==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 07-JAN-09 3FQ4 . COMPND 2 MOLECULE: INTEGRIN BETA-4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.ALONSO-GARCIA,A.INGLES-PRIETO,J.M.DE PEREDA . 225 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12143.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 141 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 34.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 2 2 0 0 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 0 PARALLEL BRIDGES PER LADDER . 2 0 0 2 0 3 5 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 2 2 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 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 1 988 A M 0 0 171 0, 0.0 2,-0.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 139.8 22.3 36.2 1.0 2 989 A R + 0 0 142 92,-0.3 28,-0.2 1,-0.2 27,-0.2 -0.734 360.0 29.8-111.4 163.0 24.1 32.9 0.6 3 990 A D S S- 0 0 9 26,-2.5 93,-2.2 25,-0.4 2,-0.6 0.933 76.8-175.6 56.7 52.7 25.9 30.7 3.1 4 991 A V E -Ab 28 96A 20 24,-2.0 24,-2.5 -3,-0.2 2,-0.4 -0.711 6.2-162.7 -89.7 121.1 23.5 31.8 5.9 5 992 A V E +Ab 27 97A 0 91,-3.3 93,-2.7 -2,-0.6 2,-0.3 -0.870 21.2 146.0-113.2 130.7 24.5 30.3 9.3 6 993 A S E -A 26 0A 8 20,-2.0 20,-2.7 -2,-0.4 2,-0.3 -0.965 50.7 -95.7-151.2 162.3 22.1 30.2 12.2 7 994 A F E -A 25 0A 1 93,-2.8 18,-0.2 -2,-0.3 95,-0.1 -0.632 38.5-125.9 -72.9 150.4 21.1 28.2 15.3 8 995 A E S S+ 0 0 110 16,-2.0 -1,-0.1 -2,-0.3 17,-0.1 0.864 87.8 14.3 -68.8 -31.9 18.1 26.0 14.4 9 996 A Q - 0 0 93 15,-0.3 -1,-0.1 91,-0.1 3,-0.1 -0.965 66.8-127.4-140.0 156.4 16.0 27.4 17.3 10 997 A P S S+ 0 0 83 0, 0.0 94,-1.8 0, 0.0 2,-0.3 0.592 97.1 30.2 -77.3 -16.7 16.1 30.3 19.7 11 998 A E E -d 104 0B 103 92,-0.2 2,-0.3 74,-0.0 94,-0.2 -0.994 60.2-175.4-142.4 144.3 15.8 28.0 22.7 12 999 A F E -d 105 0B 27 92,-2.3 94,-3.0 -2,-0.3 2,-0.4 -0.977 15.5-145.6-133.3 148.0 16.8 24.4 23.6 13 1000 A S E +d 106 0B 69 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.950 21.9 171.0-117.3 134.0 15.9 22.5 26.7 14 1001 A V E -d 107 0B 19 92,-2.7 94,-2.8 -2,-0.4 2,-0.4 -0.959 32.8-117.2-138.7 151.2 18.3 19.9 28.3 15 1002 A S E > -d 108 0B 32 -2,-0.3 3,-1.9 92,-0.2 5,-0.3 -0.766 22.0-132.2 -87.1 139.3 18.4 17.9 31.5 16 1003 A R G > S+ 0 0 6 92,-2.8 3,-1.5 -2,-0.4 -1,-0.1 0.868 106.4 62.9 -56.1 -36.1 21.3 18.7 33.7 17 1004 A G G 3 S+ 0 0 28 91,-0.4 -1,-0.3 1,-0.3 59,-0.1 0.628 81.7 80.7 -69.9 -9.5 21.9 15.0 34.1 18 1005 A D G < S- 0 0 97 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.650 86.2-144.7 -71.5 -17.0 22.6 14.6 30.3 19 1006 A Q S < S+ 0 0 109 -3,-1.5 55,-1.9 -4,-0.2 2,-0.3 0.270 72.9 50.6 75.3 -15.5 26.1 15.8 30.8 20 1007 A V E - C 0 73A 19 53,-0.3 2,-0.5 -5,-0.3 53,-0.2 -0.988 67.0-142.2-156.0 141.8 26.0 17.6 27.4 21 1008 A A E - C 0 72A 1 51,-2.7 51,-2.3 -2,-0.3 2,-0.7 -0.955 18.4-153.3-101.6 126.9 23.9 20.0 25.5 22 1009 A R E - C 0 71A 139 -2,-0.5 49,-0.2 49,-0.2 -2,-0.0 -0.883 16.7-171.9-107.1 103.5 23.8 19.2 21.8 23 1010 A I E - C 0 70A 1 47,-2.9 47,-3.0 -2,-0.7 2,-0.3 -0.860 12.9-140.6-112.6 111.2 23.2 22.4 19.9 24 1011 A P E - C 0 69A 29 0, 0.0 -16,-2.0 0, 0.0 2,-0.4 -0.498 15.4-173.5 -78.6 137.3 22.5 22.4 16.2 25 1012 A V E -AC 7 68A 0 43,-2.8 43,-2.5 -2,-0.3 2,-0.3 -0.985 11.1-161.7-122.6 131.0 23.9 25.1 13.8 26 1013 A I E -AC 6 67A 34 -20,-2.7 -20,-2.0 -2,-0.4 2,-0.4 -0.791 13.0-153.6-113.8 156.0 22.7 25.1 10.2 27 1014 A R E -A 5 0A 7 39,-2.5 2,-0.3 -2,-0.3 -22,-0.2 -0.997 22.1-173.3-125.9 127.1 24.1 26.6 7.0 28 1015 A R E +A 4 0A 138 -24,-2.5 -24,-2.0 -2,-0.4 -25,-0.4 -0.749 54.5 27.3-118.4 163.1 21.6 27.4 4.2 29 1016 A V S S- 0 0 68 -2,-0.3 -26,-2.5 -26,-0.2 -1,-0.2 0.950 79.4-151.1 53.0 60.1 21.7 28.6 0.6 30 1017 A L - 0 0 65 -28,-0.2 -1,-0.2 -3,-0.2 36,-0.0 -0.378 20.6-165.8 -69.5 130.8 25.1 27.2 -0.1 31 1018 A D - 0 0 100 2,-0.1 -1,-0.2 -2,-0.1 3,-0.1 0.711 52.6-101.0 -86.6 -23.8 27.2 29.0 -2.7 32 1019 A G S S+ 0 0 52 1,-0.4 2,-0.1 30,-0.1 -2,-0.1 0.270 88.0 81.5 126.5 -6.0 29.7 26.1 -2.9 33 1020 A G S S- 0 0 30 1,-0.2 -1,-0.4 30,-0.1 31,-0.3 -0.392 83.4 -67.5-114.2-169.7 32.7 27.1 -0.8 34 1021 A K - 0 0 75 -2,-0.1 2,-0.3 29,-0.1 28,-0.2 -0.393 41.8-168.0 -77.5 158.8 33.8 27.2 2.8 35 1022 A S E -E 61 0B 0 26,-2.0 26,-3.2 -2,-0.1 2,-0.4 -0.990 1.3-164.9-141.5 150.3 32.3 29.5 5.4 36 1023 A Q E +EF 60 92B 30 56,-1.8 56,-2.8 -2,-0.3 2,-0.3 -1.000 9.7 171.3-137.9 143.5 33.3 30.4 8.9 37 1024 A V E -E 59 0B 0 22,-1.7 22,-2.9 -2,-0.4 2,-0.3 -0.946 28.6-122.8-134.1 158.7 31.6 31.9 11.9 38 1025 A S E -EF 58 89B 20 51,-3.3 51,-2.0 -2,-0.3 2,-0.3 -0.748 25.4-165.4 -93.4 154.4 32.7 32.4 15.5 39 1026 A Y E +EF 57 88B 7 18,-2.7 18,-2.4 -2,-0.3 2,-0.3 -0.987 9.1 174.5-136.9 153.0 30.8 31.1 18.4 40 1027 A R E -EF 56 87B 111 47,-1.7 47,-2.6 -2,-0.3 16,-0.2 -0.980 25.4-129.6-155.4 139.5 30.8 31.7 22.2 41 1028 A T E - F 0 86B 11 14,-2.2 2,-0.3 -2,-0.3 45,-0.2 -0.520 23.8-166.7 -79.4 156.4 28.9 30.7 25.3 42 1029 A Q E - F 0 85B 85 43,-2.3 43,-2.8 -2,-0.2 -2,-0.0 -0.967 22.7-111.9-144.8 132.6 27.7 33.5 27.7 43 1030 A D E + F 0 84B 65 -2,-0.3 41,-0.2 41,-0.2 4,-0.2 -0.242 36.4 164.2 -58.7 146.1 26.4 33.0 31.2 44 1031 A G S S- 0 0 33 2,-1.6 40,-0.2 39,-0.7 -1,-0.1 -0.026 81.1 -39.8-115.4-120.1 22.8 33.8 32.0 45 1032 A T S S+ 0 0 89 38,-0.6 2,-0.5 -2,-0.1 39,-0.2 0.694 132.8 77.3 -75.4 -23.9 21.6 32.4 35.4 46 1033 A A S S- 0 0 0 37,-2.7 -2,-1.6 5,-0.1 2,-0.4 -0.782 80.9-151.8 -80.6 132.2 23.6 29.3 34.5 47 1034 A Q >>> - 0 0 87 -2,-0.5 4,-3.1 -4,-0.2 3,-2.1 -0.905 16.4-104.5-117.1 138.1 27.2 30.1 35.1 48 1035 A G B 345S+h 52 0C 20 -2,-0.4 5,-0.2 1,-0.3 -5,-0.0 -0.252 105.8 15.2 -54.7 139.2 30.4 28.8 33.6 49 1036 A N T 345S+ 0 0 126 3,-2.7 -1,-0.3 1,-0.1 4,-0.1 0.313 128.7 55.3 71.0 -0.8 32.3 26.3 35.8 50 1037 A R T <45S+ 0 0 98 -3,-2.1 -2,-0.2 2,-0.4 -1,-0.1 0.665 126.2 8.9-113.1 -53.7 29.2 25.8 38.0 51 1038 A D T <5S- 0 0 0 -4,-3.1 24,-2.2 1,-0.3 2,-0.3 0.664 132.8 -0.8-102.5 -23.6 26.5 24.8 35.6 52 1039 A Y B - 0 0 7 -2,-0.7 3,-2.3 -28,-0.2 -29,-0.1 -0.372 44.3 -64.8 -77.1 164.2 33.7 22.9 4.4 63 1050 A P T 3 S+ 0 0 27 0, 0.0 119,-0.4 0, 0.0 -1,-0.2 -0.270 125.4 14.6 -50.2 133.6 32.1 22.8 1.0 64 1051 A G T 3 S+ 0 0 25 -31,-0.3 2,-0.3 1,-0.2 -34,-0.1 0.170 89.1 133.5 89.7 -18.7 28.8 20.9 1.1 65 1052 A E < + 0 0 35 -3,-2.3 -1,-0.2 1,-0.1 3,-0.1 -0.539 26.6 175.7 -74.8 126.1 28.5 20.9 4.9 66 1053 A A + 0 0 46 -2,-0.3 -39,-2.5 1,-0.2 2,-0.3 0.497 57.8 12.4-111.5 -7.3 25.0 22.0 5.9 67 1054 A W E -C 26 0A 154 -41,-0.3 2,-0.3 -62,-0.0 -41,-0.2 -0.995 49.9-161.8-164.1 161.9 25.1 21.6 9.7 68 1055 A K E -C 25 0A 6 -43,-2.5 -43,-2.8 -2,-0.3 2,-0.5 -0.940 17.1-137.2-139.7 159.0 27.1 21.2 12.9 69 1056 A E E -C 24 0A 61 -2,-0.3 2,-0.3 -45,-0.2 104,-0.1 -0.981 15.6-152.9-118.7 116.8 26.4 20.1 16.4 70 1057 A L E -C 23 0A 5 -47,-3.0 -47,-2.9 -2,-0.5 2,-0.5 -0.677 7.4-154.3 -81.0 143.1 28.0 22.0 19.2 71 1058 A Q E -C 22 0A 50 103,-0.4 2,-0.6 -2,-0.3 -49,-0.2 -0.927 11.9-176.8-123.3 107.9 28.5 20.1 22.4 72 1059 A V E -C 21 0A 1 -51,-2.3 -51,-2.7 -2,-0.5 2,-0.1 -0.900 27.1-124.3-105.3 124.2 28.6 22.1 25.5 73 1060 A K E -C 20 0A 130 -2,-0.6 -20,-2.5 -20,-0.3 2,-0.4 -0.435 20.9-149.0 -70.8 137.5 29.4 20.1 28.7 74 1061 A L B -I 52 0C 3 -55,-1.9 2,-0.4 -22,-0.2 -22,-0.3 -0.841 7.4-142.9-108.7 144.6 26.9 20.4 31.6 75 1062 A L - 0 0 47 -24,-2.2 2,-0.3 -2,-0.4 -25,-0.0 -0.838 7.7-132.9-110.1 143.6 27.9 20.1 35.2 76 1063 A E 0 0 114 -2,-0.4 -24,-0.0 -59,-0.1 -59,-0.0 -0.645 360.0 360.0 -93.3 152.0 26.0 18.5 38.0 77 1064 A L 0 0 120 -2,-0.3 -1,-0.1 -26,-0.0 -26,-0.0 -0.334 360.0 360.0 -93.7 360.0 25.6 20.3 41.3 78 ! 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 79 1074 A R 0 0 272 0, 0.0 2,-0.4 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 -28.5 12.7 22.6 40.9 80 1075 A Q + 0 0 51 2,-0.0 29,-1.3 0, 0.0 2,-0.4 -0.710 360.0 175.0-102.2 135.0 15.8 24.3 39.5 81 1076 A V E + G 0 108B 65 -2,-0.4 2,-0.3 27,-0.2 27,-0.2 -0.992 4.9 171.3-136.0 127.4 16.0 26.0 36.0 82 1077 A R E - G 0 107B 47 25,-2.0 25,-3.3 -2,-0.4 2,-0.4 -0.980 13.9-151.4-137.2 153.4 19.0 27.9 34.8 83 1078 A R E + G 0 106B 89 -2,-0.3 -37,-2.7 23,-0.2 -39,-0.7 -0.954 12.5 178.1-128.2 140.0 19.9 29.4 31.4 84 1079 A F E -FG 43 105B 0 21,-1.9 21,-2.9 -2,-0.4 2,-0.3 -0.817 21.6-132.4-125.2 173.9 23.0 30.2 29.4 85 1080 A H E -FG 42 104B 54 -43,-2.8 -43,-2.3 -2,-0.3 2,-0.4 -0.855 6.4-153.8-125.0 155.1 23.4 31.6 25.9 86 1081 A V E -FG 41 103B 0 17,-2.4 17,-2.6 -2,-0.3 2,-0.4 -0.999 16.6-165.6-128.9 134.8 25.4 30.8 22.7 87 1082 A Q E -FG 40 102B 48 -47,-2.6 -47,-1.7 -2,-0.4 2,-0.3 -0.958 11.7-149.3-122.9 139.4 26.2 33.5 20.2 88 1083 A L E +F 39 0B 7 13,-2.7 2,-0.3 -2,-0.4 -49,-0.2 -0.789 32.1 150.1 -97.5 148.9 27.4 33.5 16.6 89 1084 A S E +F 38 0B 50 -51,-2.0 -51,-3.3 -2,-0.3 -2,-0.0 -0.936 36.8 46.0-159.2 174.6 29.6 36.4 15.3 90 1085 A N E - 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