==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 20-JUL-07 2QOH . COMPND 2 MOLECULE: PROTO-ONCOGENE TYROSINE-PROTEIN KINASE ABL1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.ZHOU,D.DALGARNO,X.ZHU . 552 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27617.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 364 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 0.4 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 . 30 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.8 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 5 1 0 0 2 0 0 2 1 0 2 0 0 0 2 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 4 2 3 3 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 2 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 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 1 228 A G 0 0 107 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -8.9 -11.1 34.4 6.5 2 229 A S > - 0 0 89 1,-0.1 3,-2.2 0, 0.0 0, 0.0 -0.828 360.0 -97.4-122.8 160.6 -7.6 35.1 5.2 3 230 A P T 3 S+ 0 0 128 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.800 120.5 38.9 -40.1 -48.5 -5.5 33.8 2.3 4 231 A N T 3 S+ 0 0 128 2,-0.0 2,-0.1 -3,-0.0 0, 0.0 0.051 82.5 137.9-100.0 27.5 -3.6 31.2 4.3 5 232 A Y < + 0 0 157 -3,-2.2 2,-0.3 2,-0.0 3,-0.0 -0.481 24.3 176.5 -72.6 143.4 -6.3 30.1 6.6 6 233 A D > - 0 0 55 3,-0.2 3,-0.8 -2,-0.1 -2,-0.0 -0.894 28.5-141.2-149.2 113.7 -6.5 26.3 7.2 7 234 A K T 3 S+ 0 0 147 -2,-0.3 -1,-0.0 1,-0.2 -2,-0.0 0.653 99.5 41.3 -53.2 -19.0 -9.1 24.9 9.6 8 235 A W T 3 S+ 0 0 40 66,-0.1 67,-2.3 2,-0.0 -1,-0.2 0.699 86.2 103.7-102.7 -23.5 -6.7 22.3 11.0 9 236 A E B < -a 75 0A 33 -3,-0.8 2,-0.3 65,-0.2 67,-0.2 -0.394 49.1-171.2 -66.4 133.2 -3.4 24.2 11.3 10 237 A M - 0 0 23 65,-2.8 2,-0.5 -2,-0.1 73,-0.1 -0.860 30.6-107.7-119.3 157.7 -2.4 25.3 14.9 11 238 A E > - 0 0 123 -2,-0.3 3,-2.2 1,-0.1 4,-0.3 -0.752 28.2-138.8 -83.6 124.6 0.4 27.5 16.2 12 239 A R G > S+ 0 0 43 -2,-0.5 3,-2.3 1,-0.3 -1,-0.1 0.838 100.6 62.0 -53.8 -38.6 2.9 25.2 17.8 13 240 A T G 3 S+ 0 0 107 1,-0.3 -1,-0.3 3,-0.1 22,-0.1 0.572 89.4 73.1 -67.5 -4.6 3.5 27.6 20.8 14 241 A D G < S+ 0 0 39 -3,-2.2 21,-1.3 21,-0.1 2,-0.4 0.634 92.0 71.5 -78.9 -16.0 -0.2 27.0 21.5 15 242 A I E < S-B 34 0A 11 -3,-2.3 2,-0.6 -4,-0.3 19,-0.2 -0.888 70.5-150.8-110.5 131.5 0.8 23.6 22.7 16 243 A T E -B 33 0A 43 17,-3.6 17,-2.3 -2,-0.4 2,-0.4 -0.862 16.5-151.0 -96.9 121.8 2.8 22.6 25.8 17 244 A M E +B 32 0A 58 -2,-0.6 15,-0.2 15,-0.3 3,-0.1 -0.806 23.3 166.2 -94.2 135.3 4.8 19.5 25.3 18 245 A K E - 0 0 115 13,-2.6 2,-0.3 -2,-0.4 -1,-0.2 0.669 47.7 -29.2-110.0 -90.3 5.4 17.4 28.4 19 246 A H E - 0 0 97 12,-0.4 12,-2.7 13,-0.0 2,-0.4 -0.943 64.7 -89.0-136.6 157.9 6.6 13.8 28.2 20 247 A K E -B 30 0A 78 -2,-0.3 3,-0.5 10,-0.2 10,-0.3 -0.509 50.4-142.4 -67.7 122.1 6.5 10.8 25.9 21 248 A L S > >S+ 0 0 30 8,-1.6 3,-1.3 -2,-0.4 5,-0.5 -0.204 75.3 34.4 -81.5 173.9 3.4 8.9 26.8 22 249 A G G > 5S- 0 0 32 1,-0.3 3,-2.2 2,-0.2 -1,-0.2 0.782 126.1 -77.4 52.8 27.5 2.8 5.1 26.8 23 250 A G G 3 5S- 0 0 77 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.900 86.0 -56.4 49.6 49.0 6.5 4.8 27.9 24 251 A G G X 5S+ 0 0 34 -3,-1.3 3,-1.8 5,-0.3 -1,-0.3 0.434 106.0 131.5 66.3 -3.5 7.8 5.5 24.4 25 252 A Q T < 5S+ 0 0 85 -3,-2.2 -3,-0.1 1,-0.3 -2,-0.1 0.675 74.4 38.9 -54.0 -20.3 5.7 2.5 23.3 26 253 A Y T 3 >> -BC 15 39A 38 5,-3.1 3,-1.4 -2,-0.4 5,-1.1 -0.747 25.6-158.2 -87.5 91.3 -3.4 23.1 24.5 35 262 A K G >45S+ 0 0 112 -2,-1.4 3,-2.3 -21,-1.3 -1,-0.2 0.858 80.9 55.0 -36.3 -65.5 -2.8 26.2 26.7 36 263 A K G 345S+ 0 0 123 -22,-0.4 -1,-0.3 1,-0.3 -21,-0.1 0.740 121.4 29.7 -49.5 -31.0 -5.7 28.3 25.4 37 264 A Y G <45S- 0 0 149 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.315 103.3-128.1-110.8 8.6 -8.4 25.7 26.1 38 265 A S T <<5 + 0 0 103 -3,-2.3 2,-0.4 -4,-0.7 -3,-0.2 0.945 56.8 153.2 40.5 64.5 -6.4 24.2 29.1 39 266 A L E < -C 34 0A 73 -5,-1.1 -5,-3.1 48,-0.0 2,-0.4 -0.982 47.8-131.6-127.5 132.3 -6.8 20.8 27.5 40 267 A T E +C 33 0A 59 -2,-0.4 48,-0.8 -7,-0.2 2,-0.3 -0.703 39.9 171.9 -80.7 131.8 -4.6 17.8 27.9 41 268 A V E -CD 32 87A 0 -9,-2.6 -9,-2.4 -2,-0.4 2,-0.4 -0.855 34.7-116.7-135.5 167.9 -3.9 16.4 24.4 42 269 A A E -CD 31 86A 12 44,-3.0 44,-2.3 -2,-0.3 2,-0.4 -0.875 29.7-165.7-104.5 141.9 -1.7 13.7 22.7 43 270 A V E -CD 30 85A 0 -13,-2.8 -13,-3.5 -2,-0.4 2,-0.4 -0.975 6.9-163.5-134.9 120.4 0.8 15.1 20.2 44 271 A K E -CD 29 84A 54 40,-2.5 40,-1.7 -2,-0.4 -15,-0.2 -0.844 21.1-178.1 -99.9 139.6 2.7 12.9 17.7 45 272 A T E - D 0 83A 17 -17,-2.7 2,-0.3 -2,-0.4 -17,-0.2 -0.732 20.5-119.5-132.8-179.5 5.8 14.5 16.2 46 273 A L - 0 0 47 36,-0.8 2,-0.1 -2,-0.2 5,-0.0 -0.906 13.5-138.7-124.1 153.2 8.7 14.1 13.7 47 274 A K 0 0 189 -2,-0.3 35,-0.2 34,-0.1 -1,-0.0 -0.271 360.0 360.0 -95.9-178.1 12.5 14.0 13.9 48 275 A E 0 0 177 -2,-0.1 -2,-0.0 33,-0.1 -1,-0.0 0.057 360.0 360.0 -90.5 360.0 14.7 15.8 11.3 49 ! 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 50 279 A E > 0 0 183 0, 0.0 4,-1.1 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-153.3 10.0 10.3 7.0 51 280 A V H > + 0 0 49 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.744 360.0 64.9 -67.8 -29.6 7.5 13.1 6.1 52 281 A E H > S+ 0 0 128 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.957 105.5 48.4 -57.4 -48.5 5.4 11.5 3.4 53 282 A E H > S+ 0 0 103 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.870 112.1 48.2 -57.8 -41.8 4.1 9.1 6.0 54 283 A F H X S+ 0 0 6 -4,-1.1 4,-2.8 2,-0.2 5,-0.2 0.954 112.4 47.2 -66.3 -50.5 3.4 11.8 8.6 55 284 A L H X S+ 0 0 70 -4,-2.7 4,-3.3 1,-0.2 -2,-0.2 0.915 111.9 51.5 -58.4 -43.8 1.5 14.0 6.1 56 285 A K H X S+ 0 0 68 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.926 109.8 49.4 -59.8 -45.3 -0.5 11.0 4.9 57 286 A E H X S+ 0 0 14 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.934 113.0 46.8 -58.8 -46.8 -1.4 10.1 8.5 58 287 A A H X S+ 0 0 3 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.945 111.3 52.6 -59.9 -47.1 -2.5 13.7 9.1 59 288 A A H X S+ 0 0 51 -4,-3.3 4,-0.7 1,-0.2 -2,-0.2 0.905 108.4 50.3 -56.3 -45.0 -4.4 13.7 5.9 60 289 A V H >X S+ 0 0 10 -4,-2.8 3,-1.2 1,-0.2 4,-1.1 0.921 108.6 51.6 -60.0 -45.3 -6.3 10.5 6.9 61 290 A M H 3< S+ 0 0 6 -4,-2.2 11,-0.4 1,-0.3 -1,-0.2 0.805 100.0 62.3 -65.5 -27.8 -7.3 11.9 10.2 62 291 A K H 3< S+ 0 0 62 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.780 108.6 46.0 -67.8 -22.1 -8.7 15.1 8.7 63 292 A E H << S+ 0 0 112 -3,-1.2 2,-0.4 -4,-0.7 -2,-0.2 0.691 99.7 71.1 -94.5 -23.1 -11.2 12.8 6.9 64 293 A I < + 0 0 8 -4,-1.1 2,-0.3 -3,-0.1 8,-0.3 -0.803 49.4 168.7-103.6 140.9 -12.5 10.4 9.5 65 294 A K + 0 0 104 -2,-0.4 5,-0.1 6,-0.1 6,-0.1 -0.929 13.6 137.3-150.0 121.2 -14.8 11.3 12.3 66 295 A H > - 0 0 30 3,-0.4 3,-2.2 -2,-0.3 55,-0.1 -0.968 58.6-111.8-163.8 146.9 -16.6 8.9 14.7 67 296 A P T 3 S+ 0 0 84 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.782 119.6 42.9 -49.7 -32.7 -17.4 8.5 18.4 68 297 A N T 3 S+ 0 0 16 49,-0.1 82,-2.7 81,-0.1 2,-0.4 0.060 97.2 82.5-109.4 26.7 -15.1 5.6 18.6 69 298 A L B < S-f 150 0B 1 -3,-2.2 -3,-0.4 80,-0.3 82,-0.2 -0.990 92.8-103.7-124.0 132.0 -12.1 6.9 16.5 70 299 A V - 0 0 10 80,-2.5 2,-0.3 -2,-0.4 -2,-0.1 -0.399 45.9-120.8 -61.2 126.6 -9.6 9.1 18.4 71 300 A Q - 0 0 30 -2,-0.1 16,-2.1 -4,-0.1 2,-0.2 -0.555 10.6-133.8 -80.8 129.0 -10.4 12.6 17.2 72 301 A L E + E 0 86A 3 -11,-0.4 14,-0.3 -2,-0.3 3,-0.1 -0.536 22.5 178.6 -72.6 139.3 -7.9 14.9 15.5 73 302 A L E - 0 0 48 12,-3.9 2,-0.3 1,-0.5 13,-0.2 0.639 58.6 -39.4-112.5 -31.0 -7.9 18.4 17.0 74 303 A G E - E 0 85A 0 11,-2.1 11,-3.4 -64,-0.0 -1,-0.5 -0.987 47.4-133.7-178.2 177.0 -5.2 20.0 14.9 75 304 A V E -aE 9 84A 0 -67,-2.3 -65,-2.8 -2,-0.3 2,-0.4 -0.945 8.5-148.4-145.1 162.4 -1.9 19.8 13.1 76 305 A C E + E 0 83A 0 7,-2.3 7,-2.0 -2,-0.3 -67,-0.1 -0.866 44.0 136.6-132.7 94.7 1.4 21.8 12.7 77 306 A T + 0 0 29 -2,-0.4 5,-0.1 5,-0.2 -1,-0.1 0.146 41.9 91.8-129.1 21.3 2.6 21.0 9.2 78 307 A R S S- 0 0 129 1,-0.3 4,-0.1 3,-0.1 -1,-0.1 0.709 105.0 -8.1 -85.7 -22.8 3.7 24.4 7.8 79 308 A E S S- 0 0 86 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 -0.966 98.0 -38.0-167.1 156.1 7.2 23.8 9.1 80 309 A P S S+ 0 0 75 0, 0.0 -3,-0.1 0, 0.0 -33,-0.1 -0.295 105.5 49.5 -60.6 145.6 9.3 21.4 11.2 81 310 A P S S- 0 0 47 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 0.446 83.2-150.2 -88.5 135.1 8.7 20.0 13.7 82 311 A F - 0 0 32 -35,-0.2 -36,-0.8 -5,-0.1 2,-0.3 -0.409 11.9-161.3 -70.4 142.9 5.4 18.6 12.5 83 312 A Y E -DE 45 76A 30 -7,-2.0 -7,-2.3 -38,-0.2 2,-0.5 -0.951 18.0-165.9-126.1 143.6 2.6 17.9 15.0 84 313 A I E -DE 44 75A 3 -40,-1.7 -40,-2.5 -2,-0.3 2,-0.6 -0.991 21.7-160.0-125.6 114.9 -0.6 15.8 14.9 85 314 A I E +DE 43 74A 0 -11,-3.4 -12,-3.9 -2,-0.5 -11,-2.1 -0.898 16.8 167.4-106.3 117.4 -2.7 16.8 17.8 86 315 A T E -DE 42 72A 18 -44,-2.3 -44,-3.0 -2,-0.6 -14,-0.2 -0.835 41.7 -84.5-125.8 162.4 -5.5 14.5 19.1 87 316 A E E -D 41 0A 43 -16,-2.1 2,-0.4 -2,-0.3 -46,-0.2 -0.202 47.9-117.7 -58.0 154.6 -7.7 14.2 22.1 88 317 A F - 0 0 58 -48,-0.8 2,-0.8 -47,-0.1 -1,-0.1 -0.830 13.1-147.0-102.1 133.6 -6.2 12.5 25.1 89 318 A M > - 0 0 15 -2,-0.4 3,-2.3 1,-0.1 53,-0.3 -0.883 11.8-150.2-102.8 105.0 -7.7 9.3 26.4 90 319 A T T 3 S+ 0 0 87 -2,-0.8 53,-0.2 1,-0.3 -1,-0.1 0.705 88.7 51.1 -48.7 -31.4 -7.1 9.4 30.2 91 320 A Y T 3 S- 0 0 107 51,-2.0 -1,-0.3 1,-0.3 52,-0.2 0.374 98.5-139.4 -93.6 8.3 -6.9 5.6 30.7 92 321 A G < - 0 0 32 -3,-2.3 50,-3.1 50,-0.3 -1,-0.3 -0.248 50.6 -8.7 72.9-160.0 -4.3 4.9 28.1 93 322 A N B > -G 141 0B 8 48,-0.2 4,-2.3 1,-0.1 48,-0.3 -0.427 58.9-125.1 -80.5 151.7 -4.3 1.9 25.7 94 323 A L H > S+ 0 0 0 46,-2.3 4,-3.1 43,-0.7 5,-0.3 0.786 105.2 61.4 -61.9 -38.0 -6.7 -1.1 26.0 95 324 A L H > S+ 0 0 18 42,-1.1 4,-2.2 45,-0.3 -1,-0.2 0.972 112.6 37.7 -57.0 -52.8 -4.0 -3.8 26.2 96 325 A D H > S+ 0 0 50 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.901 114.8 55.7 -65.7 -38.7 -2.6 -2.3 29.4 97 326 A Y H < S+ 0 0 35 -4,-2.3 4,-0.5 1,-0.2 3,-0.2 0.934 111.1 43.6 -60.0 -45.7 -6.0 -1.4 30.7 98 327 A L H >< S+ 0 0 0 -4,-3.1 3,-0.8 1,-0.2 -1,-0.2 0.885 111.3 54.2 -65.5 -42.7 -7.2 -5.0 30.3 99 328 A R H 3< S+ 0 0 122 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.791 116.9 36.7 -63.2 -28.6 -4.0 -6.5 31.8 100 329 A E T 3< S+ 0 0 156 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.346 93.7 112.2-109.7 8.5 -4.2 -4.4 34.9 101 330 A C S < S- 0 0 24 -3,-0.8 2,-0.5 -4,-0.5 -3,-0.0 -0.394 71.7-112.7 -88.7 157.6 -7.9 -4.3 35.6 102 331 A N > - 0 0 100 1,-0.1 4,-2.6 -2,-0.1 3,-0.3 -0.746 30.1-145.0 -78.6 127.0 -10.1 -5.7 38.4 103 332 A R T 4 S+ 0 0 138 -2,-0.5 -1,-0.1 1,-0.2 5,-0.1 0.518 95.0 57.2 -79.8 -3.1 -12.1 -8.3 36.5 104 333 A Q T 4 S+ 0 0 179 3,-0.1 3,-0.4 1,-0.0 -1,-0.2 0.759 112.1 44.2 -89.7 -29.3 -15.3 -7.9 38.5 105 334 A E T 4 S+ 0 0 118 1,-0.3 2,-1.6 -3,-0.3 -2,-0.2 0.957 116.8 45.3 -73.7 -53.0 -15.2 -4.3 37.5 106 335 A V S < S+ 0 0 0 -4,-2.6 -1,-0.3 4,-0.1 -5,-0.0 -0.599 96.4 172.7 -90.7 74.8 -14.4 -5.1 33.9 107 336 A S > - 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