==== 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 24-MAY-06 2H4I . COMPND 2 MOLECULE: LACTOTRANSFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR R.MIR,R.PREM KUMAR,M.SINHA,N.SINGH,P.KAUR,S.SHARMA,T.P.SINGH . 341 2 10 9 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15250.0 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 . 33 9.7 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 . 16 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 22.6 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 0 1 0 0 1 2 1 0 1 0 1 0 1 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 1 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 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 0 242 0, 0.0 2,-1.8 0, 0.0 264,-0.0 0.000 360.0 360.0 360.0 -73.3 39.1 13.0 30.6 2 343 A T + 0 0 84 2,-0.0 2,-0.5 266,-0.0 0, 0.0 0.069 360.0 88.1 -57.0 11.4 39.8 12.0 27.0 3 344 A R - 0 0 143 -2,-1.8 2,-0.4 25,-0.0 25,-0.2 -0.919 57.5-157.8-113.0 125.9 38.9 8.2 26.9 4 345 A V E -a 28 0A 0 23,-2.5 25,-2.9 -2,-0.5 2,-0.6 -0.845 6.8-146.7-106.7 140.6 35.3 7.0 26.2 5 346 A V E -a 29 0A 14 -2,-0.4 44,-3.0 23,-0.2 45,-1.6 -0.914 15.5-157.2-108.3 120.2 33.7 3.6 27.1 6 347 A W E -ab 30 50A 2 23,-2.9 25,-2.6 -2,-0.6 2,-0.7 -0.667 10.3-136.0 -94.6 145.6 31.2 2.3 24.7 7 348 A a E -a 31 0A 1 43,-2.2 2,-0.3 -2,-0.3 25,-0.2 -0.901 18.7-163.7-108.1 115.3 28.5 -0.2 25.6 8 349 A A E -a 32 0A 0 23,-3.2 25,-2.2 -2,-0.7 2,-0.7 -0.743 12.1-141.1 -95.2 141.3 28.0 -3.0 23.1 9 350 A V E -a 33 0A 11 -2,-0.3 169,-0.5 23,-0.2 4,-0.4 -0.899 66.5 -10.2-105.8 107.2 24.9 -5.2 23.2 10 351 A G S > S- 0 0 3 23,-2.3 4,-1.6 -2,-0.7 5,-0.1 -0.081 90.8 -68.2 96.2 165.3 25.7 -8.8 22.5 11 352 A P H > S+ 0 0 64 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.862 126.5 52.1 -58.6 -45.0 28.8 -10.8 21.3 12 353 A E H > S+ 0 0 67 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.900 110.0 46.4 -64.6 -43.1 28.8 -9.5 17.8 13 354 A E H > S+ 0 0 35 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.843 110.3 55.7 -68.7 -32.5 28.7 -5.8 18.8 14 355 A Q H X S+ 0 0 69 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.885 105.6 52.1 -65.7 -37.5 31.4 -6.5 21.3 15 356 A K H X S+ 0 0 129 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.943 112.3 43.6 -64.1 -47.0 33.6 -8.0 18.5 16 357 A K H X S+ 0 0 14 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.867 113.8 53.9 -65.9 -33.3 33.2 -4.9 16.3 17 358 A b H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.919 104.3 52.2 -67.4 -43.5 33.8 -2.8 19.4 18 359 A Q H X S+ 0 0 106 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.862 110.2 50.5 -60.6 -36.2 37.0 -4.4 20.3 19 360 A Q H X S+ 0 0 99 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.917 111.2 46.8 -67.9 -44.3 38.2 -3.8 16.8 20 361 A W H X S+ 0 0 0 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.893 110.8 53.8 -63.1 -40.7 37.3 -0.1 17.0 21 362 A S H <>S+ 0 0 11 -4,-2.8 5,-2.3 1,-0.2 7,-0.4 0.884 110.5 46.6 -60.4 -41.4 38.9 0.2 20.4 22 363 A Q H ><5S+ 0 0 138 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.908 111.9 48.0 -67.9 -46.5 42.2 -1.2 19.0 23 364 A Q H 3<5S+ 0 0 59 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.675 108.1 58.3 -68.0 -20.1 42.2 1.0 15.9 24 365 A S T ><5S- 0 0 12 -4,-1.3 3,-0.9 4,-0.2 -1,-0.3 0.459 110.6-120.7 -89.9 -2.0 41.5 4.0 18.1 25 366 A G T < 5S- 0 0 53 -3,-1.3 -3,-0.2 1,-0.2 -2,-0.1 0.889 72.4 -56.4 61.7 38.4 44.6 3.4 20.2 26 367 A Q T 3 S- 0 0 30 1,-0.1 4,-1.6 -27,-0.1 5,-0.1 -0.955 76.1-114.3-144.1 163.4 20.6 -6.2 26.4 36 377 A T H > S+ 0 0 10 140,-0.5 4,-2.0 -2,-0.3 5,-0.1 0.894 116.3 55.7 -61.4 -40.7 20.0 -2.6 25.6 37 378 A D H > S+ 0 0 55 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.903 106.4 49.8 -61.3 -40.8 18.4 -2.1 29.0 38 379 A D H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.837 107.0 54.9 -67.4 -31.4 21.5 -3.4 30.8 39 380 A a H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.901 106.1 52.5 -66.8 -38.0 23.7 -1.1 28.7 40 381 A I H X S+ 0 0 1 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.914 108.5 50.7 -61.6 -42.9 21.6 1.8 30.0 41 382 A V H X S+ 0 0 41 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.928 107.2 52.9 -61.3 -45.1 22.1 0.6 33.6 42 383 A L H X>S+ 0 0 30 -4,-2.3 5,-2.3 1,-0.2 6,-1.3 0.854 110.6 48.2 -59.1 -35.7 25.9 0.5 33.0 43 384 A V H ><5S+ 0 0 2 -4,-1.8 3,-1.0 4,-0.2 -1,-0.2 0.950 109.8 51.8 -69.2 -47.4 25.8 4.1 31.8 44 385 A L H 3<5S+ 0 0 48 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.922 110.3 48.2 -51.0 -50.1 23.7 5.2 34.7 45 386 A K H 3<5S- 0 0 121 -4,-2.7 -1,-0.3 -5,-0.1 -2,-0.2 0.673 117.1-118.8 -65.6 -18.2 26.2 3.6 37.2 46 387 A G T <<5S+ 0 0 41 -3,-1.0 -3,-0.2 -4,-0.6 -2,-0.1 0.582 82.9 120.3 88.0 10.9 28.9 5.4 35.2 47 388 A E S > - 0 0 5 -2,-0.4 4,-1.8 200,-0.2 3,-1.1 -0.386 46.9-104.3 -68.3 154.6 16.5 3.5 18.7 55 396 A G H 3> S+ 0 0 0 197,-0.5 4,-1.7 1,-0.3 5,-0.1 0.803 118.5 64.6 -54.1 -34.0 14.0 6.1 19.8 56 397 A G H 3> S+ 0 0 0 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.883 109.0 39.4 -58.5 -38.4 12.0 3.6 21.9 57 398 A Y H <> S+ 0 0 14 -3,-1.1 4,-3.0 2,-0.2 5,-0.3 0.807 105.4 64.8 -81.3 -31.6 15.0 3.2 24.1 58 399 A I H X S+ 0 0 1 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.871 102.3 53.0 -56.6 -36.9 15.9 6.9 24.1 59 400 A Y H X S+ 0 0 18 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.946 110.2 45.0 -63.7 -50.3 12.6 7.4 25.8 60 401 A T H >X S+ 0 0 15 -4,-1.0 4,-0.6 1,-0.2 3,-0.5 0.966 115.7 47.2 -57.0 -56.1 13.4 4.9 28.6 61 402 A A H ><>S+ 0 0 0 -4,-3.0 5,-2.1 1,-0.2 3,-1.1 0.862 106.7 59.4 -53.3 -41.6 16.9 6.3 29.0 62 403 A G H ><5S+ 0 0 9 -4,-2.4 3,-2.2 1,-0.3 -1,-0.2 0.861 97.8 56.3 -59.0 -41.0 15.5 9.9 29.1 63 404 A K H <<5S+ 0 0 53 -4,-1.6 -1,-0.3 -3,-0.5 -2,-0.2 0.704 107.6 53.2 -64.6 -17.3 13.3 9.3 32.2 64 405 A c T <<5S- 0 0 18 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.161 126.3-101.2-102.2 16.3 16.5 8.2 33.8 65 406 A G T < 5S+ 0 0 40 -3,-2.2 195,-0.7 1,-0.3 -3,-0.2 0.472 74.4 138.2 83.2 1.1 18.3 11.4 33.0 66 407 A L E < -D 259 0A 4 -5,-2.1 -1,-0.3 193,-0.2 193,-0.2 -0.489 40.6-143.2 -77.8 154.5 20.4 10.3 30.0 67 408 A V E -D 258 0A 40 191,-3.7 191,-1.5 -2,-0.1 2,-0.1 -0.946 14.3-112.3-127.1 142.5 20.6 12.7 27.1 68 409 A P E +D 257 0A 11 0, 0.0 189,-0.2 0, 0.0 3,-0.1 -0.453 37.0 173.2 -64.8 136.4 20.7 12.5 23.3 69 410 A V E - 0 0 7 187,-3.3 241,-0.4 1,-0.5 2,-0.3 0.801 59.8 -4.1-111.0 -56.3 24.2 13.7 22.1 70 411 A L E -D 256 0A 0 186,-0.8 186,-3.0 239,-0.1 -1,-0.5 -0.977 68.2-141.6-141.0 147.1 24.6 13.1 18.4 71 412 A A E -DE 255 308A 0 237,-1.8 237,-3.4 -2,-0.3 184,-0.3 -0.839 22.5-102.5-116.9 153.4 22.1 11.5 16.0 72 413 A E E - E 0 307A 9 182,-2.7 2,-0.4 -2,-0.3 235,-0.2 -0.399 36.5-165.7 -66.5 146.7 22.6 9.2 13.0 73 414 A N E - E 0 306A 3 233,-1.6 232,-2.5 16,-0.1 233,-1.6 -0.960 4.0-164.6-142.1 118.5 22.2 10.8 9.6 74 415 A R - 0 0 56 -2,-0.4 16,-0.2 230,-0.2 230,-0.1 -0.668 40.7 -74.0 -99.4 160.1 21.7 9.1 6.3 75 416 A K - 0 0 137 228,-0.4 2,-0.3 -2,-0.2 -1,-0.1 -0.126 50.2-171.2 -52.7 137.2 22.2 10.6 2.8 76 417 A S - 0 0 25 3,-0.2 -1,-0.0 1,-0.2 -3,-0.0 -0.961 27.6-149.6-133.8 151.1 19.5 13.0 1.5 77 418 A S S S+ 0 0 110 -2,-0.3 3,-0.2 3,-0.0 2,-0.2 0.943 91.6 56.0 -79.5 -57.4 18.7 14.7 -1.8 78 419 A K S S+ 0 0 132 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.518 105.1 39.2 -72.7 146.5 17.1 17.8 -0.3 79 420 A H S S+ 0 0 49 -2,-0.2 -1,-0.2 8,-0.0 -3,-0.2 0.948 74.8 144.2 70.6 52.5 19.5 19.5 2.1 80 421 A S + 0 0 92 -3,-0.2 -2,-0.1 1,-0.1 4,-0.1 0.633 56.2 62.9 -93.1 -25.3 22.4 18.8 -0.2 81 422 A S S S+ 0 0 108 2,-0.1 2,-0.1 0, 0.0 -1,-0.1 0.862 88.9 71.2 -75.1 -38.9 24.3 22.0 0.5 82 423 A L S S- 0 0 76 1,-0.1 5,-0.1 2,-0.1 0, 0.0 -0.448 90.7 -99.3 -81.7 155.0 25.1 21.7 4.2 83 424 A D >> - 0 0 115 -2,-0.1 4,-1.3 1,-0.1 3,-0.8 -0.255 31.6-113.4 -68.1 160.0 27.6 19.2 5.6 84 425 A d G >4 S+ 0 0 7 1,-0.2 3,-0.6 2,-0.2 222,-0.1 0.931 114.1 57.6 -58.9 -46.9 26.4 16.0 7.1 85 426 A V G 34 S+ 0 0 32 1,-0.2 224,-2.9 223,-0.2 -1,-0.2 0.686 116.7 32.5 -58.9 -23.4 27.5 17.0 10.6 86 427 A L G <4 S+ 0 0 124 -3,-0.8 -1,-0.2 222,-0.2 -2,-0.2 0.496 93.0 107.1-111.9 -8.7 25.4 20.2 10.7 87 428 A R S << S- 0 0 15 -4,-1.3 -8,-0.0 -3,-0.6 -7,-0.0 -0.392 75.2-112.2 -69.6 143.0 22.4 19.1 8.5 88 429 A P - 0 0 70 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.283 36.7-103.9 -71.8 172.0 19.1 18.5 10.4 89 430 A T - 0 0 54 221,-0.1 -16,-0.1 1,-0.1 -17,-0.0 -0.771 20.0-157.6 -98.5 143.2 17.9 14.9 10.6 90 431 A E - 0 0 86 -2,-0.4 -1,-0.1 -16,-0.2 -17,-0.1 0.790 30.4-135.8 -88.8 -29.0 15.0 13.6 8.4 91 432 A G - 0 0 9 163,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.020 21.0 -93.2 89.5 159.1 13.8 10.6 10.4 92 433 A Y E -F 251 0B 6 159,-1.8 159,-3.6 -2,-0.0 2,-0.4 -0.748 28.8-113.0-112.9 161.6 12.8 7.3 9.0 93 434 A L E -F 250 0B 21 -2,-0.3 111,-2.0 157,-0.3 2,-0.5 -0.779 21.4-145.8 -93.6 132.8 9.6 5.8 7.8 94 435 A A E +FG 249 203B 2 155,-3.3 154,-3.6 -2,-0.4 155,-1.0 -0.864 28.8 176.7 -97.0 125.1 8.1 2.9 9.8 95 436 A V E - G 0 202B 1 107,-1.9 107,-1.1 -2,-0.5 2,-0.5 -0.845 33.1-130.6-128.7 163.2 6.3 0.5 7.5 96 437 A A E - G 0 201B 0 135,-0.5 135,-2.0 150,-0.3 2,-0.4 -0.973 32.2-161.6-111.0 125.2 4.5 -2.9 7.6 97 438 A V E +HG 230 200B 0 103,-2.7 103,-1.8 -2,-0.5 2,-0.3 -0.878 13.1 173.2-114.5 143.6 5.8 -5.2 4.9 98 439 A V E -HG 229 199B 0 131,-2.6 131,-2.0 -2,-0.4 2,-0.4 -0.864 38.7 -91.4-137.8 172.2 4.2 -8.3 3.5 99 440 A K E > -H 228 0B 27 99,-0.5 3,-1.6 -2,-0.3 129,-0.3 -0.693 26.6-139.4 -85.8 135.0 4.8 -10.9 0.7 100 441 A K T 3 S+ 0 0 81 127,-4.0 -1,-0.1 -2,-0.4 5,-0.1 0.944 103.6 62.9 -57.7 -45.4 3.1 -9.9 -2.6 101 442 A A T 3 S+ 0 0 84 126,-0.4 2,-1.2 1,-0.2 -1,-0.3 0.572 83.6 80.7 -55.5 -13.0 2.1 -13.6 -3.0 102 443 A N S X S- 0 0 56 -3,-1.6 3,-1.3 96,-0.1 -1,-0.2 -0.498 78.8-168.4 -93.6 60.8 0.1 -13.3 0.2 103 444 A E T 3 + 0 0 162 -2,-1.2 3,-0.1 1,-0.2 -2,-0.1 -0.188 62.2 26.5 -54.7 140.6 -2.8 -11.7 -1.8 104 445 A G T 3 S+ 0 0 59 1,-0.2 2,-0.8 133,-0.0 -1,-0.2 0.510 78.9 133.0 85.8 5.6 -5.5 -10.2 0.3 105 446 A L < + 0 0 5 -3,-1.3 2,-0.2 -6,-0.2 -1,-0.2 -0.814 30.1 165.0 -93.6 111.6 -3.5 -9.4 3.4 106 447 A T > - 0 0 34 -2,-0.8 3,-1.9 -3,-0.1 130,-0.1 -0.703 54.9 -97.3-119.7 174.4 -4.4 -5.9 4.5 107 448 A W G > S+ 0 0 9 125,-0.4 3,-0.8 1,-0.3 4,-0.2 0.829 121.4 60.3 -58.7 -31.1 -3.9 -3.7 7.5 108 449 A N G 3 S+ 0 0 115 1,-0.2 -1,-0.3 2,-0.1 125,-0.0 0.307 105.3 44.0 -84.2 10.0 -7.5 -4.6 8.4 109 450 A S G < S+ 0 0 41 -3,-1.9 -1,-0.2 1,-0.0 -2,-0.1 -0.111 71.4 112.7-142.9 38.0 -7.0 -8.4 8.6 110 451 A L X + 0 0 1 -3,-0.8 3,-2.6 2,-0.1 -2,-0.1 0.726 46.3 117.7 -81.6 -20.6 -3.8 -8.6 10.6 111 452 A K T 3 S+ 0 0 105 1,-0.3 35,-0.2 -4,-0.2 3,-0.1 -0.221 86.3 3.7 -53.3 126.5 -5.7 -10.2 13.4 112 453 A D T 3 S+ 0 0 88 33,-3.1 -1,-0.3 1,-0.2 34,-0.2 0.534 102.7 122.4 73.8 10.2 -4.5 -13.7 14.1 113 454 A K < - 0 0 70 -3,-2.6 34,-1.6 32,-0.2 35,-0.8 -0.239 69.2 -94.6 -88.6-176.0 -1.7 -13.5 11.5 114 455 A K E -i 148 0B 66 32,-0.2 84,-1.9 33,-0.2 85,-1.8 -0.871 41.8-157.9-105.8 136.9 2.0 -14.1 12.3 115 456 A S E -ij 149 199B 0 33,-2.0 35,-1.3 -2,-0.4 2,-0.5 -0.851 16.8-155.3-122.4 154.7 4.3 -11.2 13.0 116 457 A e E -ij 150 200B 0 83,-1.9 85,-2.6 -2,-0.3 2,-0.4 -0.984 19.3-176.1-122.4 121.1 7.9 -10.2 12.9 117 458 A H E - 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