==== 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 23-OCT-00 1G32 . COMPND 2 MOLECULE: PROTHROMBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.NAR . 289 4 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 60.9 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 . 75 26.0 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 . 1 0.3 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-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 . 22 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 9.0 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+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 1 1 1 0 0 0 1 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 1 3 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 . 1 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 1CA E 0 0 121 0, 0.0 3,-0.3 0, 0.0 147,-0.1 0.000 360.0 360.0 360.0 134.5 15.4 16.9 19.8 2 1BA A + 0 0 87 1,-0.2 145,-0.0 145,-0.0 0, 0.0 0.784 360.0 25.7 -73.9 -28.9 13.2 19.9 20.3 3 1AA D S > S+ 0 0 64 143,-0.1 3,-1.2 3,-0.0 -1,-0.2 0.182 92.0 137.3-119.9 13.5 9.9 18.5 19.0 4 1 A a T 3 + 0 0 8 -3,-0.3 142,-0.2 1,-0.2 3,-0.1 -0.131 62.4 22.9 -61.7 154.6 10.7 14.9 19.7 5 2 A G T 3 S+ 0 0 0 140,-2.2 236,-1.4 235,-0.2 2,-0.6 0.477 91.4 110.2 70.4 0.9 8.1 12.6 21.2 6 3 A L < - 0 0 36 -3,-1.2 -1,-0.1 139,-0.3 234,-0.1 -0.957 62.8-143.2-110.2 112.1 5.1 14.7 20.1 7 4 A R > > - 0 0 0 -2,-0.6 5,-2.5 1,-0.1 3,-1.4 -0.607 8.2-136.4 -80.6 134.0 3.3 12.8 17.4 8 5 A P T 3 5S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 133,-0.1 0.874 104.8 42.7 -54.2 -42.2 1.8 14.7 14.4 9 6 A L T 3 5S+ 0 0 28 132,-0.5 30,-0.1 29,-0.3 132,-0.1 0.457 130.7 18.0 -87.7 -1.2 -1.5 12.8 14.5 10 7 A F T X >S+ 0 0 15 -3,-1.4 5,-2.4 28,-0.1 3,-1.6 0.414 128.4 26.1-128.6 -86.5 -1.9 12.8 18.3 11 8 A E G > 5S+ 0 0 29 1,-0.3 3,-1.4 3,-0.2 -5,-0.1 0.857 119.0 58.9 -52.8 -43.0 -0.0 15.2 20.7 12 9 A K G 3 > S+ 0 0 42 2,-0.1 3,-1.1 1,-0.1 4,-0.8 0.471 86.5 97.6-127.0 1.6 -4.4 2.9 25.0 20 14CA E H >> S+ 0 0 9 -3,-0.4 4,-2.1 1,-0.3 3,-0.7 0.841 78.2 66.4 -60.5 -33.4 -2.1 5.6 26.2 21 14DA R H 3> S+ 0 0 144 -4,-0.4 4,-2.6 1,-0.3 -1,-0.3 0.863 94.2 59.8 -55.1 -35.9 -4.4 6.2 29.2 22 14EA E H <> S+ 0 0 45 -3,-1.1 4,-0.7 2,-0.2 -1,-0.3 0.889 106.6 47.4 -58.8 -41.0 -3.4 2.6 30.5 23 14FA L H X< S+ 0 0 0 -4,-0.8 3,-1.3 -3,-0.7 140,-0.5 0.959 112.3 46.9 -65.0 -52.2 0.2 3.8 30.6 24 14GA L H >< S+ 0 0 49 -4,-2.1 3,-1.2 1,-0.3 -2,-0.2 0.866 107.7 57.9 -64.6 -28.2 -0.5 7.0 32.4 25 14HA E H 3< S+ 0 0 148 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.699 102.0 55.7 -73.6 -19.0 -2.7 5.1 34.9 26 14IA S T << 0 0 26 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.481 360.0 360.0 -88.7 -7.8 0.2 2.9 35.8 27 14JA Y < 0 0 52 -3,-1.2 -2,-0.2 -4,-0.4 -3,-0.1 0.913 360.0 360.0 -90.4 360.0 2.4 5.9 36.7 28 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 29 16 B I 0 0 0 0, 0.0 2,-0.5 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 127.2 4.4 -8.9 19.1 30 17 B V B -A 221 0A 9 191,-2.9 191,-1.5 1,-0.2 143,-0.1 -0.807 360.0 -2.9 -95.6 131.0 2.4 -11.6 21.0 31 18 B E S S+ 0 0 119 141,-0.5 -1,-0.2 -2,-0.5 188,-0.2 0.739 102.4 121.5 63.9 25.9 -1.0 -10.7 22.3 32 19 B G - 0 0 24 -3,-0.5 2,-0.3 189,-0.1 153,-0.2 -0.051 53.7-124.4 -95.8-156.0 -0.7 -7.1 21.1 33 20 B S E -B 184 0B 64 151,-2.3 151,-2.6 -3,-0.1 2,-0.2 -0.924 34.1 -68.5-148.7 168.6 -3.1 -5.3 18.7 34 21 B D E -B 183 0B 106 -2,-0.3 149,-0.2 149,-0.2 148,-0.1 -0.440 53.3-120.8 -62.0 131.4 -3.0 -3.3 15.4 35 22 B A - 0 0 5 147,-3.0 2,-0.2 -2,-0.2 -1,-0.1 -0.332 24.7-116.2 -69.9 151.4 -1.3 0.0 15.8 36 23 B E > - 0 0 37 1,-0.1 3,-1.7 -2,-0.0 4,-0.3 -0.521 45.7 -84.6 -81.0 159.9 -3.4 3.1 15.0 37 24 B I T 3 S+ 0 0 95 1,-0.3 -1,-0.1 -2,-0.2 57,-0.1 -0.523 116.7 8.0 -69.6 129.0 -2.1 5.1 12.0 38 25 B G T 3 S+ 0 0 11 -2,-0.3 -29,-0.3 104,-0.1 -1,-0.3 0.514 92.6 123.8 78.9 8.3 0.6 7.5 13.1 39 26 B M S < S+ 0 0 6 -3,-1.7 -2,-0.1 1,-0.3 -22,-0.1 0.808 83.4 23.5 -69.8 -31.0 0.7 6.0 16.6 40 27 B S > + 0 0 13 -4,-0.3 3,-2.5 1,-0.1 -1,-0.3 -0.493 69.2 166.9-136.9 68.6 4.4 5.2 16.5 41 28 B P T 3 S+ 0 0 2 0, 0.0 103,-2.0 0, 0.0 51,-0.1 0.559 76.1 59.5 -62.9 -8.1 5.9 7.6 14.0 42 29 B W T 3 S+ 0 0 3 101,-0.2 18,-2.3 103,-0.1 2,-0.2 0.437 76.4 123.8 -97.9 -2.4 9.5 6.7 15.1 43 30 B Q E < -J 59 0C 2 -3,-2.5 49,-1.0 16,-0.2 2,-0.4 -0.431 40.7-173.1 -64.1 129.3 9.0 3.1 14.2 44 31 B V E -JK 58 91C 0 14,-2.1 14,-1.4 -2,-0.2 2,-0.5 -0.962 16.5-145.2-127.4 140.6 11.7 1.9 11.8 45 32 B M E -JK 57 90C 0 45,-2.2 45,-2.7 -2,-0.4 2,-0.8 -0.925 11.4-143.0-106.5 125.4 12.0 -1.4 10.0 46 33 B L E -JK 56 89C 0 10,-3.1 9,-3.2 -2,-0.5 10,-1.3 -0.839 29.6-162.9 -88.2 111.2 15.5 -2.8 9.4 47 34 B F E -JK 54 88C 0 41,-3.4 41,-1.9 -2,-0.8 2,-0.4 -0.859 15.9-139.5-108.0 131.3 15.1 -4.4 6.0 48 35 B R E > -JK 53 87C 83 5,-3.3 5,-1.4 -2,-0.4 39,-0.2 -0.707 7.8-155.7 -85.2 131.4 17.4 -6.9 4.3 49 36 B K T 5S+ 0 0 31 37,-1.7 -1,-0.1 -2,-0.4 38,-0.1 0.940 75.8 57.0 -72.8 -48.6 17.9 -6.3 0.5 50 36AB S T 5S+ 0 0 102 36,-0.4 -1,-0.2 1,-0.3 2,-0.2 -0.897 124.3 15.3-136.2 105.1 18.8 -9.8 -0.6 51 37 B P T 5S- 0 0 78 0, 0.0 2,-0.8 0, 0.0 -1,-0.3 0.617 104.6-124.1 -73.9 165.6 16.6 -11.5 0.1 52 38 B Q T 5 + 0 0 50 -2,-0.2 232,-0.4 232,-0.1 2,-0.3 -0.718 58.8 132.0 -76.4 112.1 14.1 -8.7 0.8 53 39 B E E < -J 48 0C 63 -5,-1.4 -5,-3.3 -2,-0.8 2,-0.4 -0.995 63.5 -88.4-161.3 158.9 13.0 -9.4 4.4 54 40 B L E +J 47 0C 24 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.592 39.6 171.5 -71.7 124.0 12.3 -8.0 7.8 55 41 B L E - 0 0 25 -9,-3.2 2,-0.3 1,-0.4 170,-0.2 0.823 56.7 -36.1-100.5 -43.3 15.5 -8.2 9.8 56 42 B b E -J 46 0C 0 -10,-1.3 -10,-3.1 170,-0.1 -1,-0.4 -0.954 55.6 -96.2-167.8 175.7 14.7 -6.2 12.9 57 43 B G E +J 45 0C 2 170,-2.8 12,-0.4 -2,-0.3 2,-0.3 -0.526 42.5 163.5 -98.2 170.2 12.8 -3.3 14.5 58 44 B A E -J 44 0C 0 -14,-1.4 -14,-2.1 -2,-0.2 2,-0.3 -0.933 24.6-118.1-169.1-175.0 14.5 0.1 15.2 59 45 B S E -JL 43 67C 0 8,-2.3 8,-3.0 -2,-0.3 2,-0.6 -0.998 14.0-121.5-149.1 150.5 13.6 3.7 15.9 60 46 B L E + L 0 66C 0 -18,-2.3 86,-2.0 -2,-0.3 6,-0.2 -0.783 30.2 166.5 -89.7 115.8 14.0 7.2 14.5 61 47 B I S S- 0 0 11 4,-2.6 2,-0.3 -2,-0.6 5,-0.2 0.563 70.1 -14.2-107.2 -10.0 15.8 9.5 16.9 62 48 B S S S- 0 0 19 3,-1.1 -1,-0.3 85,-0.1 3,-0.3 -0.920 88.8 -74.6-169.5-179.0 16.6 12.4 14.5 63 49 B D S S+ 0 0 54 -2,-0.3 74,-2.4 1,-0.2 72,-0.1 0.721 130.8 22.6 -65.3 -19.9 16.5 13.0 10.7 64 50 B R S S+ 0 0 24 72,-0.2 69,-2.5 217,-0.2 2,-0.5 0.400 107.4 83.1-126.4 2.5 19.7 11.0 10.2 65 51 B W E - M 0 132C 0 -3,-0.3 -4,-2.6 67,-0.2 -3,-1.1 -0.950 47.0-176.2-120.2 126.2 20.0 8.7 13.3 66 52 B V E -LM 60 131C 0 65,-2.5 65,-2.2 -2,-0.5 2,-0.4 -0.952 13.1-151.7-117.5 131.6 18.3 5.3 13.7 67 53 B L E +LM 59 130C 0 -8,-3.0 -8,-2.3 -2,-0.4 2,-0.2 -0.864 28.1 142.2-107.8 140.0 18.6 3.4 17.0 68 54 B T E - M 0 129C 0 61,-2.5 61,-2.7 -2,-0.4 2,-0.4 -0.878 52.5 -68.7-156.1-175.3 18.5 -0.4 17.3 69 55 B A > - 0 0 0 -12,-0.4 3,-2.3 59,-0.3 4,-0.4 -0.761 34.9-133.1 -89.5 134.6 19.9 -3.4 19.1 70 56 B A G >> S+ 0 0 0 -2,-0.4 4,-2.6 1,-0.3 3,-2.0 0.854 105.2 66.5 -52.6 -35.6 23.6 -4.3 18.3 71 57 B H G 34 S+ 0 0 7 1,-0.3 -1,-0.3 2,-0.2 9,-0.1 0.658 88.1 67.3 -61.5 -19.7 22.5 -8.0 17.9 72 58 B b G <4 S+ 0 0 0 -3,-2.3 -1,-0.3 1,-0.1 -2,-0.2 0.746 117.0 23.7 -71.9 -25.1 20.4 -7.0 14.9 73 59 B L T <4 S+ 0 0 1 -3,-2.0 9,-2.0 -4,-0.4 2,-0.5 0.821 130.5 32.0-105.8 -51.3 23.7 -6.2 13.0 74 60 B L E < +P 81 0D 41 -4,-2.6 -1,-0.3 7,-0.2 7,-0.2 -0.940 61.4 134.9-118.7 119.8 26.4 -8.3 14.8 75 60AB Y E > > -P 80 0D 42 5,-3.1 3,-2.0 -2,-0.5 5,-1.8 -0.424 26.3-170.4-163.8 81.9 25.7 -11.6 16.4 76 60BB P G > 5S+ 0 0 46 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.742 82.0 65.4 -44.0 -42.3 28.3 -14.5 15.6 77 60CB P G 3 5S+ 0 0 72 0, 0.0 44,-0.0 0, 0.0 -2,-0.0 0.833 112.1 36.7 -57.0 -29.8 26.3 -17.3 17.1 78 60DB W G < 5S- 0 0 164 -3,-2.0 3,-0.1 2,-0.1 -3,-0.0 0.092 116.1-113.8-106.5 20.2 23.7 -16.8 14.4 79 60EB D T < 5 + 0 0 156 -3,-2.2 2,-0.5 1,-0.2 -5,-0.0 0.759 66.8 150.1 51.9 30.3 26.3 -16.0 11.7 80 60FB K E < +P 75 0D 35 -5,-1.8 -5,-3.1 -9,-0.1 -1,-0.2 -0.800 5.4 138.1 -96.9 127.0 24.9 -12.4 11.6 81 60GB N E -P 74 0D 115 -2,-0.5 -7,-0.2 -7,-0.2 -8,-0.1 -0.327 28.5-174.9-165.8 71.3 27.3 -9.6 10.7 82 60HB F - 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