==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(XYLAN DEGRADATION) 22-NOV-00 1HEH . COMPND 2 MOLECULE: ENDO-1,4-BETA-XYLANASE D; . SOURCE 2 ORGANISM_SCIENTIFIC: CELLULOMONAS FIMI; . AUTHOR P.J.SIMPSON,X.HEFANG,D.N.BOLAM,P.WHITE,S.M.HANCOCK, . 88 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5298.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 40 45.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 23.9 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 . 1 1.1 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 1.1 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 . 10 11.4 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+3), 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 . 0 0.0 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 . 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 PARALLEL BRIDGES PER LADDER . 1 1 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 557 C T 0 0 179 0, 0.0 87,-0.0 0, 0.0 85,-0.0 0.000 360.0 360.0 360.0 100.5 14.0 18.0 2.9 2 558 C G + 0 0 69 2,-0.1 84,-0.0 85,-0.0 0, 0.0 0.415 360.0 175.7 150.9 36.5 10.3 17.3 2.3 3 559 C S - 0 0 60 84,-0.1 83,-0.2 1,-0.1 2,-0.2 -0.174 37.1-105.1 -59.0 158.8 9.6 13.5 2.8 4 560 C a - 0 0 26 82,-0.1 2,-0.5 23,-0.1 -1,-0.1 -0.505 29.3-118.4 -85.2 157.8 6.0 12.5 2.5 5 561 C S + 0 0 55 -2,-0.2 20,-0.7 81,-0.0 2,-0.3 -0.813 44.2 156.0 -98.2 132.5 3.9 11.6 5.6 6 562 C V - 0 0 45 -2,-0.5 2,-0.3 18,-0.2 18,-0.2 -0.919 22.8-162.8-146.1 173.0 2.5 8.1 5.9 7 563 C S - 0 0 64 16,-0.4 16,-1.7 -2,-0.3 2,-0.5 -0.955 10.5-146.2-160.1 138.3 1.4 5.5 8.4 8 564 C A + 0 0 67 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.925 21.0 174.4-113.7 129.6 0.8 1.7 8.3 9 565 C V - 0 0 84 -2,-0.5 2,-3.0 12,-0.2 12,-1.1 -0.911 46.7-103.0-128.3 157.9 -2.0 0.1 10.3 10 566 C R - 0 0 210 -2,-0.3 10,-0.2 10,-0.2 9,-0.1 -0.276 55.6-175.5 -75.9 60.1 -3.3 -3.6 10.5 11 567 C G - 0 0 10 -2,-3.0 8,-0.4 7,-0.1 10,-0.0 0.153 45.8 -44.8 -46.1 175.9 -6.2 -2.6 8.3 12 568 C E S S+ 0 0 155 6,-0.1 7,-1.0 8,-0.1 2,-0.3 0.078 74.2 170.9 -40.2 161.6 -8.9 -5.2 7.6 13 569 C E B -A 18 0A 109 5,-0.3 5,-0.3 58,-0.0 2,-0.2 -0.908 19.5-147.6-160.2-172.8 -7.4 -8.6 6.7 14 570 C W - 0 0 106 3,-1.2 5,-0.1 -2,-0.3 0, 0.0 -0.806 33.2 -97.8-151.1-167.8 -8.3 -12.3 6.2 15 571 C A S S+ 0 0 80 -2,-0.2 60,-0.2 1,-0.1 -1,-0.1 0.887 120.9 31.7 -90.7 -45.6 -6.9 -15.8 6.5 16 572 C D S S+ 0 0 112 1,-0.2 58,-1.6 58,-0.1 59,-1.1 0.779 136.4 15.8 -82.6 -25.4 -5.7 -16.4 2.9 17 573 C R E - B 0 73A 86 56,-0.2 -3,-1.2 57,-0.2 2,-0.3 -0.984 68.7-148.8-144.6 155.6 -4.9 -12.7 2.4 18 574 C F E -AB 13 72A 15 54,-2.3 54,-1.1 -2,-0.3 -5,-0.3 -0.875 9.0-155.1-124.2 158.6 -4.4 -9.7 4.6 19 575 C N E - B 0 71A 2 -7,-1.0 2,-0.3 -8,-0.4 52,-0.2 -0.772 3.4-157.2-125.9 173.3 -5.1 -6.0 4.0 20 576 C V E - B 0 70A 5 50,-1.3 50,-1.2 -2,-0.2 2,-0.5 -0.992 13.4-141.7-149.3 156.1 -3.8 -2.7 5.4 21 577 C T E - B 0 69A 58 -12,-1.1 48,-0.2 -2,-0.3 -12,-0.2 -0.827 21.1-167.0-123.3 94.3 -5.0 1.0 5.8 22 578 C Y E - B 0 68A 0 46,-1.6 46,-1.0 -2,-0.5 2,-0.4 -0.535 6.4-154.8 -79.9 146.1 -2.1 3.4 5.2 23 579 C S E - B 0 67A 45 -16,-1.7 -16,-0.4 44,-0.2 2,-0.3 -0.953 4.5-160.3-123.5 141.6 -2.7 7.1 6.2 24 580 C V - 0 0 18 42,-0.7 -18,-0.2 -2,-0.4 42,-0.1 -0.857 8.0-164.7-118.1 154.7 -1.0 10.2 4.8 25 581 C S S S- 0 0 99 -20,-0.7 -1,-0.2 -2,-0.3 -19,-0.1 0.834 80.6 -19.3-101.6 -70.7 -0.8 13.7 6.3 26 582 C G S S+ 0 0 60 1,-0.1 2,-1.1 40,-0.1 3,-0.4 -0.198 81.3 137.1-134.2 45.0 0.3 16.2 3.6 27 583 C S + 0 0 4 -22,-0.3 -23,-0.1 1,-0.2 -1,-0.1 -0.173 14.4 156.6 -85.4 46.9 1.8 14.0 0.8 28 584 C S + 0 0 112 -2,-1.1 2,-1.1 1,-0.2 -1,-0.2 0.864 69.5 60.6 -40.3 -36.5 0.1 16.1 -1.9 29 585 C S S S- 0 0 97 -3,-0.4 2,-0.4 31,-0.1 -1,-0.2 -0.741 86.5-154.3 -96.5 93.4 2.9 14.7 -4.1 30 586 C W + 0 0 15 -2,-1.1 -2,-0.1 1,-0.1 55,-0.0 -0.506 41.6 134.2 -69.6 124.8 2.5 10.9 -4.0 31 587 C V + 0 0 105 -2,-0.4 -1,-0.1 53,-0.1 29,-0.1 0.034 24.4 140.6-160.0 32.5 5.8 9.2 -4.6 32 588 C V - 0 0 2 53,-0.1 27,-0.8 27,-0.1 2,-0.5 -0.399 42.1-140.6 -79.6 162.5 6.2 6.5 -2.0 33 589 C T E -D 58 0B 54 51,-0.5 51,-0.5 25,-0.2 2,-0.3 -0.919 11.3-153.4-127.0 107.2 7.6 3.1 -2.7 34 590 C L E -D 57 0B 13 23,-1.9 23,-1.4 -2,-0.5 2,-0.6 -0.576 6.0-153.4 -79.5 139.7 5.9 0.1 -1.1 35 591 C G E -D 56 0B 40 47,-1.4 47,-0.4 -2,-0.3 21,-0.1 -0.895 8.2-158.6-117.6 106.5 8.2 -2.9 -0.5 36 592 C L - 0 0 27 19,-0.8 2,-0.1 -2,-0.6 5,-0.1 0.135 29.5-105.4 -65.0-167.9 6.3 -6.3 -0.4 37 593 C N - 0 0 72 3,-0.1 3,-0.4 41,-0.0 -1,-0.1 -0.435 63.8 -78.3-121.7 59.9 7.9 -9.3 1.3 38 594 C G S S+ 0 0 83 1,-0.2 2,-0.3 -2,-0.1 3,-0.1 0.899 123.4 19.6 46.4 95.7 9.0 -11.5 -1.7 39 595 C G S S+ 0 0 65 1,-0.3 -1,-0.2 38,-0.0 34,-0.1 -0.483 87.4 114.6 115.8 -63.4 5.7 -13.2 -2.8 40 596 C Q - 0 0 3 -3,-0.4 -1,-0.3 -2,-0.3 15,-0.3 -0.169 50.2-172.7 -44.0 114.3 3.1 -10.9 -1.3 41 597 C S - 0 0 45 32,-0.2 32,-1.6 13,-0.1 2,-0.3 -0.772 26.5-104.5-113.2 160.6 1.4 -9.4 -4.4 42 598 C V + 0 0 27 11,-0.7 30,-0.2 -2,-0.3 3,-0.1 -0.648 32.9 175.7 -84.3 136.9 -1.2 -6.6 -4.7 43 599 C Q - 0 0 81 1,-0.4 2,-0.3 -2,-0.3 -1,-0.2 0.782 63.0 -24.1-107.4 -43.2 -4.7 -7.8 -5.5 44 600 C S - 0 0 46 2,-0.0 27,-2.0 27,-0.0 -1,-0.4 -0.989 55.1-168.3-164.5 159.7 -6.7 -4.5 -5.4 45 601 C S E -C 70 0A 40 -2,-0.3 2,-0.3 25,-0.2 25,-0.2 -0.936 1.5-166.3-148.0 170.7 -6.7 -1.0 -3.9 46 602 C W E +C 69 0A 124 23,-1.4 23,-1.3 -2,-0.3 3,-0.1 -0.992 63.9 40.8-159.5 153.7 -8.9 2.0 -3.4 47 603 C N S S+ 0 0 95 -2,-0.3 2,-0.3 21,-0.2 20,-0.1 0.794 118.0 23.8 77.2 26.0 -8.7 5.7 -2.4 48 604 C A S S- 0 0 15 -3,-0.1 2,-0.3 13,-0.1 -1,-0.1 -0.895 83.0-100.0 162.9 168.2 -5.5 6.1 -4.5 49 605 C A E -E 60 0B 37 11,-1.5 11,-2.0 -2,-0.3 2,-0.3 -0.844 27.7-161.1-114.1 152.2 -3.6 4.7 -7.5 50 606 C L E -E 59 0B 50 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.953 10.7-140.5-131.2 151.6 -0.6 2.4 -7.4 51 607 C T E +E 58 0B 70 7,-1.7 7,-0.8 -2,-0.3 2,-0.1 -0.936 68.6 7.9-114.8 122.9 2.1 1.5 -9.9 52 608 C G - 0 0 41 -2,-0.5 5,-0.1 5,-0.2 3,-0.1 -0.398 59.8-132.4 102.1 176.0 3.3 -2.1 -10.2 53 609 C S S S+ 0 0 71 1,-0.3 -11,-0.7 -2,-0.1 -1,-0.1 0.149 82.9 24.2-156.9 22.8 2.0 -5.3 -8.6 54 610 C S S S+ 0 0 91 -13,-0.2 2,-0.6 2,-0.0 -1,-0.3 -0.415 114.6 13.0 169.9 108.5 5.0 -7.1 -7.2 55 611 C G S S+ 0 0 44 -15,-0.3 -19,-0.8 -2,-0.1 2,-0.4 -0.791 122.4 5.6 120.9 -91.0 8.5 -5.8 -6.1 56 612 C T E +D 35 0B 103 -2,-0.6 2,-0.3 -21,-0.1 -21,-0.2 -0.912 68.4 174.6-134.2 109.7 8.5 -2.0 -5.9 57 613 C V E -D 34 0B 7 -23,-1.4 -23,-1.9 -2,-0.4 2,-0.3 -0.729 13.3-152.8-110.0 162.3 5.2 -0.0 -6.3 58 614 C T E -DE 33 51B 41 -7,-0.8 -7,-1.7 -2,-0.3 -25,-0.2 -0.982 17.0-118.9-135.3 147.3 4.6 3.7 -5.9 59 615 C A E - E 0 50B 3 -27,-0.8 -9,-0.2 -2,-0.3 -27,-0.1 -0.506 29.9-163.6 -82.2 153.7 1.4 5.7 -5.0 60 616 C R E - E 0 49B 158 -11,-2.0 -11,-1.5 -2,-0.2 2,-0.1 -0.981 19.7-111.4-139.1 151.8 0.0 8.2 -7.5 61 617 C P + 0 0 83 0, 0.0 -13,-0.1 0, 0.0 -32,-0.0 -0.409 30.7 168.9 -77.6 153.1 -2.4 11.2 -7.3 62 618 C N S S- 0 0 105 -2,-0.1 -14,-0.1 -15,-0.1 -15,-0.0 0.146 77.1 -46.6-152.3 21.0 -5.9 10.9 -8.9 63 619 C G S S- 0 0 68 2,-0.1 2,-0.1 0, 0.0 -15,-0.0 -0.254 112.3 -30.3 140.3 -51.1 -7.8 13.9 -7.6 64 620 C S S S+ 0 0 119 1,-0.0 2,-0.3 0, 0.0 -36,-0.0 -0.393 72.1 134.5 164.2 113.7 -7.3 14.0 -3.8 65 621 C G + 0 0 18 -2,-0.1 3,-0.1 -37,-0.1 -2,-0.1 -0.842 18.0 173.7-172.5 132.1 -6.7 11.2 -1.3 66 622 C N S S+ 0 0 66 -2,-0.3 -42,-0.7 1,-0.2 2,-0.6 0.537 74.4 62.4-118.9 -15.0 -4.3 10.6 1.6 67 623 C S E +B 23 0A 55 -44,-0.2 2,-0.4 -20,-0.1 -44,-0.2 -0.932 61.9 163.9-116.5 116.0 -5.7 7.3 3.0 68 624 C F E -B 22 0A 6 -46,-1.0 -46,-1.6 -2,-0.6 2,-0.3 -0.981 20.6-152.9-132.1 143.4 -5.6 4.3 0.7 69 625 C G E -BC 21 46A 1 -23,-1.3 -23,-1.4 -2,-0.4 2,-0.3 -0.825 12.2-174.3-112.9 153.6 -6.0 0.6 1.5 70 626 C V E -BC 20 45A 4 -50,-1.2 -50,-1.3 -2,-0.3 -25,-0.2 -0.995 19.9-124.5-145.4 151.6 -4.5 -2.4 -0.5 71 627 C T E -B 19 0A 2 -27,-2.0 2,-0.3 -2,-0.3 -28,-0.2 -0.409 19.6-163.6 -89.5 171.1 -4.8 -6.2 -0.3 72 628 C F E -B 18 0A 2 -54,-1.1 -54,-2.3 -30,-0.2 -30,-0.2 -0.794 14.2-137.7-159.2 111.9 -1.8 -8.6 0.0 73 629 C Y E +B 17 0A 79 -32,-1.6 -32,-0.2 -2,-0.3 -56,-0.2 -0.450 25.3 171.4 -69.9 141.2 -1.8 -12.3 -0.7 74 630 C K + 0 0 72 -58,-1.6 -57,-0.2 -34,-0.1 -1,-0.2 0.727 13.2 162.9-115.8 -61.1 0.2 -14.3 1.9 75 631 C N S S- 0 0 123 -59,-1.1 -59,-0.1 1,-0.2 -58,-0.1 0.827 101.5 -9.1 43.1 29.6 -0.3 -18.1 1.4 76 632 C G S S+ 0 0 73 -60,-0.1 -1,-0.2 2,-0.0 -36,-0.1 0.614 106.7 130.8 123.4 28.9 2.8 -18.3 3.6 77 633 C S - 0 0 24 1,-0.1 2,-0.1 -38,-0.1 -3,-0.1 0.158 29.5-175.9 -88.4-148.6 4.0 -14.7 4.0 78 634 C S + 0 0 106 1,-0.5 -1,-0.1 -41,-0.0 -2,-0.0 -0.482 52.1 54.3-171.5-112.9 4.9 -13.0 7.2 79 635 C A S S- 0 0 60 -2,-0.1 -1,-0.5 1,-0.1 -42,-0.0 -0.113 83.7-117.0 -43.4 134.5 6.0 -9.4 8.0 80 636 C T - 0 0 78 1,-0.1 -1,-0.1 -3,-0.1 -70,-0.0 -0.281 29.9-100.5 -73.3 165.7 3.3 -7.1 6.5 81 637 C P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 -45,-0.1 -0.211 36.8-163.0 -78.6 171.9 4.1 -4.6 3.8 82 638 C G - 0 0 29 -47,-0.4 -47,-1.4 -49,-0.1 2,-0.4 -0.996 18.9-117.5-155.7 156.3 4.7 -0.8 4.3 83 639 C A - 0 0 18 -2,-0.3 2,-0.3 -49,-0.2 -49,-0.2 -0.822 27.3-140.9-100.8 135.1 4.8 2.4 2.3 84 640 C T + 0 0 71 -51,-0.5 -51,-0.5 -2,-0.4 -53,-0.1 -0.683 27.5 163.7 -94.4 148.7 8.1 4.4 2.2 85 641 C a + 0 0 27 -2,-0.3 2,-0.3 -53,-0.2 -79,-0.1 -0.358 26.1 127.3-160.4 69.6 8.3 8.2 2.3 86 642 C A - 0 0 81 -83,-0.2 2,-0.6 2,-0.1 -82,-0.1 -0.791 53.4-121.9-123.9 169.5 11.8 9.5 3.1 87 643 C T 0 0 68 -2,-0.3 -84,-0.1 -84,-0.1 -85,-0.0 -0.886 360.0 360.0-116.6 105.4 14.1 12.1 1.4 88 644 C G 0 0 151 -2,-0.6 -2,-0.1 -87,-0.0 0, 0.0 -0.973 360.0 360.0 122.8 360.0 17.5 10.7 0.3