==== 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 CELL ADHESION 06-MAR-07 2P26 . COMPND 2 MOLECULE: INTEGRIN BETA-2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SHI,S.Y.FOO,S.M.TAN,E.P.MITCHELL,S.K.A.LAW,J.LESCAR . 280 1 13 13 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16020.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 57.9 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 . 68 24.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.4 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 31 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 4.3 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+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 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 RESIDUES PER ALPHA HELIX . 0 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 0 0 PARALLEL BRIDGES PER LADDER . 0 4 4 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 4 1 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 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 Q 0 0 116 0, 0.0 20,-0.1 0, 0.0 40,-0.0 0.000 360.0 360.0 360.0 142.8 -20.4 -2.4 -22.1 2 2 A E + 0 0 156 18,-0.0 18,-0.5 16,-0.0 2,-0.5 0.501 360.0 157.1-118.0 151.0 -19.1 -0.2 -23.4 3 3 A a - 0 0 20 17,-0.2 2,-0.6 16,-0.1 39,-0.2 -0.945 14.3-172.2-127.9 111.3 -18.2 -0.5 -27.1 4 4 A T + 0 0 122 -2,-0.5 2,-0.3 13,-0.3 17,-0.1 -0.902 23.9 156.5 -98.8 121.6 -17.7 2.6 -29.3 5 5 A K - 0 0 63 -2,-0.6 2,-0.4 35,-0.1 9,-0.1 -0.971 29.6-155.8-144.7 157.3 -17.4 1.6 -33.0 6 6 A F S S- 0 0 166 -2,-0.3 -2,-0.0 0, 0.0 0, 0.0 -0.924 72.7 -36.5-141.5 110.2 -17.8 3.2 -36.4 7 7 A K S S- 0 0 155 -2,-0.4 29,-0.1 1,-0.2 31,-0.1 0.785 75.4-171.5 50.9 38.8 -18.5 1.2 -39.6 8 8 A V - 0 0 7 29,-0.2 31,-0.2 1,-0.1 -1,-0.2 -0.343 14.7-178.0 -61.8 138.7 -16.2 -1.7 -38.5 9 9 A S + 0 0 45 1,-0.1 2,-0.3 28,-0.1 -1,-0.1 0.300 59.4 38.9-126.3 7.9 -15.7 -4.3 -41.3 10 10 A S S > S- 0 0 31 1,-0.1 4,-1.5 27,-0.0 -1,-0.1 -0.978 77.3-114.0-153.0 161.0 -13.5 -6.9 -39.6 11 11 A b H > S+ 0 0 5 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.914 117.8 50.8 -62.6 -44.1 -13.0 -8.7 -36.3 12 12 A R H > S+ 0 0 85 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.915 107.3 52.9 -60.8 -45.2 -9.6 -7.1 -35.8 13 13 A E H 4 S+ 0 0 82 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.834 110.9 49.5 -56.6 -33.4 -11.1 -3.6 -36.5 14 14 A c H >< S+ 0 0 0 -4,-1.5 3,-1.2 2,-0.2 4,-0.4 0.937 110.0 48.2 -71.4 -47.6 -13.7 -4.4 -33.8 15 15 A I H >< S+ 0 0 0 -4,-2.5 3,-1.3 1,-0.3 6,-0.2 0.909 109.5 54.2 -59.9 -42.2 -11.1 -5.6 -31.2 16 16 A E T 3< S+ 0 0 87 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.634 92.9 74.8 -64.9 -16.5 -9.0 -2.4 -31.9 17 17 A S T < S- 0 0 45 -3,-1.2 -13,-0.3 -4,-0.4 -1,-0.2 0.693 115.6 -52.5 -74.4 -20.1 -12.1 -0.3 -31.1 18 18 A G X - 0 0 16 -3,-1.3 3,-1.8 -4,-0.4 -1,-0.3 -0.698 49.3 -92.0 154.1 155.4 -11.9 -0.9 -27.4 19 19 A P T 3 S+ 0 0 52 0, 0.0 -16,-0.1 0, 0.0 -1,-0.1 0.737 120.7 57.7 -61.9 -24.7 -11.6 -3.5 -24.6 20 20 A G T 3 S+ 0 0 22 -18,-0.5 23,-0.4 -3,-0.1 2,-0.3 0.527 87.9 100.4 -80.8 -7.1 -15.5 -3.6 -24.3 21 21 A a < + 0 0 0 -3,-1.8 2,-0.3 -6,-0.2 21,-0.2 -0.625 46.7 175.2 -87.4 135.9 -15.9 -4.5 -28.0 22 22 A T E -A 41 0A 0 19,-2.6 19,-2.6 -2,-0.3 2,-0.4 -0.924 20.4-132.1-134.9 161.0 -16.5 -8.1 -29.1 23 23 A W E -AB 40 57A 0 34,-2.3 34,-3.5 -2,-0.3 2,-0.7 -0.957 4.0-143.9-127.0 128.4 -17.2 -9.6 -32.5 24 24 A d E + B 0 56A 0 15,-2.5 32,-0.2 -2,-0.4 5,-0.1 -0.792 14.8 179.9 -91.0 116.2 -19.9 -12.1 -33.7 25 25 A Q + 0 0 11 30,-2.6 -1,-0.1 -2,-0.7 31,-0.1 0.363 34.0 138.8 -91.4 2.9 -18.6 -14.4 -36.3 26 26 A K > - 0 0 76 29,-0.3 3,-1.8 1,-0.1 4,-0.3 -0.238 61.8-110.2 -54.4 127.6 -22.0 -16.3 -36.6 27 27 A L T 3 S+ 0 0 79 1,-0.3 -1,-0.1 2,-0.1 181,-0.1 -0.368 100.7 4.9 -58.4 132.5 -23.0 -17.1 -40.2 28 28 A N T 3 S+ 0 0 101 179,-0.5 -1,-0.3 190,-0.2 -2,-0.1 0.656 84.5 140.9 64.6 18.9 -26.0 -14.9 -41.3 29 29 A F < + 0 0 17 -3,-1.8 2,-1.1 1,-0.2 -2,-0.1 0.845 58.1 69.7 -57.0 -37.5 -25.9 -12.9 -38.0 30 30 A T S S- 0 0 6 -4,-0.3 -1,-0.2 188,-0.1 3,-0.1 -0.733 77.6-166.8 -89.3 96.2 -26.7 -9.7 -39.9 31 31 A G > - 0 0 26 -2,-1.1 3,-2.2 1,-0.2 228,-0.1 -0.012 45.2 -39.2 -70.0-178.0 -30.3 -10.1 -41.1 32 32 A P T 3 S+ 0 0 30 0, 0.0 -1,-0.2 0, 0.0 227,-0.1 -0.164 131.4 12.3 -52.1 128.9 -32.0 -7.9 -43.7 33 33 A G T 3 S+ 0 0 18 1,-0.2 216,-0.1 -3,-0.1 -2,-0.1 0.154 98.2 118.1 91.3 -17.7 -31.1 -4.3 -43.4 34 34 A D < - 0 0 42 -3,-2.2 -1,-0.2 214,-0.1 2,-0.1 -0.748 54.2-144.4 -91.3 123.3 -28.2 -4.9 -41.0 35 35 A P > - 0 0 77 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.308 32.2 -98.6 -75.2 165.3 -24.7 -3.9 -42.1 36 36 A D G > S+ 0 0 58 1,-0.3 3,-2.1 2,-0.2 4,-0.2 0.784 115.8 71.0 -53.6 -34.4 -21.5 -5.8 -41.2 37 37 A S G > S+ 0 0 18 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.606 78.3 76.7 -65.5 -14.1 -20.7 -3.5 -38.3 38 38 A I G < S+ 0 0 46 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.750 81.6 71.2 -64.9 -23.3 -23.6 -4.8 -36.3 39 39 A R G < S+ 0 0 5 -3,-2.1 -15,-2.5 -4,-0.2 2,-0.7 0.695 86.6 76.6 -63.7 -20.0 -21.3 -7.8 -35.6 40 40 A c E < +A 23 0A 0 -3,-1.4 2,-0.3 -17,-0.2 -17,-0.2 -0.850 66.6 107.3-101.2 114.2 -19.2 -5.5 -33.4 41 41 A D E S-A 22 0A 33 -19,-2.6 -19,-2.6 -2,-0.7 -37,-0.1 -0.944 70.7 -58.2-164.2-179.9 -20.8 -4.8 -29.9 42 42 A T > - 0 0 1 -2,-0.3 4,-2.1 -21,-0.2 5,-0.2 -0.376 54.3-110.7 -67.6 154.4 -20.5 -5.6 -26.2 43 43 A R H > S+ 0 0 115 -23,-0.4 4,-2.5 1,-0.2 5,-0.2 0.920 117.1 51.7 -53.5 -49.8 -20.7 -9.2 -25.3 44 44 A P H > S+ 0 0 71 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.865 109.0 51.9 -58.7 -35.5 -24.2 -8.9 -23.6 45 45 A Q H > S+ 0 0 60 2,-0.2 4,-1.5 -3,-0.2 -2,-0.2 0.938 111.7 44.7 -64.9 -48.8 -25.6 -7.2 -26.7 46 46 A L H <>S+ 0 0 0 -4,-2.1 5,-2.9 2,-0.2 -1,-0.2 0.893 112.4 52.1 -62.5 -41.5 -24.4 -9.9 -29.0 47 47 A L H ><5S+ 0 0 94 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.911 109.7 49.6 -58.7 -44.2 -25.6 -12.7 -26.6 48 48 A M H 3<5S+ 0 0 133 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.799 107.8 54.3 -66.4 -30.9 -29.0 -11.0 -26.5 49 49 A R T 3<5S- 0 0 114 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.374 128.9 -97.8 -85.2 3.0 -29.0 -10.8 -30.4 50 50 A G T < 5 + 0 0 38 -3,-1.3 2,-0.5 1,-0.3 -3,-0.2 0.660 69.9 151.1 92.1 18.2 -28.4 -14.6 -30.4 51 51 A d < - 0 0 3 -5,-2.9 -1,-0.3 -8,-0.1 2,-0.1 -0.734 41.5-134.0 -77.6 124.6 -24.7 -14.9 -30.9 52 52 A A >> - 0 0 46 -2,-0.5 3,-2.0 1,-0.1 4,-0.7 -0.379 19.9-104.3 -79.8 160.3 -23.6 -18.1 -29.3 53 53 A A G >4 S+ 0 0 90 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.856 121.3 52.3 -49.8 -45.1 -20.6 -18.5 -27.0 54 54 A D G 34 S+ 0 0 97 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.569 109.8 52.2 -71.3 -7.2 -18.5 -20.2 -29.6 55 55 A D G <4 S+ 0 0 26 -3,-2.0 -30,-2.6 133,-0.1 2,-0.8 0.481 82.9 95.4-109.2 -5.7 -19.2 -17.3 -32.0 56 56 A I E << -B 24 0A 21 -3,-0.9 2,-0.6 -4,-0.7 -32,-0.2 -0.801 62.1-155.4 -88.9 112.7 -18.2 -14.4 -29.8 57 57 A M E +B 23 0A 17 -34,-3.5 -34,-2.3 -2,-0.8 129,-0.1 -0.807 32.6 146.9 -86.8 123.0 -14.6 -13.4 -30.6 58 58 A D - 0 0 39 -2,-0.6 -36,-0.1 -36,-0.2 -1,-0.1 -0.374 24.0-170.4-160.6 67.6 -13.1 -11.6 -27.6 59 59 A P - 0 0 25 0, 0.0 2,-0.3 0, 0.0 124,-0.1 -0.341 18.7-152.9 -66.6 153.2 -9.4 -12.2 -27.0 60 60 A T - 0 0 59 25,-0.0 2,-0.3 26,-0.0 24,-0.1 -0.858 19.3 -97.7-135.6 150.9 -8.3 -10.8 -23.7 61 61 A S + 0 0 13 -2,-0.3 2,-0.3 29,-0.1 24,-0.2 -0.570 55.1 162.5 -71.2 134.6 -5.2 -9.4 -22.0 62 62 A L E -C 84 0B 64 22,-2.5 22,-2.9 -2,-0.3 2,-0.4 -0.993 32.9-134.6-156.1 158.4 -3.4 -12.1 -19.9 63 63 A A E -C 83 0B 34 -2,-0.3 2,-0.4 29,-0.3 20,-0.2 -0.956 10.1-168.8-120.8 132.7 -0.2 -13.1 -18.2 64 64 A E E -C 82 0B 100 18,-3.0 18,-3.4 -2,-0.4 2,-0.3 -0.964 15.9-159.5-113.4 138.0 1.6 -16.5 -18.3 65 65 A T E -C 81 0B 76 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.907 10.6-173.1-123.8 148.2 4.5 -17.0 -15.8 66 66 A Q E -C 80 0B 143 14,-3.2 14,-2.4 -2,-0.3 13,-0.8 -0.996 9.0-155.1-136.6 140.3 7.5 -19.4 -15.7 67 67 A E - 0 0 117 -2,-0.3 10,-0.1 11,-0.2 -2,-0.0 -0.965 23.3-122.0-115.5 137.6 10.0 -20.1 -13.0 68 68 A D - 0 0 85 -2,-0.4 5,-0.1 0, 0.0 3,-0.1 -0.099 43.2 -86.0 -67.4 172.2 13.4 -21.5 -13.8 69 69 A H S S- 0 0 201 1,-0.2 2,-0.1 3,-0.1 -2,-0.0 0.910 79.6 -63.4 -49.6 -88.5 14.5 -24.8 -12.1 70 70 A N S S+ 0 0 159 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 -0.468 123.2 37.3-155.8 103.5 15.9 -23.7 -8.7 71 71 A G S S+ 0 0 63 2,-0.4 2,-0.1 -3,-0.1 3,-0.1 0.863 80.4 112.0 96.3 42.7 19.0 -21.5 -8.8 72 72 A G S S- 0 0 51 1,-0.1 2,-0.3 0, 0.0 -3,-0.1 0.722 94.6 -28.2 58.4-149.0 17.7 -20.3 -11.1 73 73 A Q - 0 0 41 -5,-0.1 -2,-0.4 1,-0.1 -1,-0.1 -0.833 50.7-160.5-126.5 160.1 17.2 -17.1 -9.2 74 74 A K S S+ 0 0 187 -2,-0.3 -1,-0.1 -3,-0.1 24,-0.0 0.768 79.4 32.4-105.6 -49.6 16.8 -16.6 -5.4 75 75 A Q S S+ 0 0 34 1,-0.1 23,-2.5 22,-0.1 2,-0.4 0.837 109.9 50.1 -94.3 -35.9 15.2 -13.2 -4.6 76 76 A L E S-H 97 0C 0 21,-0.2 21,-0.2 99,-0.1 99,-0.2 -0.902 74.8-139.6-107.9 134.6 12.7 -12.4 -7.5 77 77 A S E +H 96 0C 28 19,-2.0 19,-3.4 -2,-0.4 2,-0.2 -0.983 69.7 33.2-143.6 151.5 10.1 -14.7 -8.8 78 78 A P - 0 0 6 0, 0.0 -11,-0.2 0, 0.0 3,-0.1 0.670 64.6-160.0 -74.8 168.3 8.8 -15.7 -11.3 79 79 A Q S S+ 0 0 15 -13,-0.8 98,-2.6 1,-0.2 2,-0.4 0.726 74.1 36.2 -87.4 -24.3 11.8 -15.4 -13.6 80 80 A K E +Cd 66 177B 50 -14,-2.4 -14,-3.2 96,-0.2 2,-0.4 -0.997 62.5 179.6-134.8 135.5 9.9 -15.3 -16.9 81 81 A V E -Cd 65 178B 0 96,-2.7 98,-3.1 -2,-0.4 2,-0.5 -0.997 10.4-161.4-133.7 136.2 6.6 -13.7 -17.8 82 82 A T E -Cd 64 179B 17 -18,-3.4 -18,-3.0 -2,-0.4 2,-0.4 -0.987 11.7-163.8-116.9 126.7 4.7 -13.6 -21.1 83 83 A L E -Cd 63 180B 0 96,-3.3 98,-2.3 -2,-0.5 2,-0.5 -0.925 11.6-161.7-109.8 133.8 2.0 -11.0 -21.6 84 84 A Y E -Cd 62 181B 70 -22,-2.9 -22,-2.5 -2,-0.4 2,-0.6 -0.979 22.3-160.1-106.5 119.7 -0.7 -11.0 -24.3 85 85 A L E - d 0 182B 0 96,-2.7 98,-2.3 -2,-0.5 75,-0.3 -0.901 17.3-167.5-116.0 115.4 -2.0 -7.4 -24.5 86 86 A R > - 0 0 0 -2,-0.6 3,-2.0 3,-0.4 70,-0.4 -0.838 48.4 -92.5 -90.2 135.2 -5.3 -6.3 -26.0 87 87 A P T 3 S+ 0 0 15 0, 0.0 70,-0.2 0, 0.0 72,-0.1 -0.195 107.2 9.2 -56.0 130.8 -5.3 -2.5 -26.4 88 88 A G T 3 S+ 0 0 46 68,-2.9 2,-0.5 1,-0.1 69,-0.1 0.365 105.2 104.1 87.3 -2.8 -6.8 -0.7 -23.4 89 89 A Q < - 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