==== 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 09-MAY-05 1ZLR . COMPND 2 MOLECULE: COAGULATION FACTOR XI; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.I.LAZAROVA,L.JIN,M.RYNKIEWICZ,J.C.GORGA,F.BIBBINS,H.V.MEYE . 237 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11741.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 30.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 23 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 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 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 . 3 3 2 5 1 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 . 0 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 3,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 120.1 13.2 63.6 81.1 2 17 A V B 3 +A 182 0A 20 180,-3.5 180,-1.8 1,-0.2 134,-0.1 -0.741 360.0 5.9 -93.9 140.4 12.4 62.9 77.5 3 18 A G T 3 S+ 0 0 30 132,-0.4 -1,-0.2 -2,-0.4 2,-0.1 0.740 102.1 121.1 64.2 25.3 14.5 60.4 75.5 4 19 A G < - 0 0 11 -3,-0.5 2,-0.3 178,-0.1 144,-0.2 -0.299 53.1-125.0-105.1-167.7 16.5 59.4 78.5 5 20 A T E -B 147 0B 82 142,-2.4 142,-2.5 -2,-0.1 2,-0.1 -0.882 37.0 -75.0-135.7 168.4 17.2 56.1 80.3 6 21 A A E -B 146 0B 56 -2,-0.3 140,-0.2 140,-0.2 139,-0.1 -0.409 50.5-128.9 -65.2 134.3 16.9 54.6 83.7 7 22 A S - 0 0 9 138,-3.0 2,-0.4 -2,-0.1 -1,-0.1 -0.351 19.2-110.9 -80.1 164.1 19.6 55.9 86.1 8 23 A V > - 0 0 92 1,-0.1 3,-2.4 -2,-0.1 4,-0.4 -0.796 44.2 -93.0 -95.5 140.4 21.8 53.5 88.1 9 24 A R T 3 S+ 0 0 149 -2,-0.4 -1,-0.1 1,-0.3 53,-0.1 -0.225 111.5 8.9 -51.7 137.2 21.3 53.7 91.9 10 25 A G T 3 S+ 0 0 39 98,-0.2 -1,-0.3 2,-0.1 52,-0.0 0.469 93.5 117.0 69.7 2.3 23.7 56.1 93.5 11 26 A E S < S+ 0 0 64 -3,-2.4 -2,-0.1 1,-0.3 -1,-0.1 0.778 85.8 30.9 -71.2 -27.3 24.8 57.4 90.1 12 27 A W S > S+ 0 0 10 -4,-0.4 3,-2.6 1,-0.1 -1,-0.3 -0.463 73.4 167.0-130.0 60.3 23.4 60.9 90.9 13 28 A P T 3 S+ 0 0 11 0, 0.0 97,-0.8 0, 0.0 47,-0.3 0.549 73.3 59.1 -51.5 -15.3 23.9 61.1 94.7 14 29 A W T 3 S+ 0 0 2 95,-0.2 19,-2.5 97,-0.1 2,-0.3 0.591 83.5 102.3 -92.6 -11.6 23.3 64.8 94.8 15 30 A Q E < -J 32 0C 4 -3,-2.6 46,-0.5 17,-0.2 45,-0.5 -0.558 49.9-177.5 -76.8 129.4 19.8 64.5 93.3 16 31 A V E -J 31 0C 1 15,-2.5 15,-1.3 -2,-0.3 2,-0.6 -0.876 24.7-131.6-123.6 157.4 16.9 64.7 95.6 17 32 A T E -JK 30 58C 0 41,-2.1 41,-2.0 -2,-0.3 2,-0.6 -0.961 21.6-150.7-110.0 117.3 13.1 64.4 95.0 18 33 A L E -JK 29 57C 2 11,-3.5 10,-3.6 -2,-0.6 11,-1.9 -0.813 17.8-170.2 -93.0 120.8 11.2 67.3 96.6 19 34 A H E -JK 27 56C 7 37,-3.2 37,-2.1 -2,-0.6 2,-0.4 -0.745 16.2-150.5-110.7 157.8 7.7 66.4 97.6 20 35 A T E -JK 26 55C 6 6,-2.3 6,-2.0 -2,-0.3 35,-0.2 -0.941 6.8-153.1-120.6 146.4 4.7 68.3 98.8 21 36 A T + 0 0 42 33,-1.9 4,-0.3 -2,-0.4 34,-0.1 0.457 51.6 130.4 -97.3 -2.0 2.1 66.7 101.2 22 37 A S S S- 0 0 64 32,-0.2 2,-0.1 2,-0.2 4,-0.1 -0.892 85.2 -10.8-110.5 131.2 -0.8 68.9 100.0 23 37AA P S S- 0 0 116 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.904 146.1 -21.5 -74.0 -32.4 -3.4 67.9 99.3 24 37BA T S S- 0 0 106 -2,-0.1 -2,-0.2 -4,-0.1 -4,-0.1 -0.965 90.2 -77.1-133.6 149.6 -1.9 64.4 99.3 25 37CA Q + 0 0 71 -4,-0.3 2,-0.3 -2,-0.3 -4,-0.2 -0.103 61.9 147.7 -52.0 139.4 1.8 63.6 99.0 26 37DA R E -J 20 0C 127 -6,-2.0 -6,-2.3 -4,-0.1 2,-0.2 -0.971 52.9 -85.4-166.5 155.7 3.5 63.8 95.6 27 38 A H E +J 19 0C 12 -2,-0.3 -8,-0.3 -8,-0.2 114,-0.1 -0.480 43.0 171.6 -66.0 136.8 6.7 64.6 93.8 28 39 A L E - 0 0 34 -10,-3.6 2,-0.3 1,-0.4 -9,-0.2 0.740 54.2 -19.8-114.5 -46.2 6.9 68.3 93.2 29 40 A a E -J 18 0C 5 -11,-1.9 -11,-3.5 158,-0.1 -1,-0.4 -0.976 57.1-107.0-159.2 168.3 10.4 69.1 91.9 30 41 A G E +J 17 0C 1 158,-3.1 12,-0.4 -2,-0.3 2,-0.3 -0.535 36.1 176.5 -96.2 167.6 14.0 67.9 91.7 31 42 A G E -J 16 0C 0 -15,-1.3 -15,-2.5 -2,-0.2 2,-0.4 -0.977 22.8-123.7-163.3 167.5 16.9 69.5 93.7 32 43 A S E -JL 15 40C 1 8,-2.5 8,-3.2 -2,-0.3 2,-0.4 -0.980 19.1-127.7-127.9 133.7 20.6 69.1 94.4 33 44 A I E + L 0 39C 1 -19,-2.5 79,-2.0 -2,-0.4 6,-0.2 -0.624 37.2 159.6 -74.8 124.3 22.4 68.7 97.7 34 45 A I E + 0 0 30 4,-2.6 2,-0.3 -2,-0.4 5,-0.2 0.453 64.5 15.8-123.7 -6.6 25.1 71.4 97.8 35 46 A G E > S- L 0 38C 15 3,-1.3 3,-1.8 75,-0.0 -1,-0.4 -0.980 87.1 -93.9-160.4 159.6 25.7 71.4 101.6 36 47 A N T 3 S+ 0 0 72 -2,-0.3 67,-3.1 1,-0.3 3,-0.0 0.666 129.5 20.2 -53.2 -15.2 25.0 69.3 104.7 37 48 A Q T 3 S+ 0 0 54 65,-0.2 62,-2.0 1,-0.0 2,-0.4 0.174 112.0 90.5-139.4 16.6 21.9 71.4 105.2 38 51 A W E < -LM 35 98C 35 -3,-1.8 -4,-2.6 60,-0.2 -3,-1.3 -0.958 42.7-174.8-131.1 133.7 21.3 72.9 101.8 39 52 A I E -LM 33 97C 4 58,-1.8 58,-2.1 -2,-0.4 2,-0.5 -0.953 16.4-150.2-116.6 132.8 19.3 71.9 98.7 40 53 A L E +LM 32 96C 1 -8,-3.2 -8,-2.5 -2,-0.4 2,-0.2 -0.912 35.1 141.5-104.9 131.1 19.6 74.1 95.5 41 54 A T E - M 0 95C 0 54,-2.4 54,-2.5 -2,-0.5 2,-0.3 -0.791 50.6 -65.0-149.3-170.6 16.5 74.1 93.3 42 55 A A > - 0 0 0 -12,-0.4 3,-1.0 52,-0.2 52,-0.2 -0.687 29.4-140.2 -92.7 143.4 14.3 76.3 91.1 43 56 A A G > S+ 0 0 3 -2,-0.3 3,-1.6 1,-0.2 -1,-0.1 0.823 99.1 64.0 -68.6 -32.4 12.3 79.2 92.5 44 57 A H G > S+ 0 0 48 1,-0.3 3,-1.2 2,-0.1 -1,-0.2 0.627 84.0 79.3 -69.3 -9.9 9.2 78.5 90.3 45 58 A a G < S+ 0 0 7 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.727 87.9 57.9 -67.6 -19.1 8.8 75.2 92.1 46 59 A F G X + 0 0 18 -3,-1.6 3,-1.8 -4,-0.2 -1,-0.2 0.107 66.7 142.5-105.8 29.2 7.2 77.0 95.0 47 59AA Y T < S+ 0 0 210 -3,-1.2 3,-0.1 1,-0.3 -3,-0.0 -0.471 83.9 5.2 -64.9 127.5 4.3 78.7 93.3 48 59BA G T 3 S+ 0 0 64 -2,-0.2 2,-1.1 1,-0.2 -1,-0.3 0.398 93.2 131.8 79.1 -6.3 1.5 78.5 95.7 49 59CA V < + 0 0 29 -3,-1.8 -1,-0.2 1,-0.2 -3,-0.0 -0.708 26.8 174.2 -83.7 103.8 3.6 77.0 98.5 50 60 A E + 0 0 195 -2,-1.1 -1,-0.2 1,-0.2 -2,-0.0 0.670 63.7 28.2 -83.5 -18.0 2.7 79.2 101.5 51 61 A S > - 0 0 36 1,-0.1 3,-1.2 27,-0.0 -1,-0.2 -0.998 63.5-137.2-148.3 141.1 4.7 77.3 104.1 52 62 A P G > S+ 0 0 32 0, 0.0 3,-1.2 0, 0.0 24,-0.6 0.589 92.6 86.3 -69.9 -8.2 7.8 75.0 104.2 53 63 A K G 3 S+ 0 0 176 1,-0.3 24,-0.0 22,-0.1 25,-0.0 0.724 84.5 52.0 -64.7 -25.8 5.8 72.7 106.4 54 64 A I G < S+ 0 0 47 -3,-1.2 -33,-1.9 -34,-0.1 2,-0.3 0.492 93.1 97.1 -89.5 -4.6 4.2 70.8 103.5 55 65 A L E < -K 20 0C 3 -3,-1.2 21,-0.6 -35,-0.2 2,-0.4 -0.614 48.8-177.7 -89.1 146.0 7.6 70.2 101.9 56 66 A R E -KN 19 75C 63 -37,-2.1 -37,-3.2 -2,-0.3 2,-0.5 -0.983 11.8-153.6-142.9 127.9 9.6 67.0 102.3 57 67 A V E -KN 18 74C 1 17,-2.7 17,-3.0 -2,-0.4 2,-0.5 -0.903 7.8-166.2-107.5 128.3 13.0 66.3 100.8 58 68 A Y E -K 17 0C 2 -41,-2.0 -41,-2.1 -2,-0.5 3,-0.3 -0.957 7.0-170.3-115.6 123.5 14.1 62.7 100.0 59 69 A S + 0 0 15 -2,-0.5 -43,-0.1 -43,-0.2 50,-0.1 -0.637 63.9 30.9-107.2 167.0 17.7 61.9 99.3 60 70 A G S S+ 0 0 24 -45,-0.5 2,-0.4 48,-0.4 -1,-0.2 0.848 84.5 149.7 56.2 36.6 19.4 58.7 98.0 61 71 A I + 0 0 19 -46,-0.5 -1,-0.2 -3,-0.3 3,-0.1 -0.846 24.4 162.5-105.5 136.1 16.3 57.9 96.0 62 72 A L S S+ 0 0 16 1,-0.4 83,-1.7 -2,-0.4 2,-0.4 0.729 73.0 30.5-109.5 -61.6 16.2 55.9 92.7 63 73 A N B > -P 144 0D 30 81,-0.2 3,-2.2 1,-0.1 -1,-0.4 -0.833 69.4-136.6-104.7 139.4 12.6 54.8 92.4 64 74 A Q G > S+ 0 0 31 79,-2.1 3,-1.9 -2,-0.4 -1,-0.1 0.748 103.2 74.5 -62.0 -21.8 9.6 56.8 93.8 65 75 A A G 3 S+ 0 0 79 1,-0.3 -1,-0.3 78,-0.1 79,-0.1 0.703 82.4 68.1 -64.0 -18.5 8.4 53.4 95.0 66 76 A E G < S+ 0 0 66 -3,-2.2 2,-0.7 1,-0.1 -1,-0.3 0.709 85.7 87.0 -72.0 -19.6 11.1 53.6 97.7 67 77 A I < + 0 0 26 -3,-1.9 2,-0.2 -4,-0.3 -1,-0.1 -0.746 54.1 146.7 -91.9 113.6 9.0 56.4 99.2 68 78 A A > - 0 0 47 -2,-0.7 3,-1.8 4,-0.1 -2,-0.0 -0.750 64.6 -88.2-131.7 178.3 6.3 55.4 101.6 69 79 A E T 3 S+ 0 0 193 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 0.798 127.6 50.5 -62.2 -26.2 4.7 56.8 104.7 70 80 A D T 3 S+ 0 0 144 2,-0.1 2,-0.4 0, 0.0 -1,-0.3 0.255 85.8 113.0 -95.4 12.0 7.4 55.0 106.8 71 81 A T S < S- 0 0 30 -3,-1.8 -4,-0.1 1,-0.1 2,-0.0 -0.709 71.3-115.4 -89.1 133.9 10.3 56.4 104.8 72 81AA S + 0 0 110 -2,-0.4 2,-0.3 -14,-0.0 -1,-0.1 -0.350 41.7 172.2 -66.7 145.3 12.7 58.9 106.4 73 82 A F - 0 0 81 -15,-0.1 2,-0.5 -2,-0.0 -15,-0.2 -0.954 33.7-109.5-149.1 163.9 12.8 62.4 105.0 74 83 A F E -N 57 0C 30 -17,-3.0 -17,-2.7 -2,-0.3 2,-0.1 -0.868 30.2-139.6-101.6 127.9 14.3 65.8 105.6 75 84 A G E -N 56 0C 8 -2,-0.5 25,-2.4 -19,-0.2 2,-0.6 -0.447 20.0-116.6 -79.6 159.9 11.9 68.5 106.7 76 85 A V E -O 99 0C 4 -21,-0.6 23,-0.2 -24,-0.6 -21,-0.2 -0.886 26.9-178.5-103.4 118.8 12.3 72.1 105.2 77 86 A Q E S+ 0 0 89 21,-2.6 2,-0.3 -2,-0.6 22,-0.2 0.802 71.2 4.5 -81.9 -32.8 13.1 74.7 107.8 78 87 A E E -O 98 0C 85 20,-1.5 20,-2.6 -26,-0.1 2,-0.5 -0.979 56.4-144.8-158.2 141.5 13.2 77.6 105.3 79 88 A I E -O 97 0C 39 -2,-0.3 2,-0.6 18,-0.2 18,-0.2 -0.931 19.2-165.1-106.5 124.0 12.6 78.4 101.7 80 89 A I E -O 96 0C 16 16,-3.7 16,-3.3 -2,-0.5 2,-0.4 -0.905 6.5-176.1-117.6 107.1 14.9 81.0 100.3 81 90 A I E -O 95 0C 59 -2,-0.6 14,-0.2 14,-0.2 12,-0.1 -0.812 37.7-102.8-100.0 137.6 13.9 82.5 96.9 82 91 A H > - 0 0 12 12,-1.8 3,-1.3 -2,-0.4 12,-0.1 -0.354 30.9-130.5 -55.5 133.6 16.2 85.0 95.1 83 92 A D T 3 S+ 0 0 135 1,-0.2 -1,-0.2 3,-0.0 -2,-0.0 0.575 103.6 53.9 -69.1 -7.4 14.6 88.4 95.7 84 93 A Q T 3 S+ 0 0 105 8,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.513 81.1 113.5-101.7 -7.7 14.7 89.4 92.0 85 94 A Y < + 0 0 53 -3,-1.3 7,-0.1 7,-0.2 3,-0.1 -0.421 22.6 153.2 -67.2 136.5 12.9 86.3 90.8 86 95 A K S S- 0 0 173 5,-0.5 2,-0.3 1,-0.4 -1,-0.2 0.534 71.2 -14.8-127.1 -43.3 9.4 86.9 89.3 87 96 A M >> - 0 0 95 4,-0.4 3,-2.5 1,-0.1 4,-0.6 -0.962 65.0-105.4-165.7 148.5 9.1 84.0 86.9 88 97 A A G >4 S+ 0 0 13 -2,-0.3 3,-1.7 1,-0.3 5,-0.3 0.840 115.5 54.2 -41.9 -52.6 11.3 81.3 85.4 89 98 A E G 34 S+ 0 0 95 1,-0.3 77,-0.4 118,-0.1 -1,-0.3 0.572 105.5 55.7 -66.2 -8.5 11.4 82.8 81.9 90 99 A S G <4 S- 0 0 72 -3,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.510 111.1-121.3 -99.1 -8.2 12.7 86.1 83.3 91 100 A G S << S+ 0 0 6 -3,-1.7 -5,-0.5 -4,-0.6 -4,-0.4 -0.474 83.6 95.6 98.7-173.2 15.6 84.5 85.0 92 101 A Y + 0 0 53 1,-0.2 2,-2.2 78,-0.2 -10,-0.3 0.756 48.1 157.2 57.1 25.1 16.7 84.4 88.7 93 102 A D + 0 0 0 -5,-0.3 2,-0.3 -6,-0.1 -1,-0.2 -0.482 29.1 117.0 -82.1 71.8 14.9 81.0 88.9 94 103 A I + 0 0 0 -2,-2.2 -12,-1.8 -52,-0.2 2,-0.3 -1.000 35.4 173.4-143.2 139.7 16.9 79.9 91.9 95 104 A A E -MO 41 81C 0 -54,-2.5 -54,-2.4 -2,-0.3 2,-0.4 -0.986 19.1-141.4-145.7 154.2 16.0 78.9 95.4 96 105 A L E -MO 40 80C 0 -16,-3.3 -16,-3.7 -2,-0.3 2,-0.5 -0.926 7.3-155.9-118.6 141.8 17.6 77.5 98.5 97 106 A L E -MO 39 79C 1 -58,-2.1 -58,-1.8 -2,-0.4 2,-0.7 -0.976 6.2-155.2-118.0 118.3 16.1 75.0 100.9 98 107 A K E -MO 38 78C 53 -20,-2.6 -21,-2.6 -2,-0.5 -20,-1.5 -0.857 21.1-137.4 -94.1 116.4 17.5 75.0 104.5 99 108 A L E - 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