==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 20-APR-99 1QBH . COMPND 2 MOLECULE: INHIBITOR OF APOPTOSIS PROTEIN (2MIHB/C-IAP-1); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.G.HINDS,R.S.NORTON,D.L.VAUX,C.L.DAY . 101 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7259.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 48 47.5 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 . 2 2.0 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 . 0 0.0 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 . 2 2.0 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 . 7 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 5.0 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 2 0 0 1 1 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 263 A G 0 0 131 0, 0.0 2,-0.3 0, 0.0 45,-0.0 0.000 360.0 360.0 360.0 77.4 -17.0 -3.2 -10.1 2 264 A S - 0 0 69 0, 0.0 2,-0.9 0, 0.0 3,-0.1 -0.859 360.0-123.0-126.3 158.8 -15.4 -3.7 -13.5 3 265 A H S S+ 0 0 150 -2,-0.3 6,-0.0 1,-0.2 0, 0.0 -0.791 78.1 107.2-107.9 83.8 -14.5 -7.0 -15.2 4 266 A M S S+ 0 0 67 -2,-0.9 -1,-0.2 4,-0.0 3,-0.0 -0.143 72.1 67.1-140.8 26.1 -10.8 -6.6 -15.8 5 267 A Q S S+ 0 0 98 -3,-0.1 2,-0.2 4,-0.1 -2,-0.1 -0.074 100.2 46.4-139.2 22.9 -10.1 -9.0 -13.0 6 268 A T S > S+ 0 0 64 4,-0.0 2,-2.9 5,-0.0 3,-1.7 -0.618 82.1 58.8-147.0-163.0 -11.5 -12.1 -14.6 7 269 A H T 3 S- 0 0 134 1,-0.3 -3,-0.0 -2,-0.2 -4,-0.0 -0.201 133.1 -43.0 61.4 -45.6 -11.2 -13.8 -18.1 8 270 A A T >> S+ 0 0 56 -2,-2.9 3,-2.0 0, 0.0 4,-1.1 0.135 114.8 107.6 178.2 -24.1 -7.4 -14.1 -17.9 9 271 A A H X> S+ 0 0 2 -3,-1.7 3,-1.0 1,-0.3 4,-0.6 0.799 72.7 62.6 -37.0 -52.3 -6.6 -10.7 -16.5 10 272 A R H >4 S+ 0 0 142 -4,-0.3 3,-0.5 1,-0.3 -1,-0.3 0.855 115.3 31.7 -44.4 -44.3 -5.7 -12.3 -13.1 11 273 A M H <4 S+ 0 0 132 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.543 105.5 75.7 -98.0 -2.2 -2.9 -14.2 -14.8 12 274 A R H << S+ 0 0 136 -4,-1.1 -1,-0.2 -3,-1.0 -2,-0.2 0.576 107.2 32.7 -81.0 -10.7 -2.3 -11.5 -17.3 13 275 A T S << S+ 0 0 1 -4,-0.6 21,-0.5 -3,-0.5 -1,-0.2 0.375 98.5 83.0-120.3 -9.3 -0.6 -9.5 -14.5 14 276 A F S S+ 0 0 75 20,-0.3 -2,-0.1 -4,-0.2 -3,-0.1 0.408 75.9 90.0 -80.1 0.3 0.9 -12.4 -12.6 15 277 A M S S- 0 0 82 24,-0.3 2,-0.3 1,-0.2 6,-0.3 0.853 80.6 -99.6 -64.9-114.3 3.7 -12.4 -15.1 16 278 A Y - 0 0 113 4,-0.1 -1,-0.2 1,-0.1 5,-0.1 -0.998 4.1-125.9-176.2 171.3 6.7 -10.3 -14.2 17 279 A W S S+ 0 0 29 -2,-0.3 4,-0.1 3,-0.1 -1,-0.1 0.760 101.4 4.5-105.4 -49.9 8.9 -7.2 -14.4 18 280 A P S S- 0 0 88 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.479 131.8 -53.8 -92.6 -88.6 12.4 -8.1 -15.4 19 281 A S S S- 0 0 94 1,-0.6 2,-0.2 -4,-0.1 -3,-0.0 0.132 123.5 -0.4-136.6 16.5 12.2 -11.9 -16.0 20 282 A S S S- 0 0 81 0, 0.0 -1,-0.6 0, 0.0 -3,-0.1 -0.717 83.2-100.7 166.8 151.8 10.5 -13.1 -12.6 21 283 A V + 0 0 21 -6,-0.3 -5,-0.0 -2,-0.2 0, 0.0 -0.822 35.1 174.9 -96.8 97.7 9.5 -11.0 -9.5 22 284 A P + 0 0 113 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.113 59.0 88.6 -84.6 19.9 12.2 -11.4 -6.8 23 285 A V S S- 0 0 43 36,-0.0 3,-0.1 37,-0.0 36,-0.1 0.545 106.3 -67.0 -87.0-122.4 10.4 -8.8 -4.6 24 286 A Q >> + 0 0 98 1,-0.1 3,-1.7 2,-0.0 4,-1.7 -0.709 53.0 178.4-132.5 80.4 7.6 -9.9 -2.2 25 287 A P H 3> S+ 0 0 39 0, 0.0 4,-1.5 0, 0.0 8,-0.1 0.697 76.7 62.3 -70.9 -14.1 4.9 -11.1 -4.5 26 288 A E H 34 S+ 0 0 177 2,-0.2 -2,-0.0 1,-0.2 4,-0.0 0.778 109.1 42.8 -76.9 -26.1 2.6 -12.0 -1.7 27 289 A Q H X> S+ 0 0 69 -3,-1.7 4,-2.1 2,-0.2 3,-1.6 0.795 106.5 62.0 -85.1 -32.8 2.6 -8.3 -0.7 28 290 A L H 3X>S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.3 5,-1.8 0.906 95.7 61.4 -55.5 -41.3 2.2 -7.3 -4.3 29 291 A A H 3<5S+ 0 0 38 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.571 111.5 38.2 -63.1 -13.7 -1.1 -9.1 -4.3 30 292 A S H <45S+ 0 0 57 -3,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.661 114.0 54.7-105.8 -32.0 -2.2 -6.7 -1.6 31 293 A A H <5S- 0 0 0 -4,-2.1 -2,-0.2 2,-0.1 -3,-0.2 0.742 120.0-103.9 -77.6 -24.2 -0.5 -3.6 -3.2 32 294 A G T <5S+ 0 0 0 -4,-2.5 2,-0.3 1,-0.6 -3,-0.2 0.820 86.6 101.1 104.2 43.8 -2.2 -4.2 -6.6 33 295 A F > < + 0 0 1 -5,-1.8 3,-0.7 1,-0.4 -1,-0.6 -0.885 59.7 43.0-144.0 164.7 0.5 -5.7 -8.7 34 296 A Y T 3 S- 0 0 58 -21,-0.5 2,-2.1 -2,-0.3 -1,-0.4 0.951 138.8 -17.1 52.9 100.0 1.2 -9.3 -9.6 35 297 A Y T 3 S+ 0 0 79 1,-0.2 -1,-0.2 4,-0.1 -21,-0.2 -0.165 142.3 63.1 72.8 -43.1 -2.2 -10.7 -10.6 36 298 A V S < S+ 0 0 16 -2,-2.1 9,-0.3 -3,-0.7 -1,-0.2 0.393 97.2 63.3 -97.5 -2.9 -3.8 -7.8 -8.8 37 299 A G S S- 0 0 0 7,-0.2 2,-0.4 -27,-0.2 -4,-0.2 -0.118 93.5 -99.2 -94.3-153.9 -2.2 -5.2 -11.2 38 300 A R > - 0 0 85 -6,-0.2 5,-1.8 -25,-0.1 2,-0.5 -0.948 62.6 -46.2-145.5 121.9 -3.0 -4.9 -14.9 39 301 A N T 5S- 0 0 55 -2,-0.4 -24,-0.3 -30,-0.3 3,-0.2 -0.528 102.6 -36.9 68.5-102.9 -0.9 -6.2 -17.8 40 302 A D T 5S+ 0 0 68 -2,-0.5 2,-2.4 1,-0.2 -1,-0.1 0.749 136.7 48.2-117.4 -67.8 2.9 -5.5 -17.7 41 303 A D T 5S- 0 0 87 1,-0.1 -1,-0.2 -4,-0.1 9,-0.1 -0.534 106.1-125.4 -76.0 62.5 3.4 -2.0 -16.2 42 304 A V T 5 + 0 0 1 -2,-2.4 -3,-0.2 -3,-0.2 -1,-0.1 0.116 37.1 180.0 -22.8 90.1 0.9 -3.2 -13.5 43 305 A K < - 0 0 108 -5,-1.8 7,-1.0 1,-0.2 -1,-0.2 0.662 31.3-131.6 -77.7 -22.0 -1.6 -0.4 -13.8 44 306 A C - 0 0 8 5,-0.1 -1,-0.2 2,-0.1 -7,-0.2 -0.244 11.0-105.1 86.5-179.9 -3.8 -1.6 -11.0 45 307 A F S S+ 0 0 56 -9,-0.3 -8,-0.1 -2,-0.1 -1,-0.1 0.807 106.9 21.7-106.2 -58.7 -7.6 -2.0 -11.2 46 308 A C S S+ 0 0 58 3,-0.0 26,-0.5 -44,-0.0 2,-0.1 0.643 101.3 104.3 -92.9 -22.7 -9.4 0.7 -9.3 47 309 A C B -A 71 0A 14 24,-0.2 24,-0.3 1,-0.1 3,-0.2 -0.382 57.1-159.9 -58.5 135.9 -6.4 3.0 -9.4 48 310 A D S S+ 0 0 128 22,-1.5 -1,-0.1 1,-0.2 23,-0.1 0.557 90.5 27.8 -92.1 -13.5 -6.7 5.8 -11.9 49 311 A G S S+ 0 0 15 21,-0.7 2,-0.3 -6,-0.1 -1,-0.2 -0.211 74.6 146.6-150.7 51.1 -2.9 6.1 -11.8 50 312 A G + 0 0 0 -7,-1.0 2,-0.2 -3,-0.2 14,-0.1 -0.716 11.0 149.4 -94.3 147.9 -0.8 3.0 -11.0 51 313 A L - 0 0 82 -2,-0.3 2,-0.3 12,-0.1 16,-0.1 -0.710 35.5-123.6-149.4-165.5 2.7 2.3 -12.6 52 314 A R + 0 0 52 -2,-0.2 -11,-0.0 1,-0.1 -9,-0.0 -0.954 32.4 157.6-149.4 148.8 5.9 0.5 -11.3 53 315 A C - 0 0 84 -2,-0.3 -1,-0.1 0, 0.0 -12,-0.0 0.336 29.3-157.5-156.2 3.0 9.5 1.9 -11.0 54 316 A W - 0 0 53 5,-0.0 3,-0.0 2,-0.0 -2,-0.0 0.635 12.8-176.2 1.8 103.5 11.2 -0.5 -8.4 55 317 A E - 0 0 119 4,-0.2 2,-0.5 1,-0.1 -1,-0.0 0.867 55.7 -24.1 -81.9-104.9 14.1 1.2 -6.8 56 318 A S S S- 0 0 115 1,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.616 119.3 -44.6-122.5 74.2 16.4 -0.5 -4.3 57 319 A G S S+ 0 0 81 -2,-0.5 2,-0.1 1,-0.2 -1,-0.1 0.951 93.2 170.0 69.3 48.9 14.5 -3.4 -2.7 58 320 A D - 0 0 49 1,-0.1 -1,-0.2 2,-0.0 -4,-0.0 -0.446 36.9-102.8 -92.5 165.1 11.6 -1.1 -2.3 59 321 A D > - 0 0 63 -2,-0.1 4,-0.9 1,-0.1 3,-0.3 -0.494 21.0-127.8 -80.9 155.5 8.1 -2.1 -1.2 60 322 A P H > S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.654 107.2 59.2 -76.1 -14.3 5.3 -2.3 -3.9 61 323 A W H 4 S+ 0 0 19 2,-0.2 -3,-0.0 1,-0.1 -33,-0.0 0.704 97.2 48.6 -87.9 -37.0 3.4 -0.1 -1.7 62 324 A V H >4 S+ 0 0 26 -3,-0.3 3,-0.7 3,-0.1 -1,-0.1 0.867 118.3 46.5 -74.2 -32.1 5.4 3.1 -1.3 63 325 A E H >X S+ 0 0 1 -4,-0.9 3,-1.9 1,-0.3 2,-1.9 0.966 113.3 50.1 -67.0 -50.8 5.7 2.9 -5.1 64 326 A H T 3< S+ 0 0 0 -4,-1.7 -1,-0.3 1,-0.3 -14,-0.1 -0.442 112.6 47.2 -91.3 57.5 2.0 2.3 -5.1 65 327 A A T <4 S+ 0 0 0 -2,-1.9 -1,-0.3 -3,-0.7 -2,-0.2 0.161 102.6 60.9-168.2 14.0 1.4 5.2 -2.8 66 328 A K T <4 S+ 0 0 72 -3,-1.9 -2,-0.2 21,-0.0 -3,-0.1 0.450 115.6 24.2-123.4 -4.7 3.5 7.9 -4.6 67 329 A W S < S+ 0 0 53 -4,-0.6 -3,-0.1 -16,-0.1 -4,-0.1 0.498 89.0 106.9-131.2 -15.6 1.8 8.0 -8.0 68 330 A F - 0 0 25 -5,-0.3 3,-0.2 1,-0.2 -18,-0.1 -0.476 44.9-169.7 -68.7 123.0 -1.8 6.8 -7.4 69 331 A P S S- 0 0 60 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.659 81.8 -10.6 -80.9 -16.9 -4.1 9.8 -7.6 70 332 A R + 0 0 132 -3,-0.0 -22,-1.5 0, 0.0 -21,-0.7 -0.829 55.9 178.6-170.6 151.4 -6.8 7.5 -6.3 71 333 A C B > -A 47 0A 0 -2,-0.3 4,-0.8 -24,-0.3 -24,-0.2 -0.657 7.5-176.7-161.2 89.3 -6.9 3.7 -5.8 72 334 A E T 4 S+ 0 0 120 -26,-0.5 -25,-0.1 1,-0.2 4,-0.1 0.782 83.7 61.6 -67.2 -24.1 -10.4 3.2 -4.3 73 335 A F T 4 S+ 0 0 47 1,-0.2 3,-0.5 2,-0.1 -1,-0.2 0.953 115.6 29.5 -57.8 -57.6 -9.4 -0.5 -4.1 74 336 A L T >>S+ 0 0 6 1,-0.2 5,-1.6 2,-0.1 4,-0.7 0.405 93.2 94.5 -92.1 2.2 -6.6 0.3 -1.9 75 337 A I T <5S+ 0 0 61 -4,-0.8 -1,-0.2 3,-0.2 -2,-0.1 0.468 74.8 79.4 -73.4 6.5 -8.1 3.4 -0.3 76 338 A R T 45S- 0 0 164 -3,-0.5 4,-0.4 3,-0.2 -1,-0.1 0.983 113.3 -8.1 -83.0 -81.8 -9.3 1.0 2.5 77 339 A M T 4>S+ 0 0 126 2,-0.1 5,-0.6 1,-0.1 -2,-0.1 0.685 145.0 43.0 -96.3 -17.9 -6.7 0.0 5.0 78 340 A K T >X>S+ 0 0 55 -4,-0.7 3,-1.8 3,-0.2 5,-1.3 0.878 110.2 53.1 -87.8 -46.0 -4.0 1.7 3.1 79 341 A G T 345S+ 0 0 123 -3,-1.8 4,-0.9 -4,-0.0 -3,-0.2 0.505 123.7 50.1-142.1 -50.6 -3.6 4.5 7.4 82 344 A F H >XX S+ 0 0 2 -4,-2.7 4,-1.1 1,-0.3 3,-0.7 0.844 107.7 53.4 -62.2 -35.2 3.0 8.2 3.7 87 349 A Q H 3< S+ 0 0 100 -4,-3.6 -1,-0.3 1,-0.3 6,-0.2 0.726 98.8 65.3 -75.2 -18.8 1.6 11.6 3.0 88 350 A G H <4 S+ 0 0 67 -3,-0.6 -1,-0.3 -5,-0.3 -2,-0.2 0.839 111.0 35.8 -65.5 -29.6 3.3 12.6 6.3 89 351 A R H << S+ 0 0 143 -3,-0.7 -2,-0.2 -4,-0.7 -1,-0.2 0.594 113.8 63.1 -93.3 -23.0 6.5 11.9 4.5 90 352 A Y >< + 0 0 50 -4,-1.1 3,-0.9 -7,-0.2 4,-0.2 -0.767 48.5 163.3-111.4 81.7 5.3 13.2 1.1 91 353 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.480 83.8 54.3 -77.0 -0.6 4.5 16.9 1.3 92 354 A H T 3 S+ 0 0 128 1,-0.1 4,-0.1 -3,-0.1 -5,-0.0 -0.331 76.6 110.8-120.2 39.5 4.7 16.9 -2.5 93 355 A L < + 0 0 49 -3,-0.9 3,-0.1 -6,-0.2 -1,-0.1 0.920 59.8 74.6 -80.3 -45.9 2.1 14.1 -2.8 94 356 A L S S- 0 0 141 -4,-0.2 2,-0.1 1,-0.2 0, 0.0 -0.073 102.6 -70.2 -65.8 165.6 -0.7 16.2 -4.3 95 357 A E - 0 0 173 1,-0.1 -1,-0.2 -26,-0.1 -2,-0.1 -0.383 49.0-177.4 -64.6 130.7 -0.9 17.4 -7.9 96 358 A Q - 0 0 142 1,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.832 42.2 -76.4 -93.7 -97.6 1.6 20.2 -8.7 97 359 A L + 0 0 131 1,-0.0 -1,-0.3 2,-0.0 2,-0.0 -0.856 48.0 163.3-157.2 177.0 1.5 21.6 -12.2 98 360 A L S S- 0 0 158 -2,-0.3 -1,-0.0 -3,-0.1 -3,-0.0 -0.119 78.6 -12.9-162.7 -84.1 2.7 20.2 -15.5 99 361 A S S S+ 0 0 107 -2,-0.0 2,-1.1 0, 0.0 -2,-0.0 -0.459 80.8 158.7-132.0 51.5 1.4 21.6 -18.8 100 362 A T 0 0 106 1,-0.2 0, 0.0 0, 0.0 0, 0.0 -0.720 360.0 360.0 -87.1 94.7 -1.4 23.6 -17.2 101 363 A S 0 0 189 -2,-1.1 -1,-0.2 0, 0.0 0, 0.0 0.545 360.0 360.0-120.7 360.0 -2.3 26.4 -19.7