==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-JUL-12 4B1L . COMPND 2 MOLECULE: LEVANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR F.CUSKIN,J.E.FLINT,C.MORLAND,A.BASLE,B.HENRISSAT,P.M.COUNTIN . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 55.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.2 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 2.5 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 1.2 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 . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 0 1 4 2 2 0 0 0 1 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 0 0 0 0 0 0 1 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 1 516 A T 0 0 157 0, 0.0 19,-0.0 0, 0.0 20,-0.0 0.000 360.0 360.0 360.0 103.3 16.0 -10.2 33.7 2 517 A P + 0 0 54 0, 0.0 2,-0.6 0, 0.0 22,-0.1 0.703 360.0 86.4 -80.7 -19.0 12.8 -9.1 31.9 3 518 A F S S- 0 0 17 20,-0.2 2,-0.6 153,-0.1 153,-0.1 -0.749 70.8-151.7 -85.0 118.0 14.0 -10.4 28.5 4 519 A M + 0 0 100 -2,-0.6 154,-1.8 151,-0.1 153,-0.7 -0.844 36.4 132.1 -96.1 115.0 13.1 -14.1 28.2 5 520 A S B -a 158 0A 39 -2,-0.6 154,-0.2 152,-0.2 42,-0.0 -0.980 54.4-140.7-155.6 152.8 15.4 -16.2 25.9 6 521 A N S S+ 0 0 96 152,-1.4 2,-0.3 -2,-0.3 153,-0.1 0.153 86.6 75.8 -98.0 18.3 17.3 -19.5 25.9 7 522 A M - 0 0 17 151,-0.4 2,-0.2 31,-0.0 3,-0.1 -0.871 58.9-177.5-126.0 157.3 20.2 -17.7 24.1 8 523 A T + 0 0 106 -2,-0.3 29,-1.4 1,-0.1 30,-0.7 -0.659 48.9 76.6-139.7-168.6 22.9 -15.3 25.3 9 524 A G - 0 0 28 27,-0.2 2,-0.5 1,-0.2 -1,-0.1 0.841 57.8-175.9 65.4 35.9 25.9 -13.2 24.2 10 525 A W + 0 0 48 26,-0.2 2,-0.5 -3,-0.1 26,-0.2 -0.536 4.6 178.7 -69.8 115.9 23.6 -10.6 22.7 11 526 A T E -B 35 0B 96 24,-3.0 24,-2.4 -2,-0.5 2,-0.0 -0.979 27.0-121.8-128.9 120.3 25.9 -8.0 21.0 12 527 A T E -B 34 0B 72 -2,-0.5 22,-0.2 22,-0.2 3,-0.1 -0.331 22.3-177.9 -58.4 133.7 24.7 -5.0 19.1 13 528 A V S S- 0 0 60 20,-2.6 2,-0.3 1,-0.5 21,-0.2 0.816 71.0 -38.8 -90.5 -53.1 25.8 -4.7 15.5 14 529 A N S S+ 0 0 70 19,-1.6 -1,-0.5 2,-0.0 19,-0.3 -0.893 105.2 51.6-158.0-175.5 24.1 -1.2 15.0 15 530 A G S S- 0 0 36 -2,-0.3 2,-0.4 17,-0.1 13,-0.2 -0.364 93.0 -66.7 71.8-159.7 20.9 0.5 16.0 16 531 A T E -C 27 0B 72 11,-1.1 11,-1.3 -2,-0.1 2,-0.4 -0.996 47.5-172.5-134.4 132.7 20.0 0.6 19.6 17 532 A W E +C 26 0B 26 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.985 11.1 161.7-130.8 128.8 18.9 -2.4 21.7 18 533 A A E -C 25 0B 47 7,-2.4 7,-4.3 -2,-0.4 2,-0.4 -0.996 34.6-117.1-149.1 151.3 17.6 -2.5 25.2 19 534 A D E +C 24 0B 78 -2,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.698 36.1 168.8 -90.9 130.2 15.7 -4.7 27.6 20 535 A T E > -C 23 0B 34 3,-2.7 3,-1.6 -2,-0.4 -2,-0.0 -0.743 53.7 -91.1-129.4 175.0 12.3 -3.6 28.9 21 536 A I T 3 S+ 0 0 162 1,-0.3 3,-0.1 -2,-0.2 -2,-0.0 0.709 128.2 53.3 -64.8 -14.2 9.5 -5.3 30.8 22 537 A E T 3 S- 0 0 76 1,-0.4 2,-0.3 -19,-0.0 -1,-0.3 0.532 124.2 -95.5 -94.0 -8.0 8.0 -6.3 27.4 23 538 A G E < S-C 20 0B 0 -3,-1.6 -3,-2.7 133,-0.1 2,-0.5 -0.850 72.3 -14.6 125.5-161.3 11.3 -7.9 26.2 24 539 A K E -CD 19 155B 11 131,-2.4 131,-2.4 -2,-0.3 2,-0.4 -0.666 63.5-150.9 -84.9 128.0 14.2 -6.7 24.1 25 540 A Q E -CD 18 154B 47 -7,-4.3 -7,-2.4 -2,-0.5 2,-0.3 -0.800 10.7-169.7-103.1 130.3 13.5 -3.5 22.2 26 541 A G E -CD 17 153B 0 127,-2.7 127,-2.3 -2,-0.4 2,-0.3 -0.888 5.5-176.9-113.3 151.2 15.2 -2.5 19.0 27 542 A R E +CD 16 152B 106 -11,-1.3 -11,-1.1 -2,-0.3 2,-0.3 -0.912 16.6 132.1-154.5 117.2 15.0 0.9 17.4 28 543 A S E - D 0 151B 14 123,-1.9 123,-1.4 -2,-0.3 2,-0.5 -0.979 51.4-121.1-158.0 153.4 16.3 2.2 14.1 29 544 A D E S- 0 0 128 -2,-0.3 -14,-0.1 121,-0.2 -2,-0.1 -0.844 97.9 -4.4 -82.0 134.2 15.7 4.2 10.9 30 545 A G E S- 0 0 24 -2,-0.5 120,-1.4 2,-0.0 121,-0.4 -0.217 121.7 -22.5 66.2-167.4 16.5 1.5 8.2 31 546 A D E + D 0 149B 55 118,-0.2 2,-0.3 119,-0.1 118,-0.2 -0.531 61.7 173.3 -78.5 133.8 17.8 -1.9 9.1 32 547 A S E - D 0 148B 0 116,-2.2 116,-1.4 -2,-0.3 2,-0.3 -0.951 10.3-156.1-139.1 163.5 19.6 -2.6 12.4 33 548 A F E - D 0 147B 17 -2,-0.3 -20,-2.6 -19,-0.3 -19,-1.6 -0.975 16.9-169.6-144.9 144.4 20.8 -5.9 14.0 34 549 A I E -BD 12 146B 5 112,-2.2 112,-2.4 -2,-0.3 2,-0.4 -0.996 21.0-154.9-130.9 135.8 21.8 -7.6 17.2 35 550 A L E -BD 11 145B 7 -24,-2.4 -24,-3.0 -2,-0.4 110,-0.3 -0.901 7.0-144.1-114.5 139.6 23.6 -11.0 17.2 36 551 A S E - 0 0 1 108,-3.0 -27,-0.2 -2,-0.4 -26,-0.2 -0.631 24.0-126.0 -84.9 157.6 23.7 -13.8 19.7 37 552 A S E S+ 0 0 78 -29,-1.4 -28,-0.2 -2,-0.2 -1,-0.1 0.683 84.3 105.2 -74.6 -18.7 26.9 -15.7 20.1 38 553 A A E - 0 0 25 -30,-0.7 106,-1.8 106,-0.1 2,-0.3 -0.310 54.3-170.4 -61.2 142.0 24.8 -18.8 19.6 39 554 A S E + D 0 143B 80 104,-0.3 2,-0.3 26,-0.1 104,-0.2 -0.915 9.1 167.6-135.7 165.3 25.1 -20.4 16.2 40 555 A G E - D 0 142B 18 102,-2.2 102,-2.4 -2,-0.3 3,-0.1 -0.971 28.8-159.5-168.4 165.2 23.2 -23.1 14.3 41 556 A S S S+ 0 0 56 1,-0.5 2,-0.4 -2,-0.3 -1,-0.1 0.582 87.2 16.4-118.7 -70.3 22.6 -24.9 11.0 42 557 A D S S+ 0 0 72 76,-0.1 -1,-0.5 2,-0.0 2,-0.3 -0.935 87.6 117.0-110.1 140.3 19.2 -26.7 11.2 43 558 A F E -E 117 0B 12 74,-1.6 74,-2.7 -2,-0.4 2,-0.4 -0.973 61.7 -98.0-176.3 170.6 16.8 -25.6 14.0 44 559 A T E -EF 116 161B 20 117,-2.7 117,-2.6 -2,-0.3 2,-0.4 -0.965 40.0-177.6-109.3 140.1 13.5 -24.1 15.1 45 560 A Y E +EF 115 160B 0 70,-2.7 70,-3.1 -2,-0.4 2,-0.3 -0.997 8.2 161.9-142.7 130.2 13.8 -20.4 16.0 46 561 A E E +EF 114 159B 29 113,-2.3 113,-2.2 -2,-0.4 2,-0.3 -0.959 12.4 174.1-150.7 161.3 10.9 -18.3 17.3 47 562 A S E -E 113 0B 0 66,-1.9 66,-2.6 -2,-0.3 2,-0.4 -0.971 36.1-111.7-160.8 150.0 10.0 -15.1 19.1 48 563 A D E -EF 112 156B 22 108,-3.1 108,-1.8 -2,-0.3 2,-0.4 -0.771 41.7-167.0 -74.2 136.8 7.0 -12.9 20.1 49 564 A I E -EF 111 155B 0 62,-2.8 62,-2.9 -2,-0.4 2,-0.4 -0.996 13.3-178.3-134.0 128.8 7.3 -9.7 18.1 50 565 A T E -EF 110 154B 22 104,-2.3 104,-2.6 -2,-0.4 2,-0.5 -0.996 18.9-144.8-127.1 124.9 5.4 -6.5 18.6 51 566 A I E - F 0 153B 0 58,-0.5 57,-3.5 55,-0.4 58,-0.3 -0.794 25.4-157.5 -85.3 125.6 5.8 -3.4 16.4 52 567 A K - 0 0 50 100,-3.2 100,-0.4 -2,-0.5 2,-0.1 -0.403 27.5 -84.6 -93.7 171.9 5.4 -0.3 18.5 53 568 A D S S+ 0 0 112 -2,-0.1 -1,-0.1 98,-0.1 2,-0.1 -0.493 85.8 72.5 -68.5 149.0 4.5 3.3 17.6 54 569 A G S > S+ 0 0 23 1,-0.3 3,-2.1 -2,-0.1 98,-0.5 -0.301 76.2 23.1 121.3 157.7 7.5 5.3 16.4 55 570 A N T 3 S- 0 0 69 1,-0.3 -1,-0.3 96,-0.2 96,-0.2 -0.297 126.4 -30.6 49.9-133.5 9.8 5.7 13.4 56 571 A G T 3 S- 0 0 25 94,-0.4 -1,-0.3 -3,-0.1 95,-0.2 0.275 77.5-119.1 -94.7 10.9 8.2 4.3 10.3 57 572 A R < + 0 0 112 -3,-2.1 24,-0.5 -5,-0.1 94,-0.2 0.942 69.4 143.9 47.4 50.8 6.1 1.7 12.1 58 573 A G - 0 0 0 92,-2.0 22,-2.5 -4,-0.3 23,-0.6 0.771 41.3 -39.7 -89.6-108.6 8.0 -0.8 9.9 59 574 A A E -GH 79 149B 0 90,-2.4 90,-2.3 20,-0.3 2,-0.3 -0.862 25.0-155.6-134.8 156.5 9.2 -4.3 10.8 60 575 A G E -GH 78 148B 0 18,-2.0 18,-2.0 -2,-0.3 2,-0.3 -0.988 28.1-169.1-131.5 144.7 10.8 -6.7 13.3 61 576 A A E -GH 77 147B 0 86,-2.7 86,-2.3 -2,-0.3 2,-0.4 -0.960 29.4-131.4-141.7 144.2 12.7 -9.8 12.3 62 577 A L E -GH 76 146B 0 14,-2.4 14,-1.8 -2,-0.3 2,-0.4 -0.751 30.8-159.1 -75.3 140.4 14.3 -13.1 13.3 63 578 A M E +GH 75 145B 0 82,-2.5 82,-2.9 -2,-0.4 2,-0.3 -0.977 17.5 165.4-124.3 142.3 17.8 -13.4 11.8 64 579 A F E +G 74 0B 0 10,-2.6 10,-3.0 -2,-0.4 80,-0.2 -0.980 52.2 30.0-155.9 160.2 19.6 -16.7 11.3 65 580 A R E S+ 0 0 4 77,-0.5 2,-0.3 -2,-0.3 76,-0.2 0.873 85.5 167.3 51.1 40.4 22.5 -18.4 9.6 66 581 A S E - 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