==== 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 HYDROLASE 29-NOV-06 2O1L . COMPND 2 MOLECULE: LACTOTRANSFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR N.SINGH,S.SHARMA,M.PERBANDT,P.KAUR,C.BETZEL,T.P.SINGH . 341 2 10 9 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15209.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 66.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 10.0 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 . 2 0.6 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 . 1 0.3 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 . 17 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 23.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 1 1 0 0 1 2 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 0 PARALLEL BRIDGES PER LADDER . 0 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 1 342 A Y 0 0 252 0, 0.0 2,-2.2 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 -18.3 42.0 9.6 30.1 2 343 A T + 0 0 58 2,-0.0 2,-0.4 26,-0.0 0, 0.0 -0.620 360.0 142.2 -80.6 80.2 39.9 11.2 27.4 3 344 A R - 0 0 96 -2,-2.2 2,-0.5 25,-0.0 25,-0.2 -0.986 43.2-151.0-131.3 133.8 38.3 7.8 26.9 4 345 A V E -a 28 0A 0 23,-2.2 25,-3.2 -2,-0.4 2,-0.8 -0.912 10.0-145.1-109.0 128.6 34.7 6.9 26.1 5 346 A V E -a 29 0A 37 -2,-0.5 44,-3.3 23,-0.2 45,-1.7 -0.842 17.5-158.8 -93.3 110.0 33.2 3.6 27.1 6 347 A W E -ab 30 50A 1 23,-3.4 25,-2.6 -2,-0.8 2,-0.6 -0.613 11.3-133.7 -84.8 145.3 30.8 2.4 24.5 7 348 A a E -a 31 0A 0 43,-2.3 2,-0.4 -2,-0.2 25,-0.2 -0.909 18.2-160.9-107.0 120.0 28.2 -0.2 25.4 8 349 A A E -a 32 0A 0 23,-3.8 25,-2.1 -2,-0.6 2,-0.7 -0.781 10.4-140.9 -97.3 140.2 27.7 -3.1 23.1 9 350 A V E > -a 33 0A 8 -2,-0.4 4,-0.5 23,-0.2 169,-0.5 -0.876 67.4 -12.5-103.8 107.4 24.6 -5.2 23.1 10 351 A G H > S- 0 0 3 23,-2.5 4,-1.6 -2,-0.7 23,-0.1 -0.025 93.1 -70.0 87.3 164.1 25.3 -8.9 22.6 11 352 A P H > S+ 0 0 60 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.709 126.9 55.1 -65.2 -27.8 28.5 -10.7 21.5 12 353 A E H > S+ 0 0 68 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.911 109.2 45.4 -76.6 -42.7 28.4 -9.5 17.9 13 354 A E H X S+ 0 0 32 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.863 110.8 57.3 -64.5 -36.7 28.2 -5.9 18.7 14 355 A Q H X S+ 0 0 71 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.925 103.8 51.5 -59.3 -45.4 31.0 -6.6 21.3 15 356 A K H X S+ 0 0 140 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.920 113.2 44.2 -58.3 -43.7 33.3 -8.0 18.5 16 357 A K H X S+ 0 0 12 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.887 112.1 52.8 -69.0 -39.5 32.8 -4.8 16.4 17 358 A b H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.903 107.9 51.3 -63.7 -39.9 33.2 -2.6 19.4 18 359 A Q H X S+ 0 0 99 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.888 110.0 49.7 -63.3 -38.4 36.6 -4.3 20.2 19 360 A Q H X S+ 0 0 90 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.913 112.7 47.4 -63.6 -45.8 37.7 -3.8 16.6 20 361 A W H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.896 111.3 51.5 -61.5 -42.4 36.7 -0.1 16.9 21 362 A S H <>S+ 0 0 14 -4,-2.7 5,-2.3 2,-0.2 3,-0.4 0.960 110.9 46.9 -59.3 -55.2 38.5 0.0 20.3 22 363 A Q H ><5S+ 0 0 136 -4,-2.8 3,-1.5 1,-0.2 -2,-0.2 0.925 113.8 47.6 -51.3 -51.6 41.7 -1.4 18.9 23 364 A Q H 3<5S+ 0 0 56 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.753 106.8 58.1 -67.7 -23.6 41.7 0.9 15.8 24 365 A S T ><5S- 0 0 7 -4,-1.7 3,-1.3 -3,-0.4 -1,-0.3 0.367 113.6-113.2 -87.9 5.3 41.0 4.0 18.0 25 366 A G T < 5S- 0 0 53 -3,-1.5 -3,-0.2 1,-0.3 -2,-0.1 0.914 71.9 -62.9 62.6 38.7 44.1 3.5 20.0 26 367 A Q T 3 S- 0 0 34 1,-0.1 4,-1.5 -27,-0.1 -25,-0.1 -0.965 77.7-111.9-144.6 165.0 20.1 -6.2 26.2 36 377 A T H > S+ 0 0 10 140,-0.5 4,-2.5 -2,-0.3 5,-0.2 0.877 117.9 55.4 -62.9 -41.4 19.7 -2.6 25.5 37 378 A D H > S+ 0 0 50 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.901 106.7 50.8 -58.6 -43.5 18.0 -2.0 28.8 38 379 A D H > S+ 0 0 80 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.830 109.1 51.5 -61.6 -37.0 21.1 -3.5 30.6 39 380 A a H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.907 106.7 53.1 -65.9 -43.2 23.3 -1.2 28.6 40 381 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.930 108.3 51.7 -53.3 -48.2 21.2 1.8 29.7 41 382 A V H X S+ 0 0 40 -4,-2.3 4,-2.5 1,-0.2 6,-0.2 0.900 106.7 52.6 -60.1 -41.4 21.7 0.6 33.3 42 383 A L H X>S+ 0 0 29 -4,-1.8 5,-2.4 2,-0.2 6,-1.1 0.940 111.0 47.3 -58.9 -44.8 25.5 0.5 32.8 43 384 A V H ><5S+ 0 0 2 -4,-2.3 3,-0.9 4,-0.2 -2,-0.2 0.944 111.4 51.1 -61.2 -46.8 25.5 4.1 31.5 44 385 A L H 3<5S+ 0 0 44 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.884 110.8 48.0 -57.3 -43.2 23.3 5.2 34.4 45 386 A K H 3<5S- 0 0 119 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.653 116.1-118.7 -71.9 -16.2 25.7 3.5 36.9 46 387 A G T <<5S+ 0 0 41 -4,-1.0 -3,-0.2 -3,-0.9 -2,-0.1 0.557 84.7 117.3 90.2 9.2 28.5 5.2 35.1 47 388 A E S > - 0 0 4 -2,-0.4 4,-2.1 200,-0.2 3,-1.0 -0.397 46.4-102.9 -68.3 154.2 16.2 3.5 18.8 55 396 A G H 3> S+ 0 0 0 197,-0.5 4,-1.9 1,-0.3 5,-0.1 0.789 119.0 57.5 -51.2 -37.8 13.6 6.1 19.8 56 397 A G H 3> S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.848 111.9 42.9 -65.0 -33.6 11.6 3.7 22.1 57 398 A Y H <> S+ 0 0 14 -3,-1.0 4,-3.3 2,-0.2 5,-0.3 0.827 106.6 60.9 -79.3 -32.6 14.7 3.2 24.1 58 399 A I H X S+ 0 0 2 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.904 104.8 50.9 -58.9 -39.0 15.6 6.9 24.0 59 400 A Y H X S+ 0 0 9 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.957 111.1 46.8 -59.3 -51.8 12.3 7.3 25.8 60 401 A T H X S+ 0 0 16 -4,-1.5 4,-0.6 1,-0.2 -2,-0.2 0.927 117.3 43.0 -55.4 -48.5 13.3 4.7 28.4 61 402 A A H ><>S+ 0 0 0 -4,-3.3 5,-2.8 1,-0.2 3,-0.6 0.872 110.4 57.0 -67.8 -37.4 16.7 6.3 28.9 62 403 A G H ><5S+ 0 0 8 -4,-2.8 3,-1.7 -5,-0.3 -1,-0.2 0.883 102.4 53.5 -61.2 -44.9 15.3 9.8 28.8 63 404 A K H 3<5S+ 0 0 36 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.708 108.1 53.0 -63.9 -22.0 13.0 9.0 31.8 64 405 A c T <<5S- 0 0 23 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.350 128.6 -98.4 -94.1 4.4 16.1 7.8 33.6 65 406 A G T < 5S+ 0 0 44 -3,-1.7 195,-0.6 1,-0.3 -3,-0.2 0.438 77.8 137.9 95.5 -0.3 17.9 11.1 32.9 66 407 A L E < -D 259 0A 4 -5,-2.8 -1,-0.3 193,-0.1 193,-0.2 -0.533 39.2-147.8 -75.4 151.5 20.0 10.1 29.9 67 408 A V E -D 258 0A 38 191,-2.8 191,-2.0 -2,-0.2 248,-0.1 -0.918 17.0-102.6-128.4 143.2 20.1 12.7 27.0 68 409 A P E +D 257 0A 11 0, 0.0 189,-0.2 0, 0.0 3,-0.1 -0.363 37.2 171.6 -50.3 140.0 20.4 12.7 23.2 69 410 A V E - 0 0 8 187,-2.8 241,-0.5 1,-0.5 2,-0.3 0.671 61.2 -8.3-122.8 -55.2 23.9 13.5 22.0 70 411 A L E -D 256 0A 0 186,-0.6 186,-3.3 239,-0.1 -1,-0.5 -0.976 65.6-135.2-142.8 154.6 24.2 13.0 18.2 71 412 A A E -DE 255 308A 0 237,-2.4 237,-3.4 -2,-0.3 184,-0.2 -0.850 22.8-107.8-113.7 147.3 21.7 11.5 15.8 72 413 A E E - E 0 307A 8 182,-2.5 2,-0.5 -2,-0.3 235,-0.2 -0.495 32.8-156.6 -65.0 136.0 22.2 9.0 12.9 73 414 A N E - E 0 306A 3 233,-2.7 232,-3.1 -2,-0.2 233,-1.4 -0.970 3.4-157.2-123.2 119.3 21.9 10.7 9.6 74 415 A R E - E 0 304A 51 -2,-0.5 2,-0.6 230,-0.2 230,-0.1 -0.315 40.2 -79.3 -83.3 169.8 21.0 8.6 6.6 75 416 A K + 0 0 132 228,-0.6 2,-0.4 -2,-0.1 -1,-0.1 -0.627 61.7 158.4 -78.5 118.7 21.8 9.7 3.1 76 417 A S - 0 0 35 -2,-0.6 0, 0.0 2,-0.1 0, 0.0 -0.968 38.5-145.5-143.0 128.8 19.3 12.3 1.9 77 418 A S + 0 0 115 -2,-0.4 -1,-0.1 0, 0.0 -2,-0.0 0.739 69.6 102.1 -64.3 -26.0 19.7 14.8 -1.0 78 419 A K S S+ 0 0 149 1,-0.1 -2,-0.1 3,-0.0 9,-0.0 -0.198 72.9 38.3 -62.3 156.8 17.7 17.5 0.7 79 420 A H S S- 0 0 91 8,-0.1 -1,-0.1 2,-0.0 -3,-0.1 0.996 91.6-159.4 57.0 75.9 19.5 20.5 2.4 80 421 A S + 0 0 112 1,-0.2 -2,-0.0 7,-0.0 -1,-0.0 0.692 64.3 22.1 -70.0 -39.6 22.0 20.2 -0.4 81 422 A S S S+ 0 0 125 2,-0.1 -1,-0.2 3,-0.0 2,-0.1 0.581 93.2 104.9-106.9 -13.9 25.4 21.8 0.3 82 423 A L S S- 0 0 93 1,-0.1 5,-0.1 2,-0.1 2,-0.1 -0.464 80.3-110.8 -66.2 135.7 25.3 21.6 4.1 83 424 A D >> - 0 0 101 -2,-0.1 3,-1.9 1,-0.1 4,-0.9 -0.358 23.8-110.5 -70.2 153.2 27.6 18.8 5.3 84 425 A d G >4 S+ 0 0 3 1,-0.3 3,-0.9 2,-0.2 222,-0.1 0.860 114.1 61.1 -50.0 -45.3 26.0 15.7 6.9 85 426 A V G 34 S+ 0 0 30 1,-0.3 224,-2.6 223,-0.1 -1,-0.3 0.705 115.3 34.2 -59.8 -19.2 27.2 16.5 10.4 86 427 A L G <4 S+ 0 0 97 -3,-1.9 -1,-0.3 222,-0.2 -2,-0.2 0.421 92.5 107.2-116.0 -3.9 25.2 19.7 10.4 87 428 A R S << S- 0 0 16 -3,-0.9 2,-0.1 -4,-0.9 -8,-0.1 -0.566 75.0-112.9 -77.4 139.5 22.2 18.7 8.3 88 429 A P - 0 0 72 0, 0.0 2,-0.2 0, 0.0 222,-0.1 -0.467 33.6-111.0 -72.1 145.2 18.9 18.3 10.3 89 430 A T - 0 0 50 1,-0.1 -16,-0.1 -2,-0.1 -17,-0.0 -0.504 20.4-161.7 -79.9 147.0 17.6 14.7 10.5 90 431 A E - 0 0 78 1,-0.2 -1,-0.1 -2,-0.2 2,-0.1 0.690 34.9-126.4-101.4 -21.9 14.4 13.8 8.6 91 432 A G - 0 0 9 159,-0.1 2,-0.3 163,-0.1 -1,-0.2 -0.249 22.8 -88.9 97.2 168.6 13.4 10.6 10.4 92 433 A Y E -F 251 0B 4 159,-2.1 159,-3.6 -2,-0.1 2,-0.7 -0.826 33.2-108.3-118.9 161.8 12.6 7.2 9.0 93 434 A L E -F 250 0B 21 -2,-0.3 111,-1.9 157,-0.2 2,-0.4 -0.787 22.0-148.3 -93.9 114.7 9.4 5.7 7.8 94 435 A A E +FG 249 203B 0 155,-2.5 154,-3.5 -2,-0.7 155,-1.0 -0.621 30.3 174.5 -76.1 126.9 7.8 3.0 9.9 95 436 A V E - G 0 202B 1 107,-2.2 107,-1.3 -2,-0.4 2,-0.5 -0.874 34.6-132.3-131.7 166.7 6.0 0.5 7.6 96 437 A A E - G 0 201B 0 135,-0.4 135,-2.7 -2,-0.3 2,-0.4 -0.987 30.7-165.1-117.0 121.9 4.1 -2.8 7.7 97 438 A V E +HG 230 200B 0 103,-2.4 103,-2.3 -2,-0.5 2,-0.3 -0.889 13.0 168.8-113.9 144.7 5.3 -5.2 5.0 98 439 A V E -H 229 0B 0 131,-2.5 131,-2.4 -2,-0.4 2,-0.3 -0.844 41.7 -87.2-140.1 171.4 3.8 -8.4 3.7 99 440 A K E > -H 228 0B 30 99,-0.5 3,-1.2 -2,-0.3 129,-0.3 -0.684 28.5-134.1 -83.3 139.9 4.3 -10.8 0.7 100 441 A K T 3 S+ 0 0 68 127,-3.0 128,-0.1 -2,-0.3 -1,-0.1 0.921 107.8 58.8 -56.4 -41.9 2.6 -9.8 -2.5 101 442 A A T 3 S+ 0 0 82 126,-0.5 2,-2.1 1,-0.2 -1,-0.3 0.666 83.7 81.5 -63.0 -19.7 1.4 -13.4 -2.8 102 443 A N S X S- 0 0 59 -3,-1.2 3,-1.1 96,-0.1 -1,-0.2 -0.536 79.7-171.8 -83.3 69.0 -0.3 -13.2 0.6 103 444 A E T 3 + 0 0 157 -2,-2.1 3,-0.1 1,-0.2 -2,-0.1 -0.306 58.5 27.5 -66.8 146.5 -3.2 -11.5 -1.3 104 445 A G T 3 S+ 0 0 59 1,-0.3 2,-0.6 -2,-0.0 -1,-0.2 0.560 82.4 129.2 80.7 5.0 -6.0 -10.0 0.7 105 446 A L < + 0 0 4 -3,-1.1 -1,-0.3 -6,-0.2 2,-0.3 -0.858 31.4 156.4 -90.8 122.0 -4.0 -9.3 3.7 106 447 A T > - 0 0 28 -2,-0.6 3,-2.1 -3,-0.1 125,-0.1 -0.831 61.6 -88.3-134.6 178.0 -4.5 -5.6 4.8 107 448 A W G > S+ 0 0 8 125,-0.5 3,-0.8 1,-0.3 4,-0.1 0.829 127.1 55.2 -54.5 -32.3 -4.2 -3.4 7.8 108 449 A N G 3 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.406 107.1 47.3 -84.7 -0.4 -7.8 -4.5 8.5 109 450 A S G < S+ 0 0 37 -3,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.034 75.6 106.7-128.7 30.3 -7.2 -8.2 8.5 110 451 A L X + 0 0 1 -3,-0.8 3,-2.2 -5,-0.1 -2,-0.1 0.722 47.0 110.8 -79.4 -25.4 -4.1 -8.5 10.7 111 452 A K T 3 S+ 0 0 118 1,-0.3 35,-0.2 -4,-0.1 3,-0.1 -0.228 88.6 9.4 -54.0 139.8 -5.9 -10.0 13.7 112 453 A D T 3 S+ 0 0 89 33,-2.9 -1,-0.3 1,-0.2 34,-0.2 0.523 103.6 121.6 64.7 7.1 -5.0 -13.7 14.3 113 454 A K S < S- 0 0 72 -3,-2.2 34,-2.1 32,-0.2 35,-0.8 -0.338 70.7 -96.8 -87.9 178.8 -2.2 -13.4 11.7 114 455 A K E -i 148 0B 65 32,-0.2 84,-2.3 33,-0.2 85,-1.6 -0.842 42.4-158.9-100.2 134.7 1.5 -14.1 12.4 115 456 A S E -ij 149 199B 0 33,-2.3 35,-1.5 -2,-0.4 2,-0.4 -0.840 17.1-155.7-123.9 152.2 3.8 -11.1 13.1 116 457 A e E -ij 150 200B 0 83,-2.5 85,-2.8 -2,-0.3 2,-0.3 -0.989 19.0-179.0-123.6 124.7 7.5 -10.2 13.0 117 458 A H E - 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