==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 25-MAR-10 2X9X . COMPND 2 MOLECULE: CELL WALL SURFACE ANCHOR FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR G.SPRAGGON,E.KOESEMA,M.SCARSELLI,E.MALITO,M.BIAGINI,N.NORAIS . 431 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19378.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 272 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 122 28.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 41 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 9.7 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 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 1 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 PARALLEL BRIDGES PER LADDER . 8 3 1 4 4 5 0 0 0 1 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 1 2 2 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 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 1 187 A A 0 0 137 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -61.7 20.8 -42.6 28.2 2 188 A K - 0 0 67 1,-0.1 39,-0.0 40,-0.1 2,-0.0 -0.709 360.0-114.3 -97.6 146.0 23.3 -41.9 25.4 3 189 A P - 0 0 6 0, 0.0 2,-0.3 0, 0.0 39,-0.2 -0.302 28.4-142.3 -69.4 162.8 22.6 -42.1 21.7 4 190 A K E -A 41 0A 85 37,-1.7 37,-2.8 247,-0.1 2,-0.3 -0.943 17.0-172.5-128.7 150.5 24.4 -44.8 19.6 5 191 A I E +A 40 0A 21 -2,-0.3 2,-0.3 10,-0.3 35,-0.2 -0.981 12.0 175.4-143.5 150.9 25.8 -44.6 16.1 6 192 A D E -A 39 0A 2 33,-1.8 33,-2.6 -2,-0.3 2,-0.4 -0.977 9.5-162.6-146.9 149.7 27.3 -46.7 13.3 7 193 A K E +A 38 0A 0 247,-0.4 2,-0.3 -2,-0.3 31,-0.2 -0.999 29.8 131.0-127.1 138.8 28.4 -46.0 9.7 8 194 A D E -A 37 0A 0 29,-2.0 29,-2.5 -2,-0.4 5,-0.1 -0.925 60.9 -53.0-161.8-177.0 29.0 -48.6 7.2 9 195 A F E >> S-A 36 0A 25 -2,-0.3 3,-2.5 27,-0.2 4,-0.7 -0.381 83.1 -71.4 -64.5 151.6 28.2 -49.7 3.6 10 196 A K T 34 S+ 0 0 90 25,-2.2 -1,-0.2 1,-0.3 25,-0.1 -0.224 123.5 16.4 -51.8 124.4 24.4 -49.7 2.9 11 197 A G T 34 S+ 0 0 61 -3,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.303 113.5 75.8 96.5 -7.2 22.9 -52.7 4.7 12 198 A K T <4 + 0 0 107 -3,-2.5 7,-0.3 25,-0.0 -2,-0.2 0.621 61.5 112.0-109.3 -18.4 25.8 -53.3 7.1 13 199 A A < + 0 0 17 -4,-0.7 -5,-0.1 -5,-0.1 25,-0.1 -0.306 33.4 166.9 -65.2 139.8 25.4 -50.5 9.7 14 200 A N - 0 0 62 25,-0.1 -7,-0.1 1,-0.1 -9,-0.1 -0.749 21.3-169.4-157.6 100.8 24.5 -51.6 13.2 15 201 A P S S+ 0 0 9 0, 0.0 -10,-0.3 0, 0.0 -1,-0.1 0.799 91.9 49.0 -65.5 -29.9 24.8 -49.2 16.2 16 202 A D S S+ 0 0 88 1,-0.2 -11,-0.0 -12,-0.1 -2,-0.0 0.880 130.2 14.8 -75.0 -40.0 24.2 -52.0 18.7 17 203 A T S S- 0 0 101 -11,-0.0 -1,-0.2 0, 0.0 3,-0.1 -0.635 81.0-158.4-141.4 76.3 26.7 -54.4 17.2 18 204 A P - 0 0 60 0, 0.0 -5,-0.1 0, 0.0 -10,-0.0 -0.201 34.8 -88.2 -58.3 146.3 29.2 -52.8 14.8 19 205 A R > - 0 0 47 -7,-0.3 3,-0.6 1,-0.1 -5,-0.0 -0.166 30.7-137.4 -53.8 143.9 31.0 -55.0 12.2 20 206 A V T 3 S+ 0 0 145 1,-0.2 3,-0.3 -3,-0.1 -1,-0.1 0.819 94.5 48.6 -79.6 -31.0 34.3 -56.6 13.4 21 207 A D T > + 0 0 81 1,-0.2 3,-1.3 2,-0.1 -1,-0.2 -0.016 67.7 128.7-102.0 33.0 36.4 -56.0 10.3 22 208 A K T < + 0 0 8 -3,-0.6 235,-0.4 1,-0.3 -1,-0.2 0.827 66.7 59.2 -58.7 -36.9 35.7 -52.4 9.6 23 209 A D T 3 S+ 0 0 78 -3,-0.3 -1,-0.3 233,-0.1 -2,-0.1 0.745 84.2 91.9 -68.6 -24.5 39.3 -51.3 9.4 24 210 A T S < S- 0 0 88 -3,-1.3 233,-0.3 1,-0.1 -3,-0.0 -0.620 83.7-121.0 -76.8 115.7 40.1 -53.6 6.5 25 211 A P - 0 0 43 0, 0.0 2,-0.5 0, 0.0 233,-0.3 -0.247 17.4-131.7 -61.4 140.9 39.5 -51.9 3.2 26 212 A V E -f 258 0B 52 231,-2.8 233,-2.0 -4,-0.1 2,-0.3 -0.830 26.0-116.2 -94.9 129.4 37.0 -53.4 0.8 27 213 A N E +f 259 0B 37 -2,-0.5 2,-0.3 231,-0.2 233,-0.2 -0.471 43.5 163.1 -69.2 125.7 38.3 -53.7 -2.8 28 214 A H - 0 0 33 231,-2.5 2,-0.3 -2,-0.3 233,-0.3 -0.902 32.5-121.1-130.8 164.2 36.4 -51.6 -5.4 29 215 A Q > - 0 0 33 -2,-0.3 3,-2.2 231,-0.1 348,-0.2 -0.781 43.8 -85.0-102.3 155.1 37.2 -50.6 -8.9 30 216 A V T 3 S+ 0 0 8 346,-2.0 320,-0.7 -2,-0.3 91,-0.2 -0.292 117.1 31.8 -54.7 135.9 37.5 -47.0 -10.1 31 217 A G T 3 S+ 0 0 19 89,-2.6 -1,-0.3 1,-0.3 90,-0.1 0.243 83.5 140.3 97.5 -13.3 34.0 -45.6 -11.0 32 218 A D < - 0 0 44 -3,-2.2 88,-2.6 87,-0.1 2,-0.7 -0.382 52.2-132.2 -60.7 138.2 32.2 -47.8 -8.4 33 219 A V E - B 0 119A 88 86,-0.2 2,-0.6 -3,-0.1 86,-0.2 -0.863 21.2-152.3 -93.6 113.3 29.4 -46.0 -6.7 34 220 A V E - B 0 118A 3 84,-3.1 84,-1.9 -2,-0.7 2,-0.5 -0.789 4.2-150.7 -92.2 118.1 29.8 -46.7 -3.0 35 221 A E E - B 0 117A 105 -2,-0.6 -25,-2.2 82,-0.2 2,-0.3 -0.779 16.4-170.7 -92.7 127.8 26.6 -46.6 -1.0 36 222 A Y E -AB 9 116A 0 80,-3.1 80,-1.6 -2,-0.5 2,-0.3 -0.779 9.3-165.2-113.6 157.4 26.8 -45.5 2.7 37 223 A E E -AB 8 115A 9 -29,-2.5 -29,-2.0 -2,-0.3 2,-0.5 -0.991 7.0-161.2-142.3 138.5 24.4 -45.5 5.6 38 224 A I E -AB 7 114A 0 76,-2.6 76,-2.6 -2,-0.3 2,-0.5 -0.979 12.3-168.7-111.6 123.5 24.6 -43.8 9.0 39 225 A V E -AB 6 113A 12 -33,-2.6 -33,-1.8 -2,-0.5 2,-0.4 -0.970 5.3-176.6-116.9 125.3 22.3 -45.3 11.6 40 226 A T E -AB 5 112A 0 72,-2.7 72,-3.2 -2,-0.5 2,-0.6 -0.983 15.0-151.3-125.8 126.0 21.7 -43.4 14.9 41 227 A K E -AB 4 111A 38 -37,-2.8 -37,-1.7 -2,-0.4 70,-0.2 -0.852 12.0-164.1 -94.8 123.7 19.7 -44.5 17.9 42 228 A I E - B 0 110A 0 68,-3.2 68,-3.3 -2,-0.6 4,-0.1 -0.943 22.5-118.7-111.1 126.3 18.2 -41.7 19.9 43 229 A P > - 0 0 21 0, 0.0 3,-0.8 0, 0.0 63,-0.3 -0.123 32.0 -96.4 -61.5 153.4 16.9 -42.5 23.4 44 230 A A T 3 S+ 0 0 42 1,-0.2 63,-0.2 63,-0.2 65,-0.1 -0.323 108.3 27.6 -60.7 152.2 13.3 -42.1 24.5 45 231 A L T 3 S+ 0 0 79 61,-2.4 -1,-0.2 1,-0.2 59,-0.1 0.763 84.5 162.7 66.4 26.8 12.5 -38.9 26.3 46 232 A A < - 0 0 7 -3,-0.8 59,-2.6 57,-0.4 -1,-0.2 -0.424 25.8-170.3 -73.7 153.2 15.3 -37.0 24.6 47 233 A N + 0 0 102 57,-0.2 2,-0.1 -2,-0.1 -1,-0.1 -0.330 20.1 169.9-139.0 54.2 15.2 -33.1 24.6 48 234 A Y - 0 0 16 52,-0.2 92,-0.3 1,-0.1 3,-0.1 -0.415 28.9-166.3 -73.2 141.4 18.0 -32.2 22.2 49 235 A A S S+ 0 0 40 90,-2.7 2,-0.3 92,-0.3 91,-0.2 0.627 83.5 29.4 -90.7 -21.7 18.4 -28.6 21.0 50 236 A T E +H 139 0C 15 89,-1.5 89,-1.3 91,-0.2 -1,-0.3 -1.000 51.8 171.3-141.6 137.6 20.7 -29.9 18.3 51 237 A A E +H 138 0C 0 -2,-0.3 44,-2.1 44,-0.3 2,-0.4 -0.787 24.9 165.4-142.6 98.2 21.1 -33.1 16.3 52 238 A N E -HI 137 94C 20 85,-2.7 85,-2.7 -2,-0.3 2,-0.4 -0.953 20.2-165.9-122.0 133.6 23.7 -32.6 13.5 53 239 A W E -HI 136 93C 1 40,-2.8 40,-3.2 -2,-0.4 2,-0.4 -0.944 10.4-179.0-112.9 138.9 25.5 -35.1 11.3 54 240 A S E -HI 135 92C 2 81,-2.0 81,-2.2 -2,-0.4 2,-0.4 -1.000 4.4-173.5-138.5 141.1 28.5 -34.1 9.2 55 241 A D E -HI 134 91C 0 36,-2.5 36,-1.5 -2,-0.4 2,-0.4 -0.995 3.3-178.9-133.2 137.8 30.6 -36.2 6.8 56 242 A R E - I 0 90C 21 77,-1.1 2,-0.3 -2,-0.4 77,-0.2 -0.997 12.9-156.0-135.7 142.4 33.8 -35.4 4.9 57 243 A X - 0 0 1 32,-2.4 75,-0.2 -2,-0.4 6,-0.1 -0.846 22.3-103.9-122.6 152.3 35.7 -37.7 2.5 58 244 A T > - 0 0 3 73,-2.4 3,-2.1 -2,-0.3 72,-0.1 -0.295 48.9 -98.5 -68.6 160.3 39.2 -38.1 1.2 59 245 A E T 3 S+ 0 0 70 1,-0.3 64,-0.2 64,-0.1 65,-0.1 0.667 116.3 66.2 -65.8 -21.4 39.7 -36.9 -2.4 60 246 A G T 3 S+ 0 0 0 63,-0.2 61,-2.8 69,-0.1 2,-0.6 0.516 93.7 69.9 -76.6 -5.5 39.4 -40.2 -4.1 61 247 A L E < S-C 120 0A 4 -3,-2.1 2,-0.8 59,-0.2 59,-0.2 -0.959 72.4-157.3-113.2 114.2 35.8 -40.4 -3.1 62 248 A A E -C 119 0A 37 57,-3.0 57,-2.6 -2,-0.6 27,-0.1 -0.811 19.9-130.1 -92.9 106.5 33.5 -37.9 -4.9 63 249 A F E -C 118 0A 13 -2,-0.8 2,-1.1 25,-0.8 55,-0.3 -0.290 19.4-129.1 -51.3 129.6 30.4 -37.3 -2.8 64 250 A N > - 0 0 36 53,-2.6 3,-1.6 2,-0.0 53,-0.4 -0.742 22.3-140.3 -88.5 99.3 27.3 -37.6 -5.0 65 251 A K T 3 S+ 0 0 125 -2,-1.1 26,-0.0 1,-0.2 23,-0.0 -0.277 83.5 28.5 -58.3 140.3 25.2 -34.5 -4.5 66 252 A G T 3 S+ 0 0 65 1,-0.0 -1,-0.2 50,-0.0 -2,-0.0 0.354 91.3 100.5 92.5 -4.0 21.5 -35.1 -4.3 67 253 A T < + 0 0 42 -3,-1.6 2,-0.3 50,-0.2 -2,-0.1 0.473 47.5 118.1 -93.9 -1.6 21.8 -38.7 -3.0 68 254 A V + 0 0 16 -4,-0.1 2,-0.4 48,-0.1 48,-0.2 -0.514 35.2 174.7 -75.1 125.9 21.0 -37.9 0.7 69 255 A K E -D 115 0A 145 46,-2.4 46,-2.5 -2,-0.3 2,-0.4 -0.996 9.0-165.5-128.1 135.7 17.9 -39.6 2.1 70 256 A V E +D 114 0A 8 -2,-0.4 7,-2.1 44,-0.2 2,-0.3 -0.980 8.8 174.6-128.5 131.6 16.9 -39.4 5.8 71 257 A T E -DE 113 76A 31 42,-2.5 42,-2.6 -2,-0.4 2,-0.5 -0.933 20.1-151.6-129.4 153.3 14.3 -41.5 7.7 72 258 A V E > S-DE 112 75A 11 3,-2.7 3,-1.6 -2,-0.3 40,-0.2 -0.993 90.7 -11.5-123.9 121.5 13.2 -41.8 11.3 73 259 A D T 3 S- 0 0 67 38,-3.0 -1,-0.1 -2,-0.5 39,-0.1 0.882 132.0 -55.9 52.5 39.2 11.8 -45.2 12.2 74 260 A D T 3 S+ 0 0 135 37,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.571 114.6 120.5 73.4 11.5 11.8 -46.0 8.5 75 261 A V E < -E 72 0A 97 -3,-1.6 -3,-2.7 1,-0.0 -1,-0.2 -0.921 67.0-114.3-110.9 130.5 9.6 -42.9 7.8 76 262 A A E -E 71 0A 75 -2,-0.5 -5,-0.2 -5,-0.2 2,-0.1 -0.320 25.1-132.0 -64.5 136.5 10.8 -40.2 5.4 77 263 A L - 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