==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 14-FEB-05 1YUK . COMPND 2 MOLECULE: INTEGRIN BETA-2 A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SHI,K.SUNDRAMURTHY,B.LIU,S.M.TAN,S.K.LAW,J.LESCAR . 214 3 9 8 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12481.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 58.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 26.6 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 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 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 3 2 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 . 1 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 0 187 0, 0.0 2,-0.3 0, 0.0 41,-0.1 0.000 360.0 360.0 360.0 19.8 20.6 3.2 11.4 2 2 A E - 0 0 156 39,-0.1 18,-0.5 2,-0.0 2,-0.4 -0.984 360.0-171.8-134.2 143.8 20.8 0.3 8.9 3 3 A a + 0 0 21 -2,-0.3 2,-0.6 17,-0.1 39,-0.2 -0.896 6.8 178.6-144.4 113.3 20.3 0.3 5.1 4 4 A T + 0 0 130 13,-0.4 2,-0.3 -2,-0.4 17,-0.1 -0.900 22.1 153.5-115.1 101.8 20.1 -2.7 2.9 5 5 A K - 0 0 57 -2,-0.6 2,-0.4 35,-0.2 9,-0.1 -0.778 31.0-145.0-122.2 168.4 19.4 -1.8 -0.8 6 6 A F S S- 0 0 167 -2,-0.3 -2,-0.0 8,-0.0 0, 0.0 -0.888 70.9 -36.6-142.6 109.4 20.1 -3.5 -4.1 7 7 A K S S- 0 0 146 -2,-0.4 29,-0.1 1,-0.2 31,-0.0 0.804 75.6-174.4 48.0 38.3 21.0 -1.5 -7.3 8 8 A V - 0 0 8 1,-0.1 -1,-0.2 29,-0.1 31,-0.2 -0.338 12.2-168.6 -59.1 140.9 18.5 1.2 -6.4 9 9 A S + 0 0 50 1,-0.1 2,-0.3 27,-0.1 -1,-0.1 0.429 61.3 30.8-115.0 -0.9 18.3 3.7 -9.3 10 10 A S S > S- 0 0 31 1,-0.1 4,-2.0 27,-0.0 5,-0.1 -0.960 79.2-107.8-151.1 166.8 16.4 6.5 -7.7 11 11 A b H > S+ 0 0 4 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.888 119.1 53.8 -64.0 -39.5 15.7 8.3 -4.5 12 12 A R H > S+ 0 0 87 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.943 108.4 48.0 -61.2 -47.8 12.2 6.8 -4.3 13 13 A E H 4 S+ 0 0 79 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.883 112.0 52.4 -60.4 -37.0 13.6 3.3 -4.7 14 14 A c H >< S+ 0 0 0 -4,-2.0 3,-1.7 1,-0.2 4,-0.4 0.951 107.9 48.0 -63.9 -51.4 16.1 4.1 -2.0 15 15 A I H >< S+ 0 0 1 -4,-2.7 3,-1.2 1,-0.3 6,-0.2 0.868 109.2 55.2 -58.6 -36.3 13.6 5.3 0.6 16 16 A E T 3< S+ 0 0 99 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.552 92.2 74.5 -74.0 -7.9 11.5 2.2 -0.1 17 17 A S T < S- 0 0 41 -3,-1.7 -13,-0.4 -4,-0.4 -1,-0.2 0.633 115.2 -45.8 -80.4 -13.8 14.5 0.0 0.7 18 18 A G X - 0 0 18 -3,-1.2 3,-1.1 -4,-0.4 -1,-0.3 -0.774 50.9 -93.6 157.9 158.5 14.2 0.7 4.5 19 19 A P T 3 S+ 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -16,-0.1 0.746 119.9 52.4 -66.9 -24.1 13.6 3.3 7.3 20 20 A G T 3 S+ 0 0 14 -18,-0.5 23,-0.5 -3,-0.1 2,-0.3 0.523 87.3 105.6 -90.3 -4.8 17.3 3.8 7.8 21 21 A a < + 0 0 0 -3,-1.1 2,-0.3 -6,-0.2 21,-0.2 -0.561 44.5 177.7 -80.5 138.4 18.1 4.5 4.1 22 22 A T E -A 41 0A 3 19,-2.4 19,-2.1 -2,-0.3 2,-0.4 -0.897 19.5-130.8-132.9 163.1 18.8 8.0 3.0 23 23 A W E -AB 40 57A 0 34,-2.2 34,-3.5 -2,-0.3 2,-0.6 -0.963 4.9-143.6-126.8 128.5 19.8 9.5 -0.4 24 24 A d E - B 0 56A 0 15,-2.5 32,-0.2 -2,-0.4 5,-0.1 -0.750 12.6-176.2 -88.8 118.3 22.6 11.9 -1.4 25 25 A Q + 0 0 14 30,-3.0 -1,-0.1 -2,-0.6 31,-0.1 0.335 36.1 135.7 -94.5 7.4 21.5 14.3 -4.1 26 26 A K > - 0 0 85 29,-0.3 3,-1.4 1,-0.1 4,-0.2 -0.302 62.3-109.4 -58.7 133.4 25.0 15.9 -4.5 27 27 A L T 3 S+ 0 0 72 1,-0.2 -1,-0.1 2,-0.1 174,-0.1 -0.348 98.7 8.6 -63.9 144.2 26.0 16.4 -8.1 28 28 A N T 3 S+ 0 0 114 172,-0.5 -1,-0.2 183,-0.1 -2,-0.1 0.658 81.7 141.1 59.3 20.8 28.8 14.1 -9.3 29 29 A F < + 0 0 23 -3,-1.4 2,-0.4 171,-0.2 -2,-0.1 0.777 50.3 82.6 -62.1 -26.7 28.6 12.0 -6.1 30 30 A T S S- 0 0 9 -4,-0.2 6,-0.1 181,-0.1 181,-0.0 -0.669 73.4-143.8 -86.3 130.3 29.1 8.9 -8.2 31 31 A G > - 0 0 24 -2,-0.4 3,-1.6 4,-0.1 -1,-0.0 -0.297 32.2 -94.8 -83.9 172.6 32.6 7.8 -9.2 32 32 A P T 3 S+ 0 0 137 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.896 123.7 40.7 -53.9 -46.2 33.7 6.2 -12.5 33 33 A G T 3 S+ 0 0 74 2,-0.0 -2,-0.0 0, 0.0 -3,-0.0 -0.018 101.6 92.3 -96.6 31.8 33.5 2.7 -11.1 34 34 A D < - 0 0 70 -3,-1.6 2,-0.1 2,-0.0 -4,-0.0 -0.958 65.9-130.1-129.8 146.5 30.3 3.1 -9.1 35 35 A P > - 0 0 60 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.436 36.3-105.4 -83.7 161.4 26.6 2.5 -9.7 36 36 A D G > S+ 0 0 55 1,-0.3 3,-2.1 2,-0.2 4,-0.2 0.756 112.8 80.3 -59.0 -22.7 24.0 5.2 -8.8 37 37 A S G > S+ 0 0 15 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.643 71.5 78.3 -59.8 -16.1 23.1 3.0 -5.9 38 38 A I G < S+ 0 0 39 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.767 81.6 67.4 -64.7 -23.8 26.1 4.4 -4.0 39 39 A R G < S+ 0 0 8 -3,-2.1 -15,-2.5 -4,-0.2 2,-0.6 0.666 90.3 77.4 -69.0 -15.1 23.9 7.5 -3.4 40 40 A c E < +A 23 0A 0 -3,-1.6 2,-0.3 -17,-0.2 -17,-0.2 -0.862 64.2 102.2-104.6 115.6 21.7 5.3 -1.1 41 41 A D E S-A 22 0A 36 -19,-2.1 -19,-2.4 -2,-0.6 2,-0.1 -0.942 72.2 -54.3-168.3-176.6 23.0 4.5 2.4 42 42 A T > - 0 0 14 -2,-0.3 4,-2.2 -21,-0.2 3,-0.5 -0.421 55.7-108.6 -73.6 154.4 22.7 5.4 6.1 43 43 A R H > S+ 0 0 94 -23,-0.5 4,-2.3 1,-0.2 5,-0.2 0.898 119.1 50.1 -48.9 -50.1 23.1 9.0 7.0 44 44 A P H > S+ 0 0 81 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.860 109.2 52.9 -59.4 -37.0 26.5 8.4 8.7 45 45 A Q H > S+ 0 0 98 -3,-0.5 4,-1.2 2,-0.2 -2,-0.2 0.918 110.2 46.3 -66.0 -43.9 27.7 6.5 5.7 46 46 A L H <>S+ 0 0 1 -4,-2.2 5,-2.2 1,-0.2 3,-0.2 0.893 110.3 53.1 -66.8 -38.7 26.8 9.4 3.2 47 47 A L H ><5S+ 0 0 82 -4,-2.3 3,-2.0 -5,-0.2 -1,-0.2 0.911 103.9 58.0 -61.7 -40.1 28.4 12.0 5.5 48 48 A M H 3<5S+ 0 0 160 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.863 104.8 51.3 -56.3 -37.9 31.6 10.0 5.6 49 49 A R T 3<5S- 0 0 140 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.307 127.8 -96.0 -84.9 8.5 31.7 10.3 1.8 50 50 A G T < 5 + 0 0 40 -3,-2.0 2,-0.5 1,-0.3 -3,-0.2 0.635 69.9 150.3 91.5 12.4 31.3 14.0 1.8 51 51 A d < - 0 0 3 -5,-2.2 -1,-0.3 1,-0.1 2,-0.1 -0.692 46.9-123.6 -80.7 127.9 27.6 14.5 1.2 52 52 A A > - 0 0 46 -2,-0.5 3,-2.7 1,-0.1 4,-0.4 -0.396 20.0-112.6 -69.7 147.9 26.5 17.7 2.9 53 53 A A G > S+ 0 0 67 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.838 117.7 51.9 -48.4 -40.2 23.7 17.4 5.5 54 54 A D G 3 S+ 0 0 124 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.464 103.5 57.8 -81.8 1.5 21.3 19.4 3.3 55 55 A D G < S+ 0 0 35 -3,-2.7 -30,-3.0 2,-0.1 2,-0.7 0.330 84.4 97.3-105.9 3.5 21.9 17.1 0.3 56 56 A I E < -B 24 0A 11 -3,-1.1 2,-0.5 -4,-0.4 -32,-0.2 -0.850 65.9-150.8 -97.8 114.0 20.8 14.1 2.2 57 57 A M E +B 23 0A 21 -34,-3.5 -34,-2.2 -2,-0.7 122,-0.1 -0.727 29.3 156.5 -85.2 126.2 17.2 13.2 1.5 58 58 A D - 0 0 41 -2,-0.5 -36,-0.1 -36,-0.2 121,-0.1 -0.479 26.2-158.0-152.9 71.8 15.5 11.5 4.4 59 59 A P - 0 0 18 0, 0.0 2,-0.4 0, 0.0 117,-0.1 -0.322 22.8-158.0 -53.0 131.4 11.7 11.8 4.5 60 60 A T - 0 0 62 21,-0.0 2,-0.1 22,-0.0 20,-0.1 -0.922 19.9-103.2-123.6 144.1 10.7 11.2 8.2 61 61 A S - 0 0 18 -2,-0.4 2,-0.3 21,-0.1 20,-0.2 -0.366 45.1-176.9 -61.6 134.9 7.5 10.1 9.9 62 62 A L E -C 80 0B 82 18,-1.8 18,-2.7 25,-0.1 2,-0.4 -0.966 19.7-153.5-137.6 150.8 5.7 13.0 11.5 63 63 A A E -C 79 0B 27 -2,-0.3 2,-0.4 16,-0.2 16,-0.2 -0.994 10.9-175.2-127.3 127.6 2.6 13.5 13.7 64 64 A E E -C 78 0B 97 14,-2.8 14,-3.3 -2,-0.4 2,-0.3 -0.981 9.6-163.1-121.8 134.8 0.6 16.8 13.8 65 65 A T E -C 77 0B 81 -2,-0.4 2,-0.4 12,-0.2 12,-0.2 -0.746 7.6-153.7-116.4 165.9 -2.3 17.3 16.1 66 66 A Q E C 76 0B 120 10,-2.3 10,-1.6 -2,-0.3 9,-1.2 -0.985 360.0 360.0-143.1 127.7 -5.2 19.7 16.3 67 67 A E 0 0 170 -2,-0.4 -2,-0.0 7,-0.2 6,-0.0 -0.205 360.0 360.0 52.7 360.0 -7.1 20.8 19.4 68 ! 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 69 73 A Q 0 0 98 0, 0.0 4,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0-108.1 -12.3 18.3 24.6 70 74 A K - 0 0 59 2,-0.3 24,-0.1 23,-0.0 3,-0.1 0.915 360.0 -25.9 -75.4 -95.2 -14.4 16.0 26.7 71 75 A Q S S+ 0 0 48 1,-0.1 23,-2.1 22,-0.1 2,-0.4 0.838 128.2 46.8 -92.5 -39.8 -12.7 12.8 27.8 72 76 A L E S-H 93 0C 3 21,-0.2 -2,-0.3 96,-0.1 21,-0.2 -0.855 74.1-137.9-112.7 143.9 -10.1 12.4 25.0 73 77 A S E +H 92 0C 35 19,-1.3 19,-3.1 -2,-0.4 2,-0.2 -0.985 68.6 35.0-152.7 147.6 -7.7 14.9 23.4 74 78 A P - 0 0 15 0, 0.0 -7,-0.2 0, 0.0 3,-0.1 0.596 62.7-157.4 -72.4 178.1 -6.5 15.9 20.9 75 79 A Q S S+ 0 0 45 -9,-1.2 95,-2.6 1,-0.2 2,-0.4 0.723 74.3 33.7 -94.5 -26.5 -9.5 15.4 18.6 76 80 A K E +Cd 66 170B 79 -10,-1.6 -10,-2.3 93,-0.2 2,-0.4 -0.990 60.8 179.6-134.5 142.1 -7.6 15.3 15.3 77 81 A V E -Cd 65 171B 0 93,-2.1 95,-3.0 -2,-0.4 2,-0.5 -0.998 10.2-160.6-141.8 134.9 -4.2 13.9 14.3 78 82 A T E -Cd 64 172B 27 -14,-3.3 -14,-2.8 -2,-0.4 2,-0.4 -0.978 11.9-166.1-118.6 127.4 -2.5 13.7 11.0 79 83 A L E -Cd 63 173B 0 93,-3.1 95,-2.7 -2,-0.5 2,-0.6 -0.948 13.9-160.1-119.1 133.5 0.3 11.3 10.5 80 84 A Y E -Cd 62 174B 70 -18,-2.7 -18,-1.8 -2,-0.4 2,-0.6 -0.960 24.3-155.9-108.4 113.6 2.9 11.2 7.6 81 85 A L E - 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