==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 25-MAR-10 2X9Z . 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 . 262 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12229.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 159 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 87 33.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 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 PARALLEL BRIDGES PER LADDER . 4 2 1 3 2 3 0 1 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 1 2 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 1 187 A A 0 0 128 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 130.9 -2.3 0.5 -11.2 2 188 A K - 0 0 138 1,-0.1 2,-0.0 40,-0.1 39,-0.0 -0.553 360.0-114.0 -88.5 148.0 -5.1 -2.1 -11.4 3 189 A P - 0 0 1 0, 0.0 2,-0.3 0, 0.0 39,-0.2 -0.370 31.7-143.8 -68.6 160.8 -7.7 -2.5 -14.2 4 190 A K E -A 41 0A 64 37,-1.9 37,-2.9 247,-0.1 2,-0.3 -0.943 16.5-172.9-129.2 152.1 -11.3 -1.9 -13.2 5 191 A I E -A 40 0A 22 -2,-0.3 2,-0.3 35,-0.2 249,-0.2 -0.985 10.9-179.7-145.7 151.1 -14.5 -3.5 -14.4 6 192 A D E -A 39 0A 1 33,-2.0 33,-2.6 -2,-0.3 2,-0.4 -0.985 9.4-159.1-146.2 151.1 -18.3 -3.3 -14.1 7 193 A K E +A 38 0A 0 247,-0.7 2,-0.3 -2,-0.3 31,-0.2 -0.999 31.1 127.6-128.9 134.3 -21.1 -5.4 -15.6 8 194 A D E -A 37 0A 0 29,-2.3 29,-2.7 -2,-0.4 5,-0.2 -0.933 57.9 -59.3-162.1-176.5 -24.7 -4.2 -16.0 9 195 A F E >> S-A 36 0A 15 -2,-0.3 3,-2.2 27,-0.2 4,-0.5 -0.304 82.0 -59.0 -69.9 163.0 -27.5 -3.8 -18.4 10 196 A K T 34 S+ 0 0 128 25,-2.0 -1,-0.2 1,-0.3 25,-0.1 -0.149 125.1 8.6 -46.5 127.6 -27.1 -1.7 -21.5 11 197 A G T 34 S+ 0 0 63 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.398 113.9 81.7 85.7 -1.9 -26.1 1.9 -20.8 12 198 A K T <4 + 0 0 104 -3,-2.2 7,-0.3 7,-0.0 2,-0.2 0.541 54.6 110.2-117.2 -10.1 -25.6 1.3 -17.0 13 199 A A < + 0 0 15 -4,-0.5 25,-0.1 -5,-0.2 -5,-0.1 -0.491 32.6 160.9 -74.2 138.5 -22.1 -0.2 -16.6 14 200 A N - 0 0 67 -2,-0.2 3,-0.1 25,-0.1 -7,-0.1 -0.726 25.2-166.0-161.5 98.9 -19.6 2.2 -14.9 15 201 A P S S+ 0 0 15 0, 0.0 -10,-0.2 0, 0.0 -1,-0.1 0.802 93.7 49.1 -62.8 -30.5 -16.4 0.9 -13.3 16 202 A D S S+ 0 0 94 1,-0.3 -2,-0.0 -12,-0.1 -11,-0.0 0.859 130.8 15.7 -75.1 -37.3 -15.7 4.1 -11.5 17 203 A T S S- 0 0 99 -3,-0.1 -1,-0.3 -11,-0.0 3,-0.1 -0.713 81.4-155.1-140.5 82.8 -19.3 4.4 -10.1 18 204 A P - 0 0 61 0, 0.0 2,-0.1 0, 0.0 -5,-0.1 -0.214 43.2 -77.8 -60.7 153.3 -21.2 1.2 -10.3 19 205 A R > - 0 0 41 -7,-0.3 3,-1.6 1,-0.1 4,-0.2 -0.306 38.3-142.3 -61.7 125.0 -25.0 1.5 -10.4 20 206 A V T 3 S+ 0 0 148 1,-0.3 3,-0.3 -3,-0.1 -1,-0.1 0.753 96.3 38.2 -63.5 -29.9 -26.3 2.2 -6.9 21 207 A D T > S+ 0 0 86 1,-0.2 3,-1.7 2,-0.1 -1,-0.3 0.104 76.4 117.2-108.9 23.3 -29.5 0.1 -7.1 22 208 A K T < + 0 0 17 -3,-1.6 235,-0.4 1,-0.3 -1,-0.2 0.718 61.8 74.4 -69.0 -17.7 -28.1 -2.8 -9.1 23 209 A D T 3 S+ 0 0 124 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.778 80.7 85.5 -60.8 -26.4 -28.8 -5.2 -6.2 24 210 A T S < S- 0 0 82 -3,-1.7 233,-0.3 1,-0.1 2,-0.1 -0.657 87.4-122.2 -81.8 121.8 -32.5 -5.0 -7.1 25 211 A P - 0 0 36 0, 0.0 2,-0.4 0, 0.0 233,-0.3 -0.394 24.4-122.9 -62.1 139.9 -33.5 -7.4 -9.9 26 212 A V E -f 258 0B 49 231,-2.7 233,-2.0 -4,-0.1 2,-0.2 -0.734 28.0-116.2 -85.5 130.4 -35.0 -5.8 -12.9 27 213 A N E +f 259 0B 99 -2,-0.4 2,-0.3 231,-0.2 233,-0.2 -0.483 45.7 159.2 -71.0 131.1 -38.5 -7.0 -13.7 28 214 A H - 0 0 37 231,-2.7 233,-0.4 -2,-0.2 2,-0.3 -0.886 32.6-123.7-140.7 171.2 -38.9 -8.8 -17.1 29 215 A Q > - 0 0 137 -2,-0.3 3,-2.4 231,-0.1 91,-0.3 -0.884 43.0 -86.9-116.7 153.4 -41.3 -11.2 -18.8 30 216 A V T 3 S+ 0 0 77 -2,-0.3 91,-0.2 1,-0.3 3,-0.1 -0.358 118.4 33.9 -56.9 129.9 -40.4 -14.6 -20.4 31 217 A G T 3 S+ 0 0 47 89,-3.1 -1,-0.3 1,-0.4 90,-0.1 0.117 84.3 137.6 106.0 -20.3 -39.3 -13.8 -24.0 32 218 A D < - 0 0 55 -3,-2.4 88,-2.2 87,-0.1 2,-0.7 -0.351 53.0-134.1 -61.1 135.1 -37.7 -10.5 -23.2 33 219 A V E - B 0 119A 87 86,-0.2 2,-0.5 -3,-0.1 86,-0.2 -0.842 23.7-157.2 -90.0 112.9 -34.3 -9.8 -24.9 34 220 A V E - B 0 118A 4 84,-3.5 84,-2.2 -2,-0.7 2,-0.4 -0.827 3.7-145.4-100.4 124.2 -32.1 -8.5 -22.1 35 221 A E E - B 0 117A 108 -2,-0.5 -25,-2.0 82,-0.2 2,-0.3 -0.766 19.0-173.1 -97.6 132.6 -29.1 -6.4 -23.2 36 222 A Y E -AB 9 116A 2 80,-3.2 80,-1.7 -2,-0.4 2,-0.3 -0.814 9.9-168.8-121.1 157.2 -25.9 -6.5 -21.3 37 223 A E E -AB 8 115A 7 -29,-2.7 -29,-2.3 -2,-0.3 2,-0.5 -0.996 9.5-159.8-146.1 145.5 -22.5 -4.7 -21.2 38 224 A I E -AB 7 114A 0 76,-2.5 76,-2.5 -2,-0.3 2,-0.5 -0.995 14.9-166.8-120.8 123.1 -19.2 -5.3 -19.6 39 225 A V E -AB 6 113A 12 -33,-2.6 -33,-2.0 -2,-0.5 2,-0.4 -0.960 5.4-175.6-117.5 127.5 -16.9 -2.2 -19.3 40 226 A T E -AB 5 112A 0 72,-2.8 72,-3.0 -2,-0.5 2,-0.6 -0.980 14.6-151.8-127.2 132.9 -13.2 -2.6 -18.4 41 227 A K E -AB 4 111A 39 -37,-2.9 -37,-1.9 -2,-0.4 70,-0.2 -0.923 10.9-163.0-104.6 120.1 -10.7 0.2 -17.8 42 228 A I E - B 0 110A 0 68,-3.0 68,-2.6 -2,-0.6 3,-0.1 -0.890 23.8-118.8-104.4 128.8 -7.1 -0.8 -18.6 43 229 A P > - 0 0 17 0, 0.0 3,-0.9 0, 0.0 63,-0.3 -0.164 33.8 -88.8 -66.1 157.0 -4.5 1.5 -17.1 44 230 A A T 3 S+ 0 0 45 1,-0.2 63,-0.2 63,-0.2 65,-0.1 -0.298 110.0 21.6 -56.0 147.2 -1.9 3.5 -19.1 45 231 A L T 3 S+ 0 0 124 61,-2.7 -1,-0.2 63,-0.2 59,-0.1 0.771 84.4 168.4 63.2 31.4 1.3 1.8 -19.9 46 232 A A < - 0 0 11 -3,-0.9 59,-2.6 57,-0.4 -1,-0.2 -0.365 23.8-170.2 -68.9 152.0 -0.1 -1.7 -19.5 47 233 A N + 0 0 117 57,-0.2 2,-0.2 58,-0.1 -1,-0.1 -0.302 21.0 168.5-137.3 53.0 2.0 -4.7 -20.7 48 234 A Y - 0 0 17 1,-0.1 92,-0.3 52,-0.1 3,-0.1 -0.438 30.2-165.1 -73.9 139.4 -0.5 -7.6 -20.4 49 235 A A S S+ 0 0 40 90,-2.7 2,-0.4 92,-0.3 91,-0.2 0.660 84.7 28.9 -84.8 -24.0 0.3 -11.0 -21.9 50 236 A T E +H 139 0C 15 89,-1.4 89,-1.2 91,-0.2 2,-0.3 -0.999 52.5 174.3-141.4 135.6 -3.4 -11.9 -21.5 51 237 A A E +H 138 0C 0 -2,-0.4 44,-2.3 44,-0.3 2,-0.4 -0.841 27.2 163.4-136.6 99.0 -6.6 -9.9 -21.4 52 238 A N E -HI 137 94C 34 85,-2.3 85,-2.8 -2,-0.3 2,-0.4 -0.958 24.8-161.1-126.2 136.2 -9.5 -12.4 -21.2 53 239 A W E -HI 136 93C 1 40,-3.0 40,-2.8 -2,-0.4 2,-0.4 -0.958 9.0-171.9-114.5 135.3 -13.2 -12.0 -20.3 54 240 A S E -HI 135 92C 1 81,-2.2 81,-2.0 -2,-0.4 2,-0.4 -0.992 5.5-178.7-130.9 130.2 -15.2 -15.1 -19.3 55 241 A D E +HI 134 91C 0 36,-2.9 36,-1.8 -2,-0.4 2,-0.3 -0.992 7.0 169.4-136.7 128.7 -19.0 -14.9 -18.8 56 242 A R E -HI 133 90C 1 77,-2.2 77,-2.9 -2,-0.4 2,-0.3 -0.969 12.9-159.9-134.2 155.2 -21.6 -17.5 -17.8 57 243 A X E -H 132 0C 2 32,-1.9 75,-0.3 -2,-0.3 6,-0.1 -0.937 25.5 -93.7-139.0 158.6 -25.2 -17.2 -16.8 58 244 A T > - 0 0 1 73,-2.7 3,-2.3 -2,-0.3 72,-0.1 -0.226 46.7-100.5 -72.6 161.7 -27.9 -19.1 -15.0 59 245 A E T 3 S+ 0 0 63 1,-0.3 64,-0.2 64,-0.1 65,-0.1 0.665 115.2 66.3 -66.3 -19.7 -30.3 -21.3 -16.9 60 246 A G T 3 S+ 0 0 0 63,-0.2 61,-2.6 1,-0.1 2,-0.6 0.538 94.9 68.8 -76.2 -8.2 -33.3 -18.9 -17.0 61 247 A L E < S-C 120 0A 5 -3,-2.3 2,-0.8 59,-0.2 59,-0.2 -0.952 74.8-154.4-111.9 113.5 -31.2 -16.7 -19.2 62 248 A A E -C 119 0A 37 57,-3.1 57,-2.5 -2,-0.6 27,-0.1 -0.770 20.7-129.2 -87.5 109.2 -30.5 -18.1 -22.7 63 249 A F E -C 118 0A 14 -2,-0.8 2,-1.0 25,-0.6 55,-0.2 -0.330 18.8-130.4 -53.4 130.4 -27.3 -16.5 -24.0 64 250 A N > - 0 0 34 53,-2.3 3,-1.6 3,-0.0 53,-0.4 -0.743 21.9-143.4 -91.5 98.5 -28.0 -15.1 -27.5 65 251 A K T 3 S+ 0 0 129 -2,-1.0 26,-0.0 1,-0.2 23,-0.0 -0.293 81.4 29.3 -60.9 142.2 -25.2 -16.5 -29.7 66 252 A G T 3 S+ 0 0 57 3,-0.0 -1,-0.2 1,-0.0 -2,-0.0 0.356 93.5 97.9 93.0 -4.6 -23.9 -14.1 -32.4 67 253 A T < + 0 0 41 -3,-1.6 2,-0.4 50,-0.2 -2,-0.1 0.414 47.8 117.5 -97.3 0.7 -24.7 -11.0 -30.4 68 254 A V + 0 0 12 48,-0.1 2,-0.4 -4,-0.1 48,-0.2 -0.564 35.9 175.2 -77.1 126.8 -21.3 -10.2 -28.9 69 255 A K E -D 115 0A 126 46,-2.4 46,-2.6 -2,-0.4 2,-0.4 -0.974 9.5-163.7-126.7 143.6 -19.7 -6.9 -29.9 70 256 A V E +D 114 0A 6 -2,-0.4 7,-2.2 44,-0.2 2,-0.3 -0.993 9.3 175.0-134.8 133.0 -16.4 -5.5 -28.6 71 257 A T E -DE 113 76A 30 42,-2.4 42,-2.5 -2,-0.4 2,-0.5 -0.932 21.8-149.1-130.0 151.5 -15.0 -2.0 -28.8 72 258 A V E > S-DE 112 75A 10 3,-2.5 3,-2.0 -2,-0.3 40,-0.2 -0.998 93.1 -13.1-118.2 124.1 -11.9 -0.2 -27.5 73 259 A D T 3 S- 0 0 65 38,-3.0 -1,-0.1 -2,-0.5 39,-0.1 0.872 131.3 -56.9 48.4 41.0 -12.6 3.5 -26.8 74 260 A D T 3 S+ 0 0 133 37,-0.4 2,-0.5 1,-0.2 -1,-0.3 0.609 112.8 121.4 68.2 15.4 -15.8 3.0 -28.8 75 261 A V E < -E 72 0A 99 -3,-2.0 -3,-2.5 0, 0.0 -1,-0.2 -0.944 68.0-119.1-106.6 122.8 -14.0 1.7 -31.9 76 262 A A E -E 71 0A 67 -2,-0.5 -5,-0.3 -5,-0.2 2,-0.1 -0.339 29.5-118.1 -59.2 134.6 -15.0 -1.8 -33.0 77 263 A L - 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