==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 10-JUL-06 2IXQ . COMPND 2 MOLECULE: PROTEIN AFAD; . SOURCE 2 SYNTHETIC: YES; . AUTHOR E.COTA,C.JONES,P.SIMPSON,H.ALTROFF,K.L.ANDERSON,L.DU MERLE, . 285 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14883.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 154 54.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 26.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 2 0.7 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 . 42 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 0 0 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 . 6 6 5 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 2 0 0 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 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 1 A S 0 0 112 0, 0.0 2,-2.5 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 131.9 -37.0 -12.1 -2.1 2 2 A A - 0 0 15 1,-0.2 26,-0.4 114,-0.2 116,-0.1 -0.408 360.0-168.5 68.9 -73.1 -34.6 -9.2 -1.5 3 3 A E + 0 0 117 -2,-2.5 2,-0.5 1,-0.2 -1,-0.2 0.978 11.9 176.6 52.1 74.8 -32.3 -10.2 -4.3 4 4 A L + 0 0 29 -3,-0.2 2,-0.4 130,-0.1 -1,-0.2 -0.922 6.6 176.6-112.2 129.6 -29.3 -8.0 -3.7 5 5 A H B -A 26 0A 126 21,-1.3 21,-2.4 -2,-0.5 2,-0.2 -0.998 9.7-159.7-135.1 133.8 -26.1 -8.2 -5.7 6 6 A L - 0 0 23 -2,-0.4 2,-0.3 19,-0.2 19,-0.2 -0.649 6.1-173.3-108.2 166.5 -23.0 -6.0 -5.5 7 7 A E - 0 0 111 -2,-0.2 17,-3.1 130,-0.0 2,-0.3 -0.979 13.2-141.5-157.4 142.7 -20.2 -5.4 -8.0 8 8 A S B -C 23 0B 44 -2,-0.3 15,-0.2 15,-0.2 14,-0.0 -0.824 13.5-139.2-109.7 150.4 -17.0 -3.5 -7.8 9 9 A R S S- 0 0 137 13,-1.3 14,-0.1 -2,-0.3 -1,-0.1 0.367 89.9 -34.9 -87.0 4.5 -15.4 -1.4 -10.5 10 10 A G S S- 0 0 60 12,-0.4 -2,-0.1 3,-0.0 3,-0.1 -0.185 76.4-106.5 174.6 -65.5 -12.1 -2.8 -9.7 11 11 A G S S- 0 0 21 1,-0.3 129,-0.4 11,-0.2 2,-0.2 0.407 76.2 -18.8 134.3 -14.2 -11.3 -3.7 -6.2 12 12 A S - 0 0 28 127,-0.2 -1,-0.3 96,-0.1 2,-0.2 -0.828 46.1-171.7-178.4-143.6 -8.9 -1.3 -4.9 13 13 A G - 0 0 36 -2,-0.2 3,-0.1 127,-0.1 91,-0.1 -0.629 24.7-134.5 141.2 160.2 -6.6 1.2 -5.6 14 14 A T S S+ 0 0 59 1,-0.2 90,-1.3 -2,-0.2 2,-0.6 0.720 93.4 54.6-116.6 -30.2 -4.2 3.2 -3.7 15 15 A Q + 0 0 135 88,-0.2 2,-0.7 -3,-0.0 88,-0.2 -0.683 67.7 174.2-112.9 78.7 -4.8 6.7 -5.1 16 16 A L - 0 0 15 -2,-0.6 86,-0.8 86,-0.3 85,-0.4 -0.798 9.7-166.2 -95.1 116.5 -8.3 7.4 -4.6 17 17 A R > - 0 0 151 -2,-0.7 3,-1.1 83,-0.2 83,-0.8 -0.351 36.8 -75.6 -91.0 176.0 -9.5 10.8 -5.4 18 18 A D E 3 S+D 99 0C 74 81,-0.3 81,-0.3 1,-0.2 -1,-0.1 -0.506 117.3 25.2 -73.7 139.9 -12.7 12.5 -4.6 19 19 A G E 3 S+ 0 0 36 79,-1.0 2,-0.4 1,-0.3 -1,-0.2 0.606 87.0 138.5 82.3 12.1 -15.6 11.3 -6.6 20 20 A A E < -D 98 0C 28 78,-1.6 78,-3.6 -3,-1.1 -1,-0.3 -0.742 48.4-129.5 -91.0 133.2 -14.1 8.0 -7.4 21 21 A K E +D 97 0C 84 -2,-0.4 76,-0.2 76,-0.3 3,-0.1 -0.357 27.5 173.4 -78.2 160.1 -16.3 5.0 -7.3 22 22 A V + 0 0 4 74,-1.1 -13,-1.3 1,-0.4 -12,-0.4 0.572 65.4 16.8-131.7 -53.6 -15.6 1.9 -5.4 23 23 A A B -C 8 0B 2 73,-0.4 73,-1.5 -15,-0.2 -1,-0.4 -0.916 52.4-174.1-126.7 153.9 -18.6 -0.3 -5.5 24 24 A T + 0 0 36 -17,-3.1 71,-0.2 -2,-0.3 2,-0.1 -0.691 18.4 160.8-148.1 87.7 -21.6 -0.4 -7.7 25 25 A G - 0 0 0 69,-0.5 69,-1.9 -2,-0.2 2,-0.4 -0.375 30.5-118.5-101.0-176.0 -24.4 -2.7 -7.0 26 26 A R E -AB 5 93A 73 -21,-2.4 -21,-1.3 67,-0.2 2,-0.3 -0.970 17.1-162.6-131.3 144.5 -28.0 -3.0 -7.8 27 27 A I E - B 0 92A 0 65,-2.7 65,-1.5 -2,-0.4 2,-0.3 -0.826 7.3-156.5-120.2 159.3 -31.1 -3.1 -5.7 28 28 A I E - B 0 91A 25 -26,-0.4 90,-0.3 -2,-0.3 2,-0.3 -0.814 4.6-166.1-130.7 169.4 -34.6 -4.2 -6.6 29 29 A a - 0 0 8 61,-1.4 88,-0.1 -2,-0.3 3,-0.1 -0.912 13.4-142.0-148.2 172.3 -38.1 -3.6 -5.4 30 30 A R - 0 0 140 -2,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.731 67.8 -1.1-106.7 -86.8 -41.5 -5.1 -5.8 31 31 A E S S- 0 0 116 1,-0.2 -1,-0.2 96,-0.1 2,-0.1 -0.128 105.9 -34.7 -96.6-165.1 -44.5 -2.9 -6.0 32 32 A A S S+ 0 0 81 92,-0.1 2,-0.3 -3,-0.1 -1,-0.2 -0.299 73.5 153.3 -56.2 124.4 -45.0 0.9 -5.9 33 33 A H - 0 0 26 54,-0.7 3,-0.1 -3,-0.1 85,-0.1 -0.938 42.5-150.4-147.4 166.8 -42.5 2.4 -3.6 34 34 A T S S+ 0 0 107 -2,-0.3 2,-0.3 1,-0.2 54,-0.1 0.256 79.9 54.3-125.9 9.8 -40.7 5.7 -3.1 35 35 A G - 0 0 8 51,-0.3 2,-1.5 52,-0.2 -1,-0.2 -0.870 59.2-152.4-155.2 117.2 -37.6 4.5 -1.5 36 36 A F E -G 85 0D 0 49,-2.5 49,-0.5 -2,-0.3 2,-0.3 -0.663 31.4-141.3 -83.5 84.7 -34.9 1.9 -2.4 37 37 A H E +G 84 0D 35 -2,-1.5 79,-1.1 80,-0.2 80,-1.0 -0.319 35.2 162.4 -52.3 109.1 -33.8 1.0 1.1 38 38 A V E -GH 83 115D 3 45,-1.3 45,-1.4 -2,-0.3 2,-0.3 -0.972 13.6-177.1-133.4 146.7 -30.0 0.6 1.0 39 39 A W E - H 0 114D 10 75,-1.3 75,-1.3 -2,-0.3 43,-0.2 -0.871 22.4-159.8-137.0 170.0 -27.3 0.5 3.7 40 40 A M - 0 0 2 40,-0.8 72,-2.0 -2,-0.3 41,-0.1 0.686 25.2-148.9-119.1 -41.9 -23.6 0.2 4.0 41 41 A N + 0 0 62 39,-1.1 71,-0.4 70,-0.1 40,-0.1 0.995 57.6 100.9 64.5 81.5 -23.0 -0.9 7.6 42 42 A E S S- 0 0 27 38,-0.2 12,-0.1 69,-0.1 39,-0.1 0.151 90.3 -36.7-148.8 -85.8 -19.7 0.6 8.6 43 43 A R - 0 0 122 37,-0.1 10,-0.2 12,-0.0 2,-0.1 -0.479 60.9-177.4-159.2 78.1 -19.4 3.7 10.7 44 44 A Q - 0 0 36 8,-0.1 2,-1.2 1,-0.1 8,-0.1 -0.409 32.4-117.1 -79.9 154.6 -22.0 6.3 10.1 45 45 A V > - 0 0 66 6,-0.2 3,-1.0 -2,-0.1 2,-0.2 -0.719 61.7 -77.4 -95.2 86.8 -22.1 9.7 11.8 46 46 A D T 3 S- 0 0 131 -2,-1.2 -2,-0.1 1,-0.2 -1,-0.0 -0.347 114.0 -1.5 59.2-122.7 -25.4 9.6 13.7 47 47 A G T 3 S+ 0 0 52 -2,-0.2 2,-0.6 34,-0.1 -1,-0.2 0.146 90.8 138.4 -84.7 20.5 -28.2 10.2 11.4 48 48 A R < + 0 0 100 -3,-1.0 34,-0.2 1,-0.1 3,-0.2 -0.558 20.6 167.1 -70.5 110.1 -26.1 10.7 8.4 49 49 A A + 0 0 5 -2,-0.6 2,-0.3 1,-0.1 -1,-0.1 0.650 62.5 39.1-103.8 -32.8 -27.8 9.0 5.7 50 50 A E S S+ 0 0 55 1,-0.2 -1,-0.1 32,-0.1 2,-0.1 0.082 121.5 17.7-111.0 44.8 -26.5 9.9 2.6 51 51 A R + 0 0 78 -2,-0.3 2,-0.3 -3,-0.2 -1,-0.2 -0.444 62.8 164.0 152.9 129.7 -22.9 10.1 3.1 52 52 A Y E -E 65 0C 5 13,-0.9 13,-0.8 -2,-0.1 2,-0.6 -0.972 40.6-110.4-160.8 138.4 -20.8 8.8 5.9 53 53 A V E -E 64 0C 35 -2,-0.3 11,-0.3 11,-0.2 2,-0.0 -0.676 39.4-155.8 -78.5 105.4 -17.2 8.1 6.4 54 54 A V E -E 63 0C 2 9,-1.7 9,-2.7 -2,-0.6 2,-0.3 -0.239 3.8-133.8 -79.9 170.4 -16.6 4.4 6.4 55 55 A Q E -E 62 0C 84 7,-0.3 7,-0.2 55,-0.2 55,-0.2 -0.788 20.2-104.0-122.1 164.8 -13.8 2.6 8.0 56 56 A S - 0 0 8 5,-1.4 53,-0.3 -2,-0.3 3,-0.3 -0.262 38.4 -99.4 -80.2 172.8 -11.5 -0.2 6.9 57 57 A K S S+ 0 0 125 51,-3.2 52,-0.1 1,-0.1 -1,-0.1 0.899 122.8 39.6 -64.2 -40.8 -11.8 -3.8 8.0 58 58 A D S S- 0 0 97 50,-0.5 -1,-0.1 3,-0.0 51,-0.0 0.397 110.1-116.9 -88.9 0.7 -9.0 -3.4 10.5 59 59 A G S S+ 0 0 49 -3,-0.3 3,-0.1 2,-0.1 -2,-0.1 0.953 86.3 93.3 58.2 79.3 -9.9 -0.0 11.8 60 60 A R S S+ 0 0 134 1,-0.3 2,-0.4 0, 0.0 -1,-0.1 0.345 75.0 59.3-161.7 -13.2 -7.0 2.2 11.0 61 61 A H - 0 0 37 47,-0.1 -5,-1.4 43,-0.0 2,-0.4 -0.993 64.5-153.0-132.5 128.4 -8.0 3.8 7.7 62 62 A E E -E 55 0C 134 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.3 -0.786 7.5-169.7-100.9 142.7 -11.1 5.9 7.0 63 63 A L E -E 54 0C 2 -9,-2.7 -9,-1.7 -2,-0.4 2,-0.2 -0.902 12.3-147.9-135.3 105.5 -12.7 6.1 3.7 64 64 A R E -E 53 0C 101 -2,-0.4 35,-1.3 -11,-0.3 2,-0.4 -0.514 18.4-167.8 -70.8 135.6 -15.4 8.7 3.0 65 65 A V E -EF 52 98C 2 -13,-0.8 2,-1.1 33,-0.3 -13,-0.9 -0.988 21.7-149.5-131.5 129.4 -17.9 7.5 0.5 66 66 A R E + F 0 97C 113 31,-4.1 31,-1.2 -2,-0.4 3,-0.3 -0.598 45.9 138.6 -93.6 69.7 -20.6 9.5 -1.3 67 67 A T + 0 0 6 -2,-1.1 -1,-0.2 29,-0.3 -16,-0.1 0.783 43.5 86.1 -87.0 -30.4 -23.1 6.8 -1.7 68 68 A G S S- 0 0 3 -3,-0.3 4,-0.2 -18,-0.1 -1,-0.2 0.404 81.3-128.6 -49.0 -19.8 -26.0 8.6 -0.9 69 69 A G - 0 0 24 -3,-0.3 2,-2.8 26,-0.2 -1,-0.1 0.253 14.6-102.0 99.4 -3.8 -27.0 10.0 -3.5 70 70 A D S S+ 0 0 156 1,-0.2 -1,-0.1 -20,-0.1 -2,-0.0 -0.250 118.2 26.3 67.5 -57.4 -27.9 12.8 -4.8 71 71 A G S S+ 0 0 40 -2,-2.8 -1,-0.2 2,-0.1 2,-0.2 0.036 87.2 118.1-125.5 39.0 -31.3 12.0 -4.6 72 72 A W - 0 0 25 -4,-0.2 13,-0.3 13,-0.2 -22,-0.1 -0.468 51.9-131.0 -99.4 174.5 -31.9 9.6 -2.0 73 73 A S B -I 84 0D 55 11,-1.6 11,-2.8 -2,-0.2 2,-1.4 -0.990 15.9-123.6-133.9 127.1 -34.1 10.0 1.0 74 74 A P + 0 0 83 0, 0.0 9,-0.2 0, 0.0 2,-0.2 -0.535 50.2 146.9 -71.3 91.7 -33.2 9.2 4.6 75 75 A V - 0 0 69 -2,-1.4 8,-0.1 1,-0.5 -38,-0.0 -0.490 64.4 -76.6-127.3 63.1 -35.9 6.8 5.6 76 76 A K - 0 0 144 -2,-0.2 -1,-0.5 6,-0.1 2,-0.3 0.175 48.7-147.3 67.0 171.8 -34.3 4.4 8.0 77 77 A G - 0 0 28 -3,-0.1 2,-0.4 -40,-0.1 4,-0.2 -0.994 12.7-112.9-162.3 168.1 -32.1 1.6 7.2 78 78 A E S S- 0 0 98 3,-0.4 2,-1.6 -2,-0.3 -37,-0.1 -0.894 87.1 -1.5-112.4 135.6 -31.2 -1.8 8.3 79 79 A G S S+ 0 0 46 -2,-0.4 3,-0.1 1,-0.1 2,-0.1 -0.425 138.5 6.9 82.7 -65.5 -28.0 -2.6 9.7 80 80 A G S S- 0 0 7 -2,-1.6 -39,-1.1 1,-0.7 -40,-0.8 -0.500 108.4 -81.5-151.3 71.6 -26.2 0.5 9.6 81 81 A K + 0 0 90 -4,-0.2 -1,-0.7 -42,-0.1 -3,-0.4 -0.089 58.7 162.5 58.7-159.8 -28.2 3.4 8.4 82 82 A G - 0 0 3 -34,-0.2 2,-0.3 -43,-0.2 -43,-0.2 -0.739 26.7-111.9 137.1 177.3 -28.8 3.9 4.8 83 83 A V E -G 38 0D 2 -45,-1.4 -45,-1.3 -2,-0.2 2,-0.4 -0.946 11.0-132.7-143.5 159.5 -31.1 5.7 2.5 84 84 A S E -GI 37 73D 0 -11,-2.8 -11,-1.6 -2,-0.3 -47,-0.2 -0.970 14.7-163.5-122.6 121.9 -33.8 5.1 0.0 85 85 A R E -G 36 0D 68 -49,-0.5 -49,-2.5 -2,-0.4 -13,-0.2 -0.552 55.7 -53.0 -95.9 164.3 -34.1 6.6 -3.4 86 86 A P > - 0 0 63 0, 0.0 2,-0.9 0, 0.0 3,-0.6 -0.098 53.7-160.3 -40.2 105.3 -37.2 6.8 -5.6 87 87 A G T 3 + 0 0 0 1,-0.2 -54,-0.7 -3,-0.1 -52,-0.2 -0.272 55.5 114.0 -90.8 49.9 -38.3 3.2 -5.6 88 88 A Q T 3 + 0 0 151 -2,-0.9 -1,-0.2 -56,-0.2 2,-0.1 0.630 64.4 73.6 -90.9 -17.6 -40.5 3.3 -8.6 89 89 A E S < S- 0 0 110 -3,-0.6 3,-0.2 1,-0.1 -56,-0.1 -0.425 78.9-131.2 -89.3 168.1 -38.2 1.1 -10.6 90 90 A E S S+ 0 0 133 1,-0.3 -61,-1.4 -62,-0.1 2,-0.3 0.715 92.0 9.6 -94.3 -25.5 -37.7 -2.6 -10.2 91 91 A Q E +B 28 0A 91 -63,-0.2 -1,-0.3 2,-0.0 2,-0.3 -0.842 69.4 169.6-159.5 116.3 -34.0 -2.6 -10.2 92 92 A V E -B 27 0A 18 -65,-1.5 -65,-2.7 -2,-0.3 2,-0.4 -0.818 25.9-125.8-124.3 166.4 -31.6 0.4 -10.0 93 93 A F E -B 26 0A 109 -2,-0.3 2,-0.4 -67,-0.2 -67,-0.2 -0.829 15.8-167.7-111.4 147.2 -27.9 0.8 -9.4 94 94 A F - 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