==== 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 METAL BINDING PROTEIN 07-SEP-07 2R71 . COMPND 2 MOLECULE: LACTOTRANSFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR R.MIR,R.JAIN,S.KUMAR,M.SINHA,N.SINGH,S.SHARMA,P.KAUR,T.P.SIN . 341 2 10 9 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15205.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 64.8 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 . 32 9.4 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 . 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 . 14 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 13.5 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 . 8 2.3 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 1 0 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 3 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 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 0 198 0, 0.0 2,-0.2 0, 0.0 264,-0.0 0.000 360.0 360.0 360.0 148.5 41.4 13.7 27.6 2 343 A T - 0 0 75 1,-0.1 2,-0.1 263,-0.0 25,-0.0 -0.658 360.0-105.7 -94.7 163.7 39.7 10.8 29.2 3 344 A R - 0 0 132 -2,-0.2 2,-0.5 25,-0.0 25,-0.2 -0.448 26.3-122.3 -78.6 163.3 38.7 7.8 27.1 4 345 A V E -a 28 0A 1 23,-2.0 25,-2.5 -2,-0.1 2,-0.7 -0.945 17.0-147.0-103.9 128.6 35.1 7.1 26.1 5 346 A V E -a 29 0A 21 -2,-0.5 44,-3.3 23,-0.2 45,-1.4 -0.874 16.5-156.9 -94.0 109.7 33.7 3.7 27.2 6 347 A W E -ab 30 50A 2 23,-3.3 25,-3.0 -2,-0.7 2,-0.6 -0.593 10.5-131.7 -83.5 146.7 31.2 2.6 24.6 7 348 A a E -a 31 0A 0 43,-2.4 2,-0.4 -2,-0.2 25,-0.2 -0.909 19.0-160.3-104.9 119.7 28.5 0.0 25.5 8 349 A A E -a 32 0A 0 23,-3.0 25,-2.7 -2,-0.6 2,-0.9 -0.787 11.8-140.0 -98.2 134.4 28.1 -2.9 23.1 9 350 A V E -a 33 0A 12 -2,-0.4 169,-0.5 23,-0.2 4,-0.5 -0.823 67.7 -23.7 -99.0 100.8 24.9 -5.0 23.1 10 351 A G S > S- 0 0 4 23,-2.6 4,-1.8 -2,-0.9 3,-0.2 -0.061 92.0 -60.1 85.9 174.3 25.8 -8.7 22.7 11 352 A P H > S+ 0 0 56 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.747 126.8 53.3 -69.3 -31.3 28.9 -10.5 21.2 12 353 A E H > S+ 0 0 56 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.896 112.0 44.8 -73.6 -39.6 28.8 -9.2 17.7 13 354 A E H > S+ 0 0 32 -4,-0.5 4,-2.8 2,-0.2 -1,-0.2 0.876 110.1 57.0 -67.5 -38.3 28.7 -5.6 18.8 14 355 A Q H X S+ 0 0 66 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.911 105.8 50.1 -57.1 -46.5 31.5 -6.4 21.3 15 356 A K H X S+ 0 0 137 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.911 112.5 46.3 -57.8 -45.8 33.7 -7.7 18.4 16 357 A K H X S+ 0 0 8 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.920 112.5 51.1 -64.9 -42.5 33.1 -4.5 16.3 17 358 A b H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.903 106.9 53.7 -59.9 -43.7 33.8 -2.3 19.4 18 359 A Q H X S+ 0 0 101 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.884 108.4 49.7 -58.4 -42.4 37.0 -4.2 20.1 19 360 A Q H X S+ 0 0 92 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.925 112.4 47.1 -59.8 -47.9 38.2 -3.5 16.6 20 361 A W H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.849 110.7 53.5 -61.5 -37.6 37.3 0.2 16.9 21 362 A S H <>S+ 0 0 10 -4,-2.5 5,-2.7 2,-0.2 6,-0.3 0.941 110.2 46.5 -63.3 -50.2 39.1 0.3 20.3 22 363 A Q H ><5S+ 0 0 146 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.913 115.3 46.2 -53.3 -51.9 42.3 -1.1 18.8 23 364 A Q H 3<5S+ 0 0 75 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.726 108.5 54.8 -67.8 -28.4 42.2 1.3 15.9 24 365 A S T ><5S- 0 0 11 -4,-1.8 3,-0.8 4,-0.2 -1,-0.2 0.444 113.0-118.8 -83.2 -1.6 41.4 4.4 18.1 25 366 A G T < 5S- 0 0 54 -3,-1.1 -3,-0.2 -4,-0.3 -2,-0.1 0.849 71.9 -53.5 62.6 37.3 44.5 3.5 20.1 26 367 A Q T 3 S- 0 0 34 1,-0.1 4,-1.7 -27,-0.1 5,-0.1 -0.920 76.0-117.3-135.3 160.5 20.5 -6.2 26.5 36 377 A T H > S+ 0 0 9 140,-0.5 4,-1.9 -2,-0.3 5,-0.2 0.894 115.6 58.2 -60.9 -41.2 20.1 -2.5 25.6 37 378 A D H > S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.884 106.4 48.2 -56.0 -42.6 18.4 -2.0 29.0 38 379 A D H > S+ 0 0 85 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.839 107.6 54.5 -68.0 -35.7 21.5 -3.3 30.8 39 380 A a H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.858 106.2 53.6 -61.8 -36.9 23.8 -1.1 28.8 40 381 A I H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.861 107.0 50.7 -66.1 -38.3 21.6 1.9 29.9 41 382 A V H X S+ 0 0 43 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.874 107.6 53.8 -64.8 -40.2 22.1 0.8 33.6 42 383 A L H X>S+ 0 0 28 -4,-1.9 5,-2.1 2,-0.2 6,-1.2 0.923 109.3 48.2 -58.3 -47.2 25.9 0.7 32.9 43 384 A V H ><5S+ 0 0 1 -4,-2.1 3,-0.8 4,-0.2 -2,-0.2 0.922 110.7 51.3 -60.4 -44.0 25.8 4.2 31.6 44 385 A L H 3<5S+ 0 0 52 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.865 109.1 49.9 -61.0 -39.3 23.8 5.3 34.7 45 386 A K H 3<5S- 0 0 121 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.656 116.0-117.4 -73.3 -15.5 26.3 3.7 37.1 46 387 A G T <<5S+ 0 0 41 -4,-0.9 -3,-0.2 -3,-0.8 -2,-0.1 0.549 86.1 116.8 86.4 10.6 29.1 5.5 35.2 47 388 A E S > - 0 0 4 -2,-0.4 4,-1.9 200,-0.2 3,-0.7 -0.399 45.0-101.2 -66.0 155.1 16.6 3.6 18.8 55 396 A G H 3> S+ 0 0 0 197,-0.5 4,-1.6 1,-0.2 -1,-0.1 0.821 120.8 56.7 -49.9 -43.6 13.9 6.2 19.7 56 397 A G H 3> S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.878 110.4 44.8 -58.6 -39.3 11.9 3.8 22.0 57 398 A Y H <> S+ 0 0 15 -3,-0.7 4,-3.0 2,-0.2 5,-0.3 0.829 104.0 62.4 -73.7 -32.6 15.1 3.3 24.1 58 399 A I H X S+ 0 0 1 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.892 102.1 53.9 -59.0 -36.6 15.9 7.0 24.2 59 400 A Y H X S+ 0 0 15 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.926 110.5 44.7 -60.3 -48.8 12.5 7.3 26.0 60 401 A T H X S+ 0 0 15 -4,-1.2 4,-1.0 2,-0.2 281,-0.2 0.919 116.8 45.3 -57.4 -50.4 13.6 4.8 28.6 61 402 A A H <>S+ 0 0 1 -4,-3.0 5,-2.5 1,-0.2 -2,-0.2 0.847 110.2 56.1 -65.8 -35.2 17.0 6.4 29.0 62 403 A G H ><5S+ 0 0 7 -4,-2.5 3,-1.9 -5,-0.3 -1,-0.2 0.881 100.7 55.2 -66.9 -44.5 15.5 9.9 29.1 63 404 A K H 3<5S+ 0 0 42 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.839 108.9 51.4 -55.0 -33.7 13.2 9.1 32.1 64 405 A c T 3<5S- 0 0 21 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.307 128.7 -97.5 -88.5 7.6 16.4 8.0 33.9 65 406 A G T < 5S+ 0 0 44 -3,-1.9 195,-0.5 1,-0.3 -3,-0.2 0.368 75.2 139.4 97.5 -6.0 18.2 11.3 33.1 66 407 A L E < -D 259 0A 3 -5,-2.5 -1,-0.3 193,-0.1 193,-0.2 -0.403 38.2-146.2 -72.9 152.2 20.3 10.4 30.0 67 408 A V E -D 258 0A 39 191,-2.9 191,-1.6 248,-0.1 2,-0.2 -0.899 16.7-107.1-123.1 147.1 20.5 13.0 27.2 68 409 A P E +D 257 0A 12 0, 0.0 189,-0.2 0, 0.0 3,-0.1 -0.527 36.6 173.1 -68.4 138.9 20.7 12.9 23.4 69 410 A V E - 0 0 9 187,-3.2 241,-0.5 1,-0.5 2,-0.3 0.798 60.2 -4.0-113.9 -58.1 24.2 13.8 22.2 70 411 A L E -D 256 0A 0 186,-0.6 186,-2.8 239,-0.1 -1,-0.5 -0.968 65.9-136.6-141.3 149.9 24.5 13.3 18.4 71 412 A A E -DE 255 308A 0 237,-2.3 237,-3.4 -2,-0.3 184,-0.2 -0.870 22.4-109.5-111.9 143.6 22.1 11.8 15.9 72 413 A E E - E 0 307A 9 182,-2.6 2,-0.4 -2,-0.4 235,-0.2 -0.473 35.1-163.3 -58.8 137.6 22.6 9.4 13.0 73 414 A N E - E 0 306A 3 233,-2.4 232,-2.5 -2,-0.1 233,-1.6 -0.991 5.8-170.8-129.6 120.6 22.2 11.2 9.7 74 415 A R - 0 0 46 -2,-0.4 230,-0.1 230,-0.2 16,-0.1 -0.433 43.5 -55.4 -99.4-179.9 21.6 9.3 6.5 75 416 A K + 0 0 114 228,-0.5 2,-0.2 -2,-0.1 -1,-0.2 -0.228 62.3 173.8 -51.6 138.0 21.6 10.4 2.8 76 417 A S - 0 0 34 1,-0.1 3,-0.1 -3,-0.1 -1,-0.1 -0.674 34.3-148.4-130.0-168.3 19.2 13.3 2.0 77 418 A S S S+ 0 0 106 -2,-0.2 3,-0.4 1,-0.0 2,-0.1 0.509 78.6 71.6-131.7 -36.7 18.2 15.6 -0.9 78 419 A K S S+ 0 0 149 1,-0.2 -2,-0.1 2,-0.1 -1,-0.0 -0.439 94.8 34.1 -76.7 159.0 17.2 18.8 0.9 79 420 A H S S+ 0 0 60 -2,-0.1 3,-0.4 -3,-0.1 -1,-0.2 0.868 80.1 170.6 59.8 41.5 19.9 21.0 2.7 80 421 A S + 0 0 102 -3,-0.4 -2,-0.1 1,-0.2 -4,-0.1 0.823 65.4 39.2 -55.9 -49.4 22.2 19.9 -0.2 81 422 A S S S+ 0 0 129 2,-0.1 -1,-0.2 0, 0.0 2,-0.1 0.759 93.8 100.4 -78.4 -25.8 25.2 22.1 0.3 82 423 A L S S- 0 0 86 -3,-0.4 5,-0.1 1,-0.1 0, 0.0 -0.381 82.5-106.3 -64.9 134.6 25.2 21.9 4.1 83 424 A D >> - 0 0 105 -2,-0.1 4,-1.4 1,-0.1 3,-1.1 -0.208 26.4-114.9 -59.9 150.0 27.7 19.5 5.7 84 425 A d G >4 S+ 0 0 9 1,-0.2 3,-0.6 2,-0.2 222,-0.1 0.904 112.6 57.9 -52.5 -49.1 26.3 16.2 7.1 85 426 A V G 34 S+ 0 0 26 1,-0.2 224,-2.8 223,-0.1 -1,-0.2 0.708 116.0 34.8 -57.5 -25.2 27.3 17.1 10.7 86 427 A L G <4 S+ 0 0 111 -3,-1.1 -1,-0.2 222,-0.2 -2,-0.2 0.560 92.6 110.3-107.7 -13.4 25.2 20.3 10.7 87 428 A R S << S- 0 0 22 -4,-1.4 -8,-0.1 -3,-0.6 -7,-0.0 -0.386 75.5-111.2 -63.7 133.5 22.4 19.1 8.5 88 429 A P - 0 0 66 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.361 34.5-110.1 -61.2 148.6 19.0 18.6 10.2 89 430 A T - 0 0 53 221,-0.1 -16,-0.1 1,-0.1 -13,-0.0 -0.532 21.6-158.6 -77.6 150.3 17.9 15.0 10.6 90 431 A E - 0 0 83 -2,-0.2 -1,-0.1 -16,-0.1 -17,-0.1 0.693 29.9-130.3-105.0 -23.4 14.9 13.9 8.6 91 432 A G - 0 0 8 163,-0.1 2,-0.3 159,-0.1 -1,-0.0 0.081 21.2 -94.4 88.1 155.5 13.6 10.8 10.4 92 433 A Y E -F 251 0B 4 159,-2.0 159,-3.5 112,-0.0 2,-0.7 -0.708 29.8-111.3-108.7 162.0 12.8 7.4 9.0 93 434 A L E -F 250 0B 34 -2,-0.3 111,-2.1 157,-0.2 2,-0.4 -0.803 21.4-145.5 -95.1 116.3 9.5 5.9 7.8 94 435 A A E +FG 249 203B 1 155,-2.4 154,-2.8 -2,-0.7 155,-0.9 -0.651 31.3 176.3 -73.0 128.1 8.0 3.1 10.0 95 436 A V E - G 0 202B 1 107,-2.6 107,-1.5 -2,-0.4 2,-0.5 -0.904 33.3-132.5-131.2 162.1 6.3 0.6 7.6 96 437 A A E - G 0 201B 0 135,-0.5 135,-2.8 -2,-0.3 2,-0.4 -0.986 30.6-161.3-113.0 126.0 4.5 -2.7 7.7 97 438 A V E +HG 230 200B 0 103,-2.9 103,-2.0 -2,-0.5 2,-0.3 -0.876 14.5 169.7-116.6 136.0 5.8 -5.1 5.0 98 439 A V E -H 229 0B 0 131,-2.9 131,-2.7 -2,-0.4 2,-0.3 -0.878 40.3 -92.9-132.4 166.7 4.2 -8.2 3.5 99 440 A K E > -H 228 0B 33 99,-0.5 3,-1.1 -2,-0.3 129,-0.3 -0.666 27.6-132.9 -77.2 137.4 4.8 -10.6 0.5 100 441 A K T 3 S+ 0 0 89 127,-2.7 128,-0.1 -2,-0.3 -1,-0.1 0.908 107.6 62.4 -51.6 -42.9 2.9 -9.6 -2.7 101 442 A A T 3 S+ 0 0 83 126,-0.4 2,-2.0 1,-0.2 -1,-0.2 0.713 82.2 81.0 -60.4 -24.3 1.9 -13.3 -2.9 102 443 A N S X S- 0 0 54 -3,-1.1 3,-1.2 96,-0.1 -1,-0.2 -0.507 80.4-168.0 -80.3 69.4 0.0 -13.0 0.4 103 444 A E T 3 + 0 0 163 -2,-2.0 3,-0.1 1,-0.2 -2,-0.1 -0.216 59.4 19.2 -66.3 147.3 -2.9 -11.5 -1.4 104 445 A G T 3 S+ 0 0 61 1,-0.3 2,-0.7 133,-0.0 -1,-0.2 0.565 83.5 131.0 69.1 6.3 -5.8 -9.8 0.4 105 446 A L < + 0 0 4 -3,-1.2 -1,-0.3 93,-0.1 2,-0.3 -0.860 32.7 159.6 -84.8 117.0 -3.7 -9.4 3.6 106 447 A T > - 0 0 30 -2,-0.7 3,-1.9 -3,-0.1 130,-0.1 -0.801 59.0 -88.6-129.1 173.5 -4.3 -5.7 4.5 107 448 A W G > S+ 0 0 9 125,-0.4 3,-0.8 129,-0.3 4,-0.1 0.807 125.3 56.1 -48.5 -35.7 -4.0 -3.6 7.7 108 449 A N G 3 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.414 106.8 46.8 -85.0 -1.4 -7.6 -4.5 8.5 109 450 A S G < S+ 0 0 41 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.005 74.7 110.8-127.0 28.1 -7.1 -8.3 8.5 110 451 A L X + 0 0 1 -3,-0.8 3,-2.1 2,-0.1 -2,-0.1 0.732 45.3 113.4 -74.6 -23.9 -3.9 -8.5 10.5 111 452 A K T 3 S+ 0 0 95 1,-0.3 35,-0.2 -4,-0.1 3,-0.1 -0.234 86.2 8.0 -56.3 133.4 -5.6 -10.2 13.5 112 453 A D T 3 S+ 0 0 94 33,-3.0 -1,-0.3 1,-0.2 34,-0.2 0.519 102.5 121.7 69.5 8.7 -4.5 -13.8 14.1 113 454 A K S < S- 0 0 69 -3,-2.1 34,-1.9 32,-0.2 35,-0.8 -0.273 70.6 -94.6 -84.6-179.4 -1.7 -13.5 11.5 114 455 A K E -i 148 0B 62 32,-0.2 84,-2.1 33,-0.2 85,-1.6 -0.862 41.4-158.5-102.6 135.0 2.0 -14.0 12.2 115 456 A S E -ij 149 199B 0 33,-2.0 35,-1.9 -2,-0.4 2,-0.5 -0.880 15.6-157.0-124.4 148.9 4.2 -11.0 13.0 116 457 A e E -ij 150 200B 0 83,-2.0 85,-2.1 -2,-0.3 2,-0.3 -0.987 18.9-176.3-122.0 118.8 8.0 -10.1 12.9 117 458 A H E - 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