==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 23-APR-09 3H6A . COMPND 2 MOLECULE: INTEGRIN BETA-4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.ALONSO-GARCIA,A.INGLES-PRIETO,J.M.DE PEREDA . 224 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12116.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 140 62.5 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 34.4 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 . 10 4.5 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,-0.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 136.0 22.4 36.3 0.9 2 989 A R + 0 0 140 92,-0.3 28,-0.2 1,-0.2 27,-0.2 -0.710 360.0 30.5-111.3 168.0 24.3 33.0 0.5 3 990 A D S S- 0 0 9 26,-2.5 93,-2.2 25,-0.3 2,-0.6 0.915 77.2-174.8 53.1 51.5 26.0 30.8 3.0 4 991 A V E -Ab 28 96A 20 24,-2.1 24,-2.4 -3,-0.2 2,-0.5 -0.677 5.8-163.3 -88.5 119.5 23.6 31.8 5.8 5 992 A V E +Ab 27 97A 0 91,-3.5 93,-2.6 -2,-0.6 2,-0.3 -0.862 21.3 144.2-111.2 130.6 24.5 30.4 9.2 6 993 A S E -A 26 0A 8 20,-2.0 20,-2.5 -2,-0.5 2,-0.3 -0.955 51.2 -95.3-150.0 165.6 22.2 30.3 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 38.3-126.6 -75.7 150.3 21.1 28.2 15.2 8 995 A E S S+ 0 0 111 16,-1.9 -1,-0.1 -2,-0.3 17,-0.1 0.904 87.8 16.0 -68.2 -35.3 18.2 26.1 14.3 9 996 A Q - 0 0 94 15,-0.3 -1,-0.1 1,-0.1 95,-0.1 -0.960 66.3-128.5-136.5 155.7 16.1 27.4 17.3 10 997 A P S S+ 0 0 83 0, 0.0 94,-1.7 0, 0.0 2,-0.3 0.619 97.3 30.0 -73.3 -19.0 16.2 30.4 19.7 11 998 A E E -d 104 0B 103 92,-0.2 2,-0.3 94,-0.0 94,-0.2 -0.998 59.6-175.8-140.6 144.3 15.8 28.0 22.7 12 999 A F E -d 105 0B 25 92,-2.3 94,-3.1 -2,-0.3 2,-0.4 -0.992 15.8-146.3-132.6 145.8 16.8 24.4 23.5 13 1000 A S E +d 106 0B 72 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.926 21.5 171.8-113.5 133.3 16.0 22.5 26.7 14 1001 A V E -d 107 0B 20 92,-2.8 94,-2.7 -2,-0.4 2,-0.4 -0.920 33.0-113.0-133.5 157.4 18.3 19.9 28.3 15 1002 A S E > -d 108 0B 32 -2,-0.3 3,-2.3 92,-0.2 4,-0.2 -0.795 22.5-130.6 -90.4 138.2 18.4 17.9 31.5 16 1003 A R G > S+ 0 0 7 92,-2.8 3,-0.8 -2,-0.4 93,-0.1 0.787 108.5 58.8 -53.5 -29.9 21.2 18.8 33.9 17 1004 A G G 3 S+ 0 0 28 91,-0.4 -1,-0.3 1,-0.2 59,-0.1 0.532 80.6 84.6 -83.0 -5.0 21.9 15.1 34.1 18 1005 A D G < S- 0 0 91 -3,-2.3 -1,-0.2 1,-0.1 -2,-0.1 0.627 83.0-144.8 -72.5 -15.0 22.6 14.7 30.4 19 1006 A Q S < S+ 0 0 110 -3,-0.8 55,-1.8 -4,-0.2 2,-0.3 0.227 73.8 50.4 72.9 -18.4 26.2 15.8 30.8 20 1007 A V E - C 0 73A 22 53,-0.3 2,-0.5 -5,-0.2 53,-0.2 -0.985 67.6-142.7-151.4 140.2 26.1 17.6 27.4 21 1008 A A E - C 0 72A 0 51,-3.0 51,-2.2 -2,-0.3 2,-0.7 -0.932 18.3-153.0 -97.3 127.9 24.0 20.0 25.5 22 1009 A R E - C 0 71A 138 -2,-0.5 49,-0.2 49,-0.2 -2,-0.0 -0.877 16.4-173.1-106.6 105.8 23.8 19.2 21.8 23 1010 A I E - C 0 70A 0 47,-2.9 47,-3.0 -2,-0.7 2,-0.2 -0.874 13.4-141.7-115.2 108.8 23.2 22.5 19.8 24 1011 A P E - C 0 69A 30 0, 0.0 -16,-1.9 0, 0.0 2,-0.4 -0.484 14.8-173.0 -76.9 136.1 22.5 22.4 16.1 25 1012 A V E -AC 7 68A 0 43,-2.8 43,-2.7 -2,-0.2 2,-0.3 -0.992 10.6-162.6-123.1 128.1 23.9 25.1 13.8 26 1013 A I E -AC 6 67A 33 -20,-2.5 -20,-2.0 -2,-0.4 2,-0.4 -0.769 13.2-153.3-113.1 153.7 22.8 25.1 10.1 27 1014 A R E -A 5 0A 6 39,-2.3 2,-0.2 -2,-0.3 -22,-0.2 -0.994 21.6-171.3-122.9 125.2 24.2 26.7 7.0 28 1015 A R E +A 4 0A 139 -24,-2.4 -24,-2.1 -2,-0.4 -25,-0.3 -0.730 55.3 25.7-112.3 162.0 21.6 27.4 4.2 29 1016 A V S S- 0 0 70 -2,-0.2 -26,-2.5 -26,-0.2 -1,-0.2 0.951 79.5-150.7 53.4 59.0 21.8 28.6 0.5 30 1017 A L - 0 0 63 -28,-0.2 -1,-0.2 -3,-0.2 36,-0.0 -0.350 20.6-165.3 -66.9 132.8 25.3 27.2 -0.1 31 1018 A D - 0 0 96 2,-0.1 -1,-0.1 -2,-0.1 3,-0.1 0.656 52.5-101.7 -90.3 -20.6 27.4 29.0 -2.7 32 1019 A G S S+ 0 0 55 1,-0.4 2,-0.1 30,-0.1 -2,-0.1 0.348 87.4 83.0 120.9 -2.9 29.8 26.1 -2.9 33 1020 A G S S- 0 0 29 1,-0.2 -1,-0.4 30,-0.1 31,-0.3 -0.394 83.1 -68.0-116.8-167.3 32.8 27.2 -0.9 34 1021 A K - 0 0 74 -2,-0.1 2,-0.3 29,-0.1 28,-0.2 -0.470 42.4-168.4 -82.9 157.7 34.0 27.3 2.8 35 1022 A S E -E 61 0B 0 26,-1.9 26,-3.0 -2,-0.1 2,-0.4 -0.986 1.9-164.5-141.2 150.0 32.4 29.5 5.4 36 1023 A Q E +EF 60 92B 32 56,-1.7 56,-2.8 -2,-0.3 2,-0.3 -0.997 9.8 172.0-136.8 142.8 33.4 30.4 8.9 37 1024 A V E -E 59 0B 0 22,-1.6 22,-3.0 -2,-0.4 2,-0.3 -0.951 28.0-124.5-133.7 158.6 31.7 32.0 11.9 38 1025 A S E -EF 58 89B 20 51,-3.0 51,-2.1 -2,-0.3 2,-0.3 -0.777 26.2-168.6 -95.1 154.6 32.8 32.5 15.5 39 1026 A Y E +EF 57 88B 7 18,-2.6 18,-2.3 -2,-0.3 2,-0.3 -0.971 8.4 173.7-139.9 153.4 30.8 31.2 18.4 40 1027 A R E -EF 56 87B 108 47,-1.6 47,-2.5 -2,-0.3 16,-0.2 -0.957 26.9-125.4-157.3 143.8 30.9 31.6 22.2 41 1028 A T E - F 0 86B 11 14,-2.3 2,-0.4 -2,-0.3 45,-0.2 -0.508 24.7-165.7 -79.8 153.3 28.9 30.7 25.3 42 1029 A Q E - F 0 85B 82 43,-2.5 43,-2.7 -2,-0.2 -2,-0.0 -0.983 23.4-110.2-139.8 134.6 27.8 33.5 27.6 43 1030 A D E + F 0 84B 65 -2,-0.4 4,-0.2 41,-0.2 41,-0.2 -0.234 37.5 164.1 -58.2 145.7 26.5 33.1 31.2 44 1031 A G S S- 0 0 32 2,-1.7 40,-0.2 39,-0.7 -1,-0.1 -0.030 79.8 -41.6-115.4-120.0 22.9 33.7 32.0 45 1032 A T S S+ 0 0 87 38,-0.7 2,-0.5 -2,-0.1 39,-0.2 0.655 132.3 77.3 -80.3 -19.4 21.6 32.4 35.4 46 1033 A A S S- 0 0 0 37,-2.7 -2,-1.7 5,-0.0 2,-0.4 -0.815 81.8-150.1 -82.2 134.5 23.6 29.3 34.5 47 1034 A Q >>> - 0 0 88 -2,-0.5 4,-3.0 -4,-0.2 3,-2.2 -0.905 15.9-103.6-120.5 138.7 27.2 30.1 35.2 48 1035 A G B 345S+h 52 0C 20 -2,-0.4 5,-0.2 1,-0.3 -1,-0.0 -0.203 106.6 13.5 -54.0 137.4 30.5 28.8 33.7 49 1036 A N T 345S+ 0 0 126 3,-2.4 -1,-0.3 1,-0.1 4,-0.1 0.326 128.6 56.3 71.6 -0.2 32.3 26.3 35.9 50 1037 A R T <45S+ 0 0 97 -3,-2.2 -2,-0.2 2,-0.4 -1,-0.1 0.681 125.2 9.2-114.4 -53.3 29.2 25.8 38.1 51 1038 A D T <5S- 0 0 0 -4,-3.0 24,-2.2 1,-0.3 2,-0.3 0.641 132.8 -0.7-104.1 -24.2 26.5 24.8 35.7 52 1039 A Y B - 0 0 7 -2,-0.7 3,-2.2 -28,-0.2 -29,-0.1 -0.356 44.6 -63.2 -76.3 166.8 33.8 23.0 4.4 63 1050 A P T 3 S+ 0 0 27 0, 0.0 119,-0.4 0, 0.0 -1,-0.2 -0.293 125.1 13.5 -52.0 133.5 32.2 22.8 1.0 64 1051 A G T 3 S+ 0 0 26 -31,-0.3 2,-0.3 1,-0.2 -34,-0.1 0.131 88.7 133.6 90.8 -19.5 28.9 20.9 1.1 65 1052 A E < + 0 0 35 -3,-2.2 -1,-0.2 1,-0.2 3,-0.1 -0.535 27.2 176.8 -74.1 124.3 28.6 20.9 4.9 66 1053 A A + 0 0 46 -2,-0.3 -39,-2.3 1,-0.2 2,-0.3 0.454 57.9 11.0-107.8 -7.7 25.1 22.0 5.9 67 1054 A W E -C 26 0A 151 -41,-0.3 2,-0.3 -62,-0.0 -41,-0.2 -0.993 50.7-159.4-163.7 163.6 25.2 21.7 9.7 68 1055 A K E -C 25 0A 6 -43,-2.7 -43,-2.8 -2,-0.3 2,-0.5 -0.945 17.1-136.2-139.9 157.0 27.2 21.2 12.8 69 1056 A E E -C 24 0A 60 -2,-0.3 2,-0.3 -45,-0.2 104,-0.1 -0.970 15.4-152.9-115.3 115.4 26.4 20.1 16.4 70 1057 A L E -C 23 0A 6 -47,-3.0 -47,-2.9 -2,-0.5 2,-0.5 -0.660 7.6-155.9 -78.5 142.0 28.0 22.1 19.2 71 1058 A Q E -C 22 0A 51 103,-0.4 2,-0.5 -2,-0.3 -49,-0.2 -0.897 11.2-176.8-123.5 104.5 28.5 20.1 22.4 72 1059 A V E -C 21 0A 2 -51,-2.2 -51,-3.0 -2,-0.5 2,-0.2 -0.862 27.2-124.5-103.1 125.6 28.7 22.1 25.6 73 1060 A K E -C 20 0A 130 -2,-0.5 -20,-2.5 -20,-0.3 2,-0.3 -0.476 21.0-147.4 -72.5 137.3 29.4 20.1 28.7 74 1061 A L B -I 52 0C 4 -55,-1.8 2,-0.4 -22,-0.2 -22,-0.3 -0.786 7.3-144.9-102.8 149.3 26.9 20.3 31.6 75 1062 A L - 0 0 47 -24,-2.2 2,-0.2 -2,-0.3 -25,-0.0 -0.877 8.5-132.5-115.5 145.1 27.9 20.1 35.2 76 1063 A E 0 0 117 -2,-0.4 -59,-0.0 -59,-0.1 -24,-0.0 -0.651 360.0 360.0 -94.8 154.5 26.0 18.5 38.1 77 1064 A L 0 0 120 -2,-0.2 -1,-0.1 -26,-0.1 -26,-0.0 -0.337 360.0 360.0 -94.8 360.0 25.5 20.4 41.4 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 0 266 0, 0.0 2,-0.3 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 -28.0 12.5 22.5 40.7 80 1075 A Q + 0 0 48 2,-0.0 29,-1.5 0, 0.0 2,-0.4 -0.687 360.0 175.5 -96.1 138.8 15.7 24.3 39.4 81 1076 A V E + G 0 108B 63 -2,-0.3 2,-0.3 27,-0.2 27,-0.2 -0.995 3.0 170.2-139.8 129.1 16.0 26.0 36.0 82 1077 A R E - G 0 107B 47 25,-1.8 25,-3.2 -2,-0.4 2,-0.4 -0.994 14.8-150.0-142.1 149.6 19.0 28.0 34.8 83 1078 A R E + G 0 106B 84 -2,-0.3 -37,-2.7 23,-0.2 -38,-0.7 -0.924 12.7 178.2-123.0 141.1 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 -0.836 21.2-133.7-126.0 174.1 23.1 30.2 29.4 85 1080 A H E -FG 42 104B 54 -43,-2.7 -43,-2.5 -2,-0.3 2,-0.4 -0.869 6.1-153.7-126.6 155.2 23.4 31.6 25.9 86 1081 A V E -FG 41 103B 0 17,-2.1 17,-2.5 -2,-0.3 2,-0.4 -0.998 16.7-164.4-127.6 135.8 25.4 30.9 22.7 87 1082 A Q E -FG 40 102B 55 -47,-2.5 -47,-1.6 -2,-0.4 2,-0.3 -0.962 10.8-149.6-123.3 137.3 26.2 33.6 20.2 88 1083 A L E +F 39 0B 8 13,-2.7 2,-0.3 -2,-0.4 -49,-0.2 -0.775 32.2 150.3 -96.8 147.7 27.5 33.5 16.6 89 1084 A S E +F 38 0B 51 -51,-2.1 -51,-3.0 -2,-0.3 -2,-0.0 -0.940 36.4 45.9-155.9 176.9 29.6 36.4 15.3 90 1085 A N E - 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