==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 28-MAR-11 3RB7 . COMPND 2 MOLECULE: NA/CA EXCHANGE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR M.WU,L.ZHENG . 982 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46787.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 612 62.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 65 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 267 27.2 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 9 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 106 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 5 0 2 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 . 6 8 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 PARALLEL BRIDGES PER LADDER . 10 8 6 12 6 9 5 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 . 2 7 8 4 3 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 1 442 A I 0 0 80 0, 0.0 95,-2.3 0, 0.0 26,-0.2 0.000 360.0 360.0 360.0 -87.3 -48.1 -6.2 84.8 2 443 A R E -a 96 0A 70 93,-0.3 24,-2.3 95,-0.0 2,-0.3 -0.477 360.0-149.0-108.7-177.8 -45.0 -7.9 83.3 3 444 A M E +aB 97 25A 0 93,-1.1 95,-0.6 22,-0.3 22,-0.2 -0.870 28.7 146.8-158.1 112.6 -42.7 -7.4 80.3 4 445 A Y E - B 0 24A 46 20,-1.0 20,-2.8 -2,-0.3 2,-0.4 -0.385 40.9 -67.3-133.3-158.3 -40.8 -10.2 78.4 5 446 A F E - B 0 23A 6 95,-0.7 18,-0.2 18,-0.2 3,-0.1 -0.867 31.8-160.6-109.4 138.1 -39.4 -11.6 75.1 6 447 A E S S+ 0 0 92 16,-2.0 2,-0.1 -2,-0.4 -2,-0.0 -0.768 77.6 31.9-161.1 114.7 -41.2 -12.9 72.1 7 448 A P S S- 0 0 67 0, 0.0 -1,-0.3 0, 0.0 15,-0.2 0.447 77.4-154.5 -74.7 167.3 -39.8 -14.8 70.0 8 449 A G + 0 0 41 -2,-0.1 96,-1.0 -3,-0.1 2,-0.3 0.934 69.1 29.2 -80.3 -53.8 -37.4 -16.8 72.2 9 450 A H E -d 104 0B 79 94,-0.2 2,-0.4 96,-0.1 96,-0.2 -0.748 62.3-155.0-107.3 157.7 -34.6 -17.9 69.9 10 451 A Y E -d 105 0B 29 94,-1.6 96,-2.6 -2,-0.3 2,-0.5 -0.969 4.5-168.7-132.4 119.0 -33.2 -16.3 66.7 11 452 A T E +d 106 0B 93 -2,-0.4 2,-0.3 94,-0.2 96,-0.2 -0.944 22.6 164.2-107.5 123.5 -31.4 -18.3 64.0 12 453 A V E -d 107 0B 13 94,-1.9 96,-2.3 -2,-0.5 -2,-0.1 -0.996 37.8-115.6-147.4 137.2 -29.7 -16.1 61.5 13 454 A M E > -d 108 0B 78 -2,-0.3 3,-0.9 94,-0.2 96,-0.2 -0.329 29.3-122.7 -68.5 156.3 -27.0 -16.4 58.8 14 455 A E T 3 S+ 0 0 1 94,-1.6 3,-0.4 1,-0.2 -1,-0.1 0.592 104.4 67.3 -73.5 -6.6 -23.9 -14.4 59.3 15 456 A N T 3 S+ 0 0 92 93,-0.2 -1,-0.2 1,-0.2 94,-0.0 0.131 76.2 74.6-110.7 20.4 -24.6 -12.7 56.1 16 457 A C < - 0 0 67 -3,-0.9 2,-0.5 1,-0.2 -1,-0.2 0.308 69.3-160.4-113.5 12.5 -27.7 -10.6 56.5 17 458 A G + 0 0 31 -3,-0.4 55,-1.4 55,-0.2 -1,-0.2 -0.286 66.5 50.4 52.7-102.8 -26.2 -7.7 58.6 18 459 A E E +H 71 0C 125 -2,-0.5 2,-0.3 53,-0.2 53,-0.2 -0.372 64.5 172.6 -73.0 140.1 -29.3 -6.2 60.2 19 460 A F E -H 70 0C 23 51,-1.6 51,-3.9 -2,-0.1 2,-0.1 -0.963 24.6-123.2-151.5 136.6 -31.8 -8.3 62.1 20 461 A E - 0 0 112 -2,-0.3 2,-0.3 49,-0.3 49,-0.2 -0.379 16.1-166.7 -81.9 150.7 -34.9 -7.5 64.3 21 462 A V - 0 0 1 47,-0.3 47,-0.7 -2,-0.1 2,-0.6 -0.999 14.9-141.3-135.1 138.4 -35.6 -8.5 67.9 22 463 A R E - C 0 67A 59 -2,-0.3 -16,-2.0 45,-0.2 45,-0.2 -0.874 11.7-167.3-120.3 117.8 -39.1 -8.1 69.6 23 464 A V E -BC 5 66A 0 43,-2.7 43,-1.4 -2,-0.6 2,-0.4 -0.606 10.2-152.6 -97.3 152.2 -40.0 -7.1 73.1 24 465 A V E -BC 4 65A 3 -20,-2.8 -20,-1.0 41,-0.2 2,-0.3 -0.970 10.6-163.5-134.0 136.8 -43.4 -7.4 74.8 25 466 A R E -B 3 0A 9 39,-3.3 2,-0.3 -2,-0.4 -22,-0.3 -0.812 23.5-173.2-107.1 157.7 -45.3 -5.6 77.6 26 467 A R + 0 0 116 -24,-2.3 2,-0.2 -2,-0.3 39,-0.0 -0.910 40.3 28.2-151.7 176.1 -48.3 -7.3 79.2 27 468 A G S S+ 0 0 36 -2,-0.3 -2,-0.1 -26,-0.2 2,-0.0 -0.535 116.7 6.4 64.6-140.7 -51.3 -7.0 81.6 28 469 A D + 0 0 100 -2,-0.2 -2,-0.2 1,-0.1 0, 0.0 -0.281 61.6 175.4 -68.6 161.4 -52.3 -3.3 81.6 29 470 A I + 0 0 56 -4,-0.1 33,-1.8 4,-0.0 4,-0.2 0.304 39.2 115.9-150.9 2.1 -50.6 -0.9 79.2 30 471 A S S S+ 0 0 84 31,-0.2 2,-0.1 32,-0.1 33,-0.1 0.652 70.7 65.0 -60.4 -18.4 -52.3 2.5 79.6 31 472 A T S S- 0 0 82 30,-0.1 2,-0.9 29,-0.1 31,-0.3 -0.415 94.9 -87.9-107.7 176.4 -49.1 4.2 80.8 32 473 A Y + 0 0 134 29,-0.1 2,-0.1 28,-0.1 -2,-0.1 -0.755 56.0 171.8 -88.0 106.3 -45.6 5.1 79.7 33 474 A A E +E 59 0B 5 26,-3.6 26,-2.2 -2,-0.9 2,-0.3 -0.276 8.4 178.5-104.0-173.7 -43.4 2.1 80.4 34 475 A S E +E 58 0B 24 24,-0.3 58,-1.9 -2,-0.1 2,-0.3 -0.954 12.7 177.2-179.6 168.9 -39.8 1.0 79.7 35 476 A V E -E 57 0B 0 22,-2.5 22,-3.6 -2,-0.3 2,-0.3 -0.953 20.1-129.0-169.4 168.9 -37.0 -1.5 80.0 36 477 A E E -EF 56 89B 59 53,-2.2 53,-1.9 -2,-0.3 2,-0.3 -0.901 11.6-156.5-134.9 163.9 -33.4 -2.0 78.8 37 478 A Y E -EF 55 88B 4 18,-1.3 18,-1.5 -2,-0.3 2,-0.3 -0.923 3.7-160.6-138.2 159.9 -31.1 -4.6 77.1 38 479 A E E -EF 54 87B 42 49,-1.1 49,-1.7 -2,-0.3 2,-1.2 -0.978 22.1-130.5-144.5 130.1 -27.5 -5.6 76.7 39 480 A T E - F 0 86B 3 14,-2.2 47,-0.2 -2,-0.3 2,-0.2 -0.658 31.8-169.4 -82.0 94.9 -25.8 -7.8 74.1 40 481 A Q E - F 0 85B 26 45,-2.1 45,-2.5 -2,-1.2 2,-0.0 -0.596 21.1-112.5 -83.0 145.8 -23.7 -10.3 76.1 41 482 A D + 0 0 73 -2,-0.2 4,-0.2 43,-0.2 43,-0.1 -0.276 37.4 163.9 -77.4 160.7 -21.1 -12.5 74.4 42 483 A G S S- 0 0 32 2,-3.2 42,-0.2 41,-0.2 -1,-0.1 -0.118 78.9 -39.0-135.2-122.3 -21.3 -16.3 74.0 43 484 A T S S+ 0 0 83 40,-1.6 2,-0.4 -2,-0.1 41,-0.2 0.492 138.9 66.2 -86.5 -6.6 -19.2 -18.2 71.5 44 485 A A S S- 0 0 0 39,-2.2 -2,-3.2 5,-0.0 2,-0.4 -0.935 80.7-164.9-103.7 138.3 -20.0 -15.2 69.4 45 486 A S >>> - 0 0 39 -2,-0.4 4,-1.8 -4,-0.2 3,-1.7 -0.930 29.1 -96.4-127.4 146.3 -18.4 -12.0 70.7 46 487 A A B 345S+i 50 0D 42 -2,-0.4 5,-0.3 1,-0.2 -5,-0.0 -0.338 112.8 27.0 -51.8 138.0 -18.9 -8.3 70.1 47 488 A G T 345S+ 0 0 63 3,-1.2 -1,-0.2 1,-0.1 4,-0.1 -0.091 122.1 49.6 99.8 -35.7 -16.3 -7.3 67.6 48 489 A T T <45S+ 0 0 84 -3,-1.7 -2,-0.2 2,-0.4 3,-0.1 0.842 128.8 1.0-106.2 -46.2 -15.8 -10.7 65.8 49 490 A D T <5S+ 0 0 7 -4,-1.8 24,-2.5 1,-0.4 2,-0.3 0.623 132.8 15.5-123.1 -23.6 -19.3 -12.1 64.8 50 491 A F B >> - 0 0 75 -2,-0.3 4,-2.5 -4,-0.2 3,-1.4 -0.967 29.6-100.6-129.1 143.8 -25.1 -50.7 29.3 159 600 A E T 345S+ 0 0 70 -2,-0.4 5,-0.2 1,-0.2 -5,-0.0 -0.143 102.9 18.3 -60.4 154.1 -23.3 -47.8 27.7 160 601 A S T 345S+ 0 0 95 3,-0.4 -1,-0.2 1,-0.2 4,-0.1 0.461 126.9 57.0 66.4 -0.2 -23.7 -46.9 24.0 161 602 A K T <45S+ 0 0 157 -3,-1.4 -2,-0.2 0, 0.0 -1,-0.2 0.670 121.8 13.3-118.0 -57.7 -26.9 -49.0 24.0 162 603 A D T <5S- 0 0 19 -4,-2.5 -3,-0.2 30,-0.0 2,-0.2 0.764 137.6 -13.3 -92.3 -34.4 -29.2 -47.6 26.7 163 604 A Y S - 0 0 0 -58,-3.3 3,-2.7 -2,-0.1 -58,-0.3 -0.696 18.6-108.3 -95.1 147.5 -9.7 -25.8 43.4 204 649 A P T 3 S+ 0 0 20 0, 0.0 5,-0.2 0, 0.0 421,-0.1 0.705 116.7 56.4 -39.6 -33.3 -6.3 -24.0 43.4 205 650 A D T 3 S+ 0 0 56 419,-0.3 420,-0.1 4,-0.1 -61,-0.1 0.696 74.0 112.1 -81.4 -19.5 -8.1 -20.7 42.7 206 651 A S S X S- 0 0 2 -3,-2.7 3,-3.2 -61,-0.3 2,-1.9 -0.358 82.0-118.3 -56.3 129.1 -10.4 -20.7 45.7 207 652 A T T 3 S+ 0 0 127 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 0.184 111.3 45.4 -64.8 25.8 -9.1 -17.9 47.9 208 653 A H T 3> S+ 0 0 58 -2,-1.9 4,-1.2 2,-0.0 -1,-0.3 0.284 83.9 93.0-144.2 -0.5 -8.4 -20.4 50.7 209 654 A Y H <> S+ 0 0 55 -3,-3.2 4,-1.3 -6,-0.2 5,-0.2 0.886 81.6 53.4 -74.1 -42.4 -6.7 -23.1 48.8 210 655 A P H > S+ 0 0 85 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.945 110.3 51.3 -52.8 -46.5 -3.0 -22.1 49.3 211 656 A K H > S+ 0 0 122 1,-0.2 4,-0.7 2,-0.1 3,-0.4 0.819 106.0 54.9 -59.4 -36.6 -3.6 -21.9 53.0 212 657 A I H >X S+ 0 0 9 -4,-1.2 4,-1.7 1,-0.2 3,-1.2 0.942 103.1 46.8 -75.1 -51.1 -5.1 -25.4 53.4 213 658 A K H 3< S+ 0 0 88 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.567 107.9 61.7 -71.2 -3.9 -2.6 -27.8 51.9 214 659 A E H 3< S+ 0 0 115 -4,-0.5 -1,-0.3 -3,-0.4 4,-0.2 0.680 103.9 47.6 -89.9 -23.9 0.1 -26.0 53.9 215 660 A V H X< S+ 0 0 6 -3,-1.2 3,-3.2 -4,-0.7 747,-0.3 0.888 97.8 67.2 -80.0 -41.9 -1.6 -26.9 57.2 216 661 A E T 3< S+ 0 0 35 -4,-1.7 747,-3.7 1,-0.3 748,-0.3 0.585 87.6 74.1 -56.8 -7.5 -2.0 -30.5 56.2 217 662 A K T 3 S+ 0 0 112 -3,-0.2 -1,-0.3 745,-0.2 -2,-0.2 0.868 84.3 78.9 -65.1 -41.3 1.8 -30.4 56.5 218 663 A K S < S- 0 0 88 -3,-3.2 744,-2.1 -4,-0.2 745,-0.2 -0.496 93.4-110.3 -74.5 134.8 1.3 -30.3 60.3 219 664 A P B > -S 961 0G 30 0, 0.0 3,-1.8 0, 0.0 741,-0.1 -0.434 32.7-109.1 -60.3 135.5 0.6 -33.6 62.1 220 665 A V T 3 S+ 0 0 18 740,-2.1 3,-0.5 1,-0.3 739,-0.2 0.818 118.6 66.2 -24.7 -54.2 -2.9 -33.7 63.5 221 666 A Q T 3 S+ 0 0 91 737,-2.6 2,-1.5 739,-0.3 -1,-0.3 0.862 95.9 52.2 -36.3 -59.8 -1.2 -33.4 66.9 222 667 A D S < S+ 0 0 91 -3,-1.8 2,-0.4 736,-0.1 -1,-0.3 -0.460 80.8 125.1 -92.3 65.2 0.0 -29.8 66.3 223 668 A L - 0 0 39 -2,-1.5 -3,-0.0 -3,-0.5 -8,-0.0 -0.982 49.0-139.4-124.3 130.4 -3.2 -28.0 65.2 224 669 A T > - 0 0 82 -2,-0.4 4,-2.0 1,-0.1 5,-0.1 -0.172 29.9-108.9 -69.7 174.4 -4.7 -24.9 66.8 225 670 A E H > S+ 0 0 94 2,-0.2 4,-2.4 3,-0.2 5,-0.2 0.969 124.5 45.7 -65.0 -56.1 -8.4 -24.4 67.3 226 671 A L H > S+ 0 0 145 1,-0.2 4,-2.1 2,-0.2 3,-0.2 0.934 118.2 42.7 -48.2 -54.7 -8.5 -21.9 64.5 227 672 A D H > S+ 0 0 25 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.826 110.1 58.4 -61.0 -34.9 -6.4 -24.2 62.3 228 673 A R H < S+ 0 0 83 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.896 109.1 44.5 -63.7 -40.0 -8.5 -27.2 63.4 229 674 A I H >X S+ 0 0 32 -4,-2.4 3,-1.9 1,-0.2 4,-1.2 0.851 100.7 64.8 -76.8 -39.9 -11.6 -25.4 62.1 230 675 A L H >X S+ 0 0 29 -4,-2.1 4,-0.6 1,-0.3 3,-0.5 0.882 104.9 50.4 -43.1 -40.2 -10.1 -24.4 58.8 231 676 A L H 3< S+ 0 0 31 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.586 104.6 55.8 -81.4 -10.4 -9.9 -28.1 58.2 232 677 A L H <4 S+ 0 0 53 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.578 98.2 66.2 -92.6 -14.5 -13.5 -28.6 59.1 233 678 A S H << S+ 0 0 14 -4,-1.2 -120,-2.0 -3,-0.5 -119,-0.2 0.830 76.5 106.7 -71.4 -35.8 -14.4 -26.0 56.5 234 679 A K S < S- 0 0 74 -4,-0.6 -120,-0.1 -122,-0.1 -122,-0.0 -0.002 75.0 -94.4 -64.2 155.8 -13.4 -28.1 53.5 235 680 A P + 0 0 16 0, 0.0 2,-0.3 0, 0.0 -120,-0.2 -0.057 42.1 170.9 -71.9 165.3 -15.9 -29.8 51.1 236 681 A R B -l 115 0E 106 -122,-2.8 -120,-2.6 1,-0.2 -35,-0.1 -0.963 32.7-108.5-162.8 159.3 -17.3 -33.3 51.2 237 682 A N - 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