 84,-0.2 136,-0.2 -0.612 37.7 110.5 -98.1 70.5 34.1 1.3 24.8 91 103 H I - 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