==== 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 STRUCTURAL PROTEIN 19-APR-99 1QG3 . COMPND 2 MOLECULE: PROTEIN (INTEGRIN BETA-4 SUBUNIT); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.M.DE PEREDA,G.WICHE,R.C.LIDDINGTON . 388 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 215 55.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 143 36.9 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 . 6 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 . 26 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 6.2 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+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 . 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 PARALLEL BRIDGES PER LADDER . 3 3 0 7 9 0 0 4 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 4 0 4 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 1126 A D 0 0 118 0, 0.0 2,-0.2 0, 0.0 79,-0.1 0.000 360.0 360.0 360.0-132.7 16.9 33.8 17.4 2 1127 A L - 0 0 27 71,-0.1 25,-0.1 76,-0.1 71,-0.1 -0.474 360.0-134.5 -73.0 137.3 16.1 30.7 19.4 3 1128 A G - 0 0 23 23,-1.2 70,-0.3 -2,-0.2 77,-0.2 -0.248 33.4 -85.0 -81.1 176.8 15.7 31.1 23.1 4 1129 A A - 0 0 21 78,-0.1 22,-0.2 1,-0.1 78,-0.2 -0.638 51.4 -98.2 -84.1 138.1 17.3 28.7 25.6 5 1130 A P - 0 0 1 0, 0.0 79,-0.3 0, 0.0 2,-0.2 -0.305 48.2-133.9 -55.1 140.8 15.2 25.5 26.4 6 1131 A Q E +A 23 0A 104 17,-1.9 17,-3.2 1,-0.2 77,-0.1 -0.596 66.9 12.6-102.3 161.6 13.4 26.1 29.7 7 1132 A N E S- 0 0 113 -2,-0.2 -1,-0.2 15,-0.2 2,-0.1 0.880 72.9-159.3 44.2 55.1 12.8 24.2 32.9 8 1133 A P E - 0 0 22 0, 0.0 2,-0.4 0, 0.0 14,-0.2 -0.430 14.6-175.5 -62.3 132.9 15.4 21.5 32.2 9 1134 A N E -A 21 0A 84 12,-3.3 12,-3.2 -2,-0.1 2,-0.3 -0.997 10.2-177.7-138.3 137.8 14.6 18.4 34.3 10 1135 A A E +A 20 0A 20 -2,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.977 5.4 169.8-136.6 149.1 16.4 15.1 34.9 11 1136 A K E -A 19 0A 128 8,-1.8 8,-2.7 -2,-0.3 2,-0.1 -0.977 41.8 -99.4-155.7 142.2 15.8 11.9 36.8 12 1137 A A E -A 18 0A 15 -2,-0.3 2,-0.4 77,-0.3 6,-0.3 -0.400 42.4-175.4 -60.3 133.4 17.4 8.4 37.0 13 1138 A A - 0 0 28 4,-2.0 -1,-0.1 1,-0.2 2,-0.0 -0.855 45.9 -40.2-140.7 103.6 15.3 6.1 34.9 14 1139 A G S > S- 0 0 43 -2,-0.4 3,-0.7 2,-0.1 77,-0.5 -0.287 103.3 -14.6 78.6-167.2 16.1 2.4 34.7 15 1140 A S T 3 S- 0 0 48 1,-0.2 45,-0.2 75,-0.1 46,-0.1 -0.561 125.7 -16.4 -78.4 129.7 19.5 0.8 34.6 16 1141 A R T 3 S+ 0 0 97 -2,-0.3 45,-2.0 75,-0.2 2,-0.3 0.801 113.9 99.4 48.8 37.2 22.5 3.0 33.8 17 1142 A K < - 0 0 70 -3,-0.7 -4,-2.0 42,-0.2 2,-0.4 -0.986 55.0-147.8-151.8 165.8 20.4 5.8 32.4 18 1143 A I E -AB 12 58A 0 40,-1.8 40,-3.1 -2,-0.3 2,-0.6 -0.996 15.0-140.4-135.8 134.3 18.8 9.2 32.9 19 1144 A H E -AB 11 57A 52 -8,-2.7 -8,-1.8 -2,-0.4 2,-0.5 -0.863 26.2-173.5 -93.3 118.3 15.6 10.7 31.5 20 1145 A F E +AB 10 56A 0 36,-2.8 36,-2.1 -2,-0.6 2,-0.3 -0.971 9.2 167.8-118.5 121.8 16.3 14.3 30.6 21 1146 A N E +AB 9 55A 44 -12,-3.2 -12,-3.3 -2,-0.5 2,-0.3 -0.850 6.2 170.1-129.5 168.7 13.4 16.6 29.5 22 1147 A W E - 0 0 5 32,-1.9 -15,-0.2 -2,-0.3 -2,-0.0 -0.963 37.7 -88.4-164.2 174.5 12.8 20.3 29.0 23 1148 A L E -A 6 0A 86 -17,-3.2 -17,-1.9 -2,-0.3 32,-0.0 -0.851 48.0-108.6 -99.9 126.6 10.3 22.9 27.6 24 1149 A P - 0 0 72 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.170 40.0-115.0 -50.9 140.9 10.7 23.9 23.9 25 1150 A P - 0 0 8 0, 0.0 -23,-0.0 0, 0.0 -21,-0.0 -0.379 37.2 -81.9 -79.4 159.9 12.1 27.4 23.5 26 1151 A S S S+ 0 0 93 -22,-0.2 -23,-1.2 2,-0.1 2,-0.3 -0.279 99.7 27.1 -56.6 141.9 10.2 30.3 22.0 27 1152 A G S S- 0 0 64 -25,-0.1 -25,-0.1 -3,-0.1 0, 0.0 -0.801 110.9 -42.3 109.2-149.1 10.4 30.2 18.2 28 1153 A K - 0 0 180 -2,-0.3 48,-0.3 -4,-0.0 2,-0.1 -0.714 53.8-172.9-128.9 82.9 10.8 27.3 15.8 29 1154 A P - 0 0 38 0, 0.0 46,-0.2 0, 0.0 3,-0.1 -0.476 12.4-164.7 -72.8 144.0 13.4 24.8 17.0 30 1155 A M - 0 0 110 44,-3.7 2,-0.3 1,-0.3 45,-0.2 0.575 68.7 -35.6-101.3 -15.4 14.2 22.0 14.5 31 1156 A G E -C 74 0B 1 43,-1.2 43,-1.5 2,-0.0 2,-0.3 -0.958 61.6-104.1-178.7-168.0 15.9 19.9 17.1 32 1157 A Y E -CD 73 51B 10 19,-2.5 19,-1.9 -2,-0.3 2,-0.5 -0.997 10.3-147.6-145.9 148.4 18.0 19.9 20.2 33 1158 A R E -CD 72 50B 96 39,-2.0 39,-1.8 -2,-0.3 2,-0.4 -0.964 17.1-159.3-119.7 118.3 21.6 19.1 21.2 34 1159 A V E -CD 71 49B 0 15,-2.9 15,-2.4 -2,-0.5 2,-0.5 -0.797 4.9-167.0-100.7 138.7 22.3 17.7 24.6 35 1160 A K E +CD 70 48B 45 35,-2.6 35,-2.1 -2,-0.4 2,-0.3 -0.990 16.9 166.6-122.6 124.9 25.7 17.9 26.3 36 1161 A Y E +CD 69 47B 24 11,-1.9 11,-2.9 -2,-0.5 2,-0.3 -0.974 5.4 168.3-139.3 155.9 26.3 15.7 29.4 37 1162 A W E -C 68 0B 8 31,-2.2 31,-2.7 -2,-0.3 2,-0.2 -0.990 43.4 -82.9-161.8 159.5 29.3 14.6 31.5 38 1163 A I E > -C 67 0B 44 7,-0.3 3,-2.5 -2,-0.3 29,-0.3 -0.484 61.5 -97.5 -66.8 133.9 30.3 12.9 34.7 39 1164 A Q T 3 S+ 0 0 92 27,-2.8 27,-0.2 1,-0.3 -1,-0.1 -0.327 113.1 26.0 -56.0 125.5 30.3 15.5 37.5 40 1165 A G T 3 S+ 0 0 75 1,-0.5 -1,-0.3 -2,-0.1 2,-0.1 0.091 96.0 116.7 107.1 -22.6 33.8 16.8 38.0 41 1166 A D S < S- 0 0 63 -3,-2.5 -1,-0.5 1,-0.1 2,-0.2 -0.393 73.0-107.0 -76.9 156.4 34.9 16.0 34.4 42 1167 A S > - 0 0 59 1,-0.1 3,-3.6 -3,-0.1 -4,-0.1 -0.570 29.0-116.0 -78.7 147.1 36.0 18.8 32.1 43 1168 A E G > S+ 0 0 86 1,-0.3 3,-1.9 -2,-0.2 -1,-0.1 0.680 115.1 79.5 -58.5 -10.2 33.4 19.5 29.4 44 1169 A S G 3 S+ 0 0 94 1,-0.3 -1,-0.3 -7,-0.0 -3,-0.0 0.712 93.9 46.3 -67.2 -20.3 36.3 18.3 27.3 45 1170 A E G < S+ 0 0 102 -3,-3.6 -7,-0.3 -7,-0.1 -1,-0.3 0.085 91.6 125.1-107.2 19.6 35.1 14.9 28.3 46 1171 A A < - 0 0 22 -3,-1.9 2,-0.3 -9,-0.1 -9,-0.2 -0.341 54.7-132.6 -77.8 161.1 31.4 15.7 27.6 47 1172 A H E -D 36 0B 99 -11,-2.9 -11,-1.9 -2,-0.1 2,-0.5 -0.888 12.9-142.5-115.8 147.8 29.2 13.6 25.3 48 1173 A L E +D 35 0B 90 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.950 20.3 175.0-118.8 125.2 27.0 15.0 22.6 49 1174 A L E -D 34 0B 59 -15,-2.4 -15,-2.9 -2,-0.5 2,-0.3 -0.921 16.8-144.1-126.4 149.6 23.5 13.7 21.7 50 1175 A D E +D 33 0B 81 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.786 17.5 178.1-110.8 155.4 20.9 14.9 19.3 51 1176 A S E -D 32 0B 15 -19,-1.9 -19,-2.5 -2,-0.3 5,-0.1 -0.977 28.8-159.4-156.5 145.1 17.1 14.8 19.6 52 1177 A K S S+ 0 0 139 -2,-0.3 -1,-0.1 -21,-0.2 4,-0.1 0.576 82.9 59.5 -97.2 -14.3 14.1 15.9 17.6 53 1178 A V S S- 0 0 80 2,-0.4 2,-1.7 -21,-0.1 -21,-0.1 -0.795 98.5 -99.4-114.5 158.5 11.8 15.9 20.6 54 1179 A P S S+ 0 0 49 0, 0.0 -32,-1.9 0, 0.0 2,-0.3 -0.026 101.3 45.3 -66.5 32.8 11.9 17.9 23.9 55 1180 A S E -B 21 0A 36 -2,-1.7 -2,-0.4 -34,-0.2 2,-0.3 -0.973 58.8-175.1-165.2 165.3 13.4 14.9 25.8 56 1181 A V E -B 20 0A 22 -36,-2.1 -36,-2.8 -2,-0.3 2,-0.5 -0.965 25.0-123.8-165.2 153.2 16.1 12.3 25.5 57 1182 A E E -B 19 0A 81 -2,-0.3 2,-0.6 -38,-0.2 -38,-0.2 -0.922 21.3-146.1-105.8 125.2 17.3 9.2 27.4 58 1183 A L E -B 18 0A 0 -40,-3.1 -40,-1.8 -2,-0.5 3,-0.2 -0.828 30.7-176.8 -90.2 121.6 21.0 9.3 28.3 59 1184 A T + 0 0 63 -2,-0.6 -42,-0.2 -42,-0.2 -43,-0.1 -0.661 46.7 40.4-120.5 175.2 22.3 5.7 28.1 60 1185 A N S S+ 0 0 151 -45,-0.2 -1,-0.2 -44,-0.2 -43,-0.1 0.846 78.1 152.0 58.8 38.0 25.4 3.6 28.7 61 1186 A L - 0 0 5 -45,-2.0 -1,-0.2 -3,-0.2 6,-0.0 -0.388 51.4 -96.8 -90.3 170.4 26.2 5.6 31.9 62 1187 A Y > - 0 0 154 -2,-0.1 3,-0.6 1,-0.1 28,-0.2 -0.579 44.6-106.9 -84.0 154.0 28.1 4.3 34.9 63 1188 A P T 3 S+ 0 0 16 0, 0.0 29,-0.2 0, 0.0 59,-0.1 -0.483 97.0 9.9 -80.4 154.9 26.0 3.1 37.9 64 1189 A Y T 3 S+ 0 0 66 27,-2.2 2,-0.4 1,-0.2 27,-0.1 0.879 99.3 137.9 42.7 50.5 25.7 5.2 41.0 65 1190 A C < - 0 0 24 -3,-0.6 25,-2.1 26,-0.2 2,-0.4 -0.958 54.5-122.5-128.0 142.4 27.4 8.1 39.2 66 1191 A D E - E 0 89B 65 -2,-0.4 -27,-2.8 23,-0.2 2,-0.3 -0.679 30.5-170.6 -86.1 133.4 26.7 11.8 39.2 67 1192 A Y E -CE 38 88B 6 21,-2.8 21,-2.3 -2,-0.4 2,-0.3 -0.927 13.4-158.5-126.0 149.5 26.0 13.5 35.9 68 1193 A E E +CE 37 87B 48 -31,-2.7 -31,-2.2 -2,-0.3 2,-0.3 -0.898 21.3 169.6-119.6 152.0 25.6 17.1 34.7 69 1194 A M E +CE 36 86B 0 17,-1.9 17,-2.3 -2,-0.3 2,-0.3 -0.989 15.7 179.2-163.9 153.0 23.8 18.1 31.6 70 1195 A K E -C 35 0B 34 -35,-2.1 -35,-2.6 -2,-0.3 2,-0.3 -0.945 13.7-149.4-149.8 163.0 22.4 21.0 29.6 71 1196 A V E -C 34 0B 0 13,-0.3 12,-2.8 -2,-0.3 2,-0.3 -0.988 6.9-169.7-141.3 148.2 20.6 21.3 26.2 72 1197 A C E -C 33 0B 0 -39,-1.8 -39,-2.0 -2,-0.3 2,-0.3 -0.839 19.8-125.5-129.0 168.7 20.3 24.0 23.5 73 1198 A A E -C 32 0B 0 8,-0.4 7,-3.0 -70,-0.3 2,-0.3 -0.760 19.1-163.3-113.4 161.0 18.0 24.3 20.4 74 1199 A Y E +CF 31 79B 39 -43,-1.5 -44,-3.7 -2,-0.3 -43,-1.2 -0.984 17.9 145.5-143.2 154.0 18.9 24.7 16.8 75 1200 A G - 0 0 11 3,-2.2 -43,-0.0 -2,-0.3 0, 0.0 -0.616 64.9 -38.1-154.0-144.5 17.0 25.8 13.7 76 1201 A A S S+ 0 0 81 -48,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.861 133.1 42.9 -65.9 -38.3 17.5 27.6 10.4 77 1202 A Q S S- 0 0 175 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.794 118.4-103.9 -79.8 -30.3 19.8 30.3 11.8 78 1203 A G - 0 0 35 0, 0.0 -3,-2.2 0, 0.0 2,-0.4 -0.997 62.9 -12.8 143.9-147.1 21.9 28.0 13.9 79 1204 A E B -F 74 0B 106 -2,-0.3 -5,-0.3 -5,-0.2 3,-0.1 -0.750 53.3-149.9 -96.3 139.7 22.2 27.1 17.6 80 1205 A G - 0 0 15 -7,-3.0 -77,-0.2 -2,-0.4 -76,-0.1 -0.240 42.6 -63.0 -90.2-174.0 20.6 29.1 20.4 81 1206 A P - 0 0 75 0, 0.0 -8,-0.4 0, 0.0 -1,-0.2 -0.324 56.5-103.0 -72.4 154.4 21.9 29.5 23.9 82 1207 A Y - 0 0 61 -10,-0.2 -10,-0.2 -78,-0.2 -78,-0.1 -0.454 33.3-115.9 -76.4 150.0 22.3 26.5 26.3 83 1208 A S - 0 0 10 -12,-2.8 -77,-0.1 1,-0.2 -1,-0.1 -0.057 47.0 -76.8 -69.2 179.6 19.8 25.9 29.1 84 1209 A S - 0 0 80 -79,-0.3 2,-0.3 1,-0.1 -13,-0.3 -0.296 58.4 -92.6 -74.0 169.1 20.9 26.0 32.7 85 1210 A L - 0 0 66 -15,-0.1 2,-0.3 -3,-0.1 -15,-0.2 -0.663 39.4-170.5 -89.0 136.7 22.8 23.1 34.1 86 1211 A V E -E 69 0B 26 -17,-2.3 -17,-1.9 -2,-0.3 2,-0.3 -0.907 7.7-149.5-122.8 154.1 21.0 20.2 35.9 87 1212 A S E +E 68 0B 65 -2,-0.3 2,-0.3 -19,-0.2 -19,-0.2 -0.887 17.9 168.3-122.3 154.1 22.6 17.3 37.9 88 1213 A C E -E 67 0B 17 -21,-2.3 -21,-2.8 -2,-0.3 2,-0.4 -0.948 23.2-136.6-165.1 142.1 21.4 13.8 38.5 89 1214 A R E -E 66 0B 114 -2,-0.3 -77,-0.3 -23,-0.2 -23,-0.2 -0.854 23.0-123.6-107.9 140.7 22.7 10.5 39.8 90 1215 A T - 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