==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL INVASION 05-MAR-10 3M1H . COMPND 2 MOLECULE: LYSINE SPECIFIC CYSTEINE PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PORPHYROMONAS GINGIVALIS; . AUTHOR N.LI,C.A.COLLYER,N.HUNTER . 695 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28408.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 369 53.1 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 . 236 34.0 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 0.1 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 . 47 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 8 4 0 16 4 4 5 3 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 . 4 0 0 4 4 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 1427 A A 0 0 101 0, 0.0 173,-2.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 127.4 -7.3 -1.6 13.6 2 1428 A E E +A 173 0A 118 171,-0.2 171,-0.3 1,-0.1 3,-0.1 -0.672 360.0 175.7 -86.8 132.0 -4.1 -0.0 14.8 3 1429 A V E S+ 0 0 62 169,-3.0 2,-0.3 -2,-0.4 170,-0.2 0.571 74.2 24.8-106.0 -15.7 -4.2 3.6 15.8 4 1430 A L E +A 172 0A 25 168,-1.6 168,-2.2 67,-0.0 -1,-0.3 -0.987 55.1 165.2-148.3 138.8 -0.6 3.8 17.0 5 1431 A N E +A 171 0A 86 -2,-0.3 2,-0.5 166,-0.2 166,-0.2 -0.741 14.3 176.4-155.9 99.1 2.5 1.8 16.1 6 1432 A E E +A 170 0A 32 164,-2.8 164,-2.0 -2,-0.2 163,-0.1 -0.939 19.5 170.6-120.1 121.1 5.8 3.3 17.2 7 1433 A D - 0 0 66 -2,-0.5 39,-0.2 162,-0.2 35,-0.1 0.396 41.2-133.4-103.2 -5.2 9.2 1.7 16.8 8 1434 A F > + 0 0 0 3,-0.2 3,-2.2 1,-0.1 39,-0.1 0.525 63.5 134.1 62.5 13.0 11.2 4.7 17.8 9 1435 A E T 3 S+ 0 0 61 1,-0.3 -1,-0.1 37,-0.1 3,-0.1 0.744 77.5 41.8 -70.9 -19.2 13.5 4.2 14.8 10 1436 A N T 3 S- 0 0 157 1,-0.5 -1,-0.3 36,-0.1 2,-0.1 0.028 123.7-105.2-103.7 27.2 13.3 7.9 14.0 11 1437 A G S < S- 0 0 14 -3,-2.2 -1,-0.5 -4,-0.1 -3,-0.2 -0.349 70.1 -25.0 82.0-173.1 13.6 9.0 17.7 12 1438 A I S S- 0 0 46 -3,-0.1 6,-0.1 -2,-0.1 18,-0.1 -0.678 81.9-120.1 -68.2 117.6 10.7 10.2 19.9 13 1439 A P > - 0 0 30 0, 0.0 3,-1.7 0, 0.0 -2,-0.1 -0.293 11.9-119.7 -63.6 149.2 8.3 11.6 17.3 14 1440 A A T 3 S+ 0 0 110 1,-0.3 -2,-0.0 3,-0.0 -3,-0.0 0.738 112.3 66.3 -55.2 -26.3 7.5 15.3 17.5 15 1441 A S T 3 S+ 0 0 74 2,-0.1 -1,-0.3 54,-0.0 55,-0.2 0.667 93.7 71.3 -72.2 -20.9 3.8 14.2 18.0 16 1442 A W S < S- 0 0 14 -3,-1.7 2,-0.4 53,-0.1 52,-0.2 -0.408 77.5-138.0 -85.8 173.0 4.7 12.6 21.3 17 1443 A K E -F 67 0B 28 50,-2.4 50,-3.4 -2,-0.1 2,-0.4 -0.995 6.0-151.7-139.3 137.6 5.5 14.6 24.5 18 1444 A T E -F 66 0B 43 -2,-0.4 2,-0.5 528,-0.2 48,-0.2 -0.865 9.5-161.3 -99.8 143.3 8.1 14.3 27.2 19 1445 A I E -F 65 0B 8 46,-2.4 46,-2.7 -2,-0.4 2,-1.1 -0.986 7.1-161.7-125.0 117.9 7.4 15.6 30.7 20 1446 A D E +F 64 0B 3 527,-2.3 3,-0.3 -2,-0.5 44,-0.2 -0.732 21.6 168.0 -93.1 80.1 10.3 16.2 33.1 21 1447 A A S S+ 0 0 46 42,-1.8 -1,-0.2 -2,-1.1 43,-0.2 0.861 72.9 50.3 -71.1 -31.6 8.3 16.3 36.3 22 1448 A D S S- 0 0 57 41,-0.9 -1,-0.2 -3,-0.2 42,-0.1 0.725 102.9-134.8 -77.3 -21.0 11.3 16.2 38.7 23 1449 A G + 0 0 40 -3,-0.3 -2,-0.1 40,-0.2 -3,-0.1 0.571 64.9 125.4 87.1 11.4 13.0 19.1 36.8 24 1450 A D S S- 0 0 63 2,-0.2 3,-0.1 37,-0.1 525,-0.1 0.518 79.2-112.7 -81.3 -4.3 16.5 17.7 36.5 25 1451 A G S S+ 0 0 53 1,-0.3 2,-0.4 523,-0.1 -1,-0.1 0.287 82.2 116.3 88.4 -8.4 16.7 18.1 32.7 26 1452 A N + 0 0 40 25,-0.1 -1,-0.3 3,-0.0 2,-0.2 -0.794 38.9 162.8 -96.5 133.4 16.9 14.4 32.1 27 1453 A N - 0 0 38 -2,-0.4 24,-0.3 -3,-0.1 2,-0.2 -0.759 50.3 -62.7-131.0 178.8 14.0 12.8 30.2 28 1454 A W S S+ 0 0 9 37,-0.3 2,-0.3 -2,-0.2 22,-0.2 -0.537 72.1 169.2 -60.1 137.5 13.0 9.7 28.3 29 1455 A T B -B 49 0A 28 20,-2.5 20,-2.5 -2,-0.2 18,-0.1 -0.997 51.9-145.7-156.4 151.4 15.4 9.8 25.4 30 1456 A T S S+ 0 0 24 -2,-0.3 8,-0.2 18,-0.2 17,-0.1 0.324 101.3 59.2 -98.2 5.0 16.8 7.8 22.5 31 1457 A T S S- 0 0 78 6,-0.2 -1,-0.2 18,-0.1 7,-0.1 -0.528 78.8-169.8-127.7 63.4 20.2 9.4 23.0 32 1458 A P >> - 0 0 2 0, 0.0 4,-2.5 0, 0.0 5,-0.6 -0.338 31.6 -84.6 -57.9 127.1 21.1 8.3 26.6 33 1459 A P T 45S+ 0 0 37 0, 0.0 22,-0.3 0, 0.0 -2,-0.0 -0.446 100.1 21.4 -70.4 156.2 24.2 10.1 28.0 34 1460 A P T 45S+ 0 0 80 0, 0.0 22,-0.0 0, 0.0 20,-0.0 -0.996 130.1 40.7 -90.2 -7.5 27.1 9.8 28.0 35 1461 A G T 45S- 0 0 66 -3,-0.3 3,-0.1 2,-0.1 -4,-0.0 0.863 84.3-152.4 -61.4 -39.0 27.1 7.7 24.8 36 1462 A G T <5 + 0 0 39 -4,-2.5 2,-0.3 1,-0.2 -1,-0.1 0.594 61.6 97.9 73.1 12.1 24.5 9.8 23.1 37 1463 A S S -J 44 0C 7 3,-1.3 2,-0.8 4,-0.2 3,-0.6 -0.069 34.3 -72.2 -78.3-179.0 16.3 -1.8 20.7 42 1468 A H T 3 S- 0 0 22 4,-0.3 -1,-0.1 1,-0.3 4,-0.1 -0.694 110.5 -33.3 -79.4 110.8 13.9 -4.7 20.7 43 1469 A N T 3 S+ 0 0 155 -2,-0.8 -1,-0.3 1,-0.2 2,-0.3 0.849 137.5 76.1 42.6 39.6 15.0 -6.6 17.6 44 1470 A S B < S-J 41 0C 38 -3,-0.6 -3,-1.3 1,-0.1 -1,-0.2 -0.972 91.8-105.0-167.0 166.8 15.8 -3.2 16.3 45 1471 A A S S+ 0 0 65 -2,-0.3 2,-0.4 -5,-0.2 -4,-0.2 0.871 92.7 48.0 -75.0 -39.5 18.4 -0.4 16.5 46 1472 A I + 0 0 36 -39,-0.2 -4,-0.3 -6,-0.2 2,-0.3 -0.874 50.3 160.6-117.7 139.6 16.5 2.2 18.6 47 1473 A C - 0 0 0 -8,-0.4 2,-0.4 -2,-0.4 -8,-0.2 -0.895 37.8-111.6-137.4 171.5 14.5 2.2 21.8 48 1474 A V E - C 0 167A 0 119,-2.4 119,-2.8 -2,-0.3 2,-0.3 -0.881 38.3-173.3-111.2 140.2 13.5 5.0 24.2 49 1475 A S E -BC 29 166A 0 -20,-2.5 -20,-2.5 -2,-0.4 2,-0.3 -0.937 19.8-159.5-140.5 150.8 15.1 5.0 27.7 50 1476 A S E - C 0 165A 0 115,-2.2 115,-2.4 -2,-0.3 2,-0.4 -0.995 23.0-130.3-135.4 140.8 14.9 6.8 31.1 51 1477 A A E + C 0 164A 4 -2,-0.3 113,-0.2 -24,-0.3 3,-0.1 -0.742 33.7 169.9-101.4 135.6 17.6 6.8 33.8 52 1478 A S S S+ 0 0 0 111,-2.7 8,-2.5 -2,-0.4 109,-2.2 0.391 93.6 22.6-101.0 -5.7 17.7 6.1 37.5 53 1479 A Y E -K 59 0D 23 110,-1.5 2,-0.5 6,-0.3 -1,-0.3 -0.913 69.5-160.0-159.5 131.5 21.6 6.2 37.2 54 1480 A I E >> -K 58 0D 0 4,-2.3 4,-2.8 -2,-0.3 3,-1.9 -0.971 28.1-115.1-118.9 125.1 23.8 7.9 34.5 55 1481 A N T 34 S+ 0 0 20 -2,-0.5 74,-0.1 -22,-0.3 73,-0.0 -0.280 102.0 16.9 -57.0 142.2 27.4 6.8 34.0 56 1482 A F T 34 S+ 0 0 176 72,-0.3 -1,-0.3 1,-0.1 73,-0.1 0.507 130.5 53.5 68.8 9.1 30.0 9.5 34.9 57 1483 A E T <4 S- 0 0 121 -3,-1.9 -2,-0.2 1,-0.1 -1,-0.1 0.567 93.0-137.8-130.4 -58.3 27.2 11.4 36.8 58 1484 A G E < -K 54 0D 8 -4,-2.8 -4,-2.3 70,-0.1 -1,-0.1 -0.788 47.1 -2.9 126.5-166.9 25.6 9.2 39.4 59 1485 A P E -K 53 0D 70 0, 0.0 -6,-0.3 0, 0.0 2,-0.3 -0.212 57.7-160.7 -61.3 142.9 22.1 8.3 40.8 60 1486 A Q - 0 0 26 -8,-2.5 101,-0.4 2,-0.0 99,-0.0 -0.820 18.2-140.5-117.6 163.2 19.1 10.2 39.5 61 1487 A N - 0 0 116 -2,-0.3 99,-0.1 99,-0.1 -37,-0.1 -0.659 33.8-166.1-121.6 71.7 15.6 10.7 40.9 62 1488 A P + 0 0 4 0, 0.0 96,-0.6 0, 0.0 97,-0.4 -0.269 32.5 167.1 -67.7 144.0 13.4 10.5 37.8 63 1489 A D E + G 0 157B 37 94,-0.2 -42,-1.8 95,-0.1 -41,-0.9 -0.614 34.2 157.9-140.5 78.0 9.8 11.5 37.5 64 1490 A N E -FG 20 156B 2 92,-2.4 92,-2.6 -44,-0.2 2,-0.4 -0.910 24.5-162.5-113.2 128.0 9.8 11.3 33.7 65 1491 A Y E -FG 19 155B 11 -46,-2.7 -46,-2.4 -2,-0.5 2,-0.4 -0.853 9.6-164.2-109.3 146.0 6.7 10.9 31.5 66 1492 A L E -FG 18 154B 0 88,-2.2 88,-2.6 -2,-0.4 2,-0.4 -0.992 20.5-166.4-123.3 116.1 6.5 9.8 27.8 67 1493 A V E -FG 17 153B 0 -50,-3.4 -50,-2.4 -2,-0.4 86,-0.2 -0.871 13.3-130.6-114.6 133.8 3.1 10.7 26.4 68 1494 A T - 0 0 1 84,-2.7 3,-0.1 -2,-0.4 -52,-0.1 -0.237 35.4 -93.2 -65.8 165.3 1.5 9.5 23.2 69 1495 A P - 0 0 25 0, 0.0 83,-0.3 0, 0.0 -1,-0.1 -0.260 66.9 -63.7 -67.1 172.1 -0.1 11.8 20.7 70 1496 A E - 0 0 126 -55,-0.2 2,-0.3 81,-0.1 81,-0.2 -0.417 60.6-156.1 -65.2 133.7 -3.9 12.3 21.1 71 1497 A L - 0 0 12 79,-2.8 2,-0.6 -2,-0.1 -1,-0.1 -0.748 15.2-143.0-110.9 152.1 -5.8 9.1 20.5 72 1498 A S + 0 0 92 -2,-0.3 78,-0.1 1,-0.0 3,-0.1 -0.946 35.8 151.3-116.3 106.6 -9.4 8.4 19.4 73 1499 A L > + 0 0 3 -2,-0.6 75,-2.4 76,-0.5 3,-1.9 -0.525 4.5 163.0-131.0 63.8 -10.7 5.3 21.3 74 1500 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.773 86.2 29.8 -61.1 -26.4 -14.4 5.9 21.5 75 1501 A G T 3 S- 0 0 59 1,-0.5 72,-0.3 72,-0.1 2,-0.1 0.154 121.1-105.4-111.4 16.1 -15.0 2.2 22.4 76 1502 A G < - 0 0 4 -3,-1.9 99,-2.5 70,-0.3 -1,-0.5 -0.316 37.9-148.7 84.9-176.1 -11.7 1.6 24.1 77 1503 A G E -DE 145 174A 5 68,-2.0 68,-3.0 97,-0.3 2,-0.4 -0.955 14.5 -94.4-173.2-173.5 -8.6 -0.2 22.9 78 1504 A T E -DE 144 173A 34 95,-2.3 95,-2.4 -2,-0.3 2,-0.5 -0.997 23.3-156.7-133.1 128.2 -5.6 -2.4 23.8 79 1505 A L E +DE 143 172A 0 64,-2.9 64,-2.9 -2,-0.4 2,-0.3 -0.891 12.6 177.8-100.1 132.7 -2.0 -1.2 24.4 80 1506 A T E +DE 142 171A 29 91,-2.8 91,-3.0 -2,-0.5 2,-0.3 -0.972 10.4 155.3-127.7 149.6 1.0 -3.5 23.9 81 1507 A F E -D 141 0A 1 60,-1.8 60,-3.0 -2,-0.3 2,-0.4 -0.972 35.1-117.6-159.7 165.4 4.6 -2.6 24.4 82 1508 A W E -DE 140 168A 61 86,-2.6 86,-2.2 -2,-0.3 2,-0.3 -0.920 28.9-178.8-116.6 141.2 8.0 -4.1 25.2 83 1509 A V E +DE 139 167A 3 56,-2.4 56,-2.5 -2,-0.4 2,-0.3 -0.973 6.0 163.5-137.4 143.0 10.1 -3.2 28.2 84 1510 A C E - E 0 166A 2 82,-1.8 82,-2.9 -2,-0.3 2,-0.5 -0.984 38.9-109.0-150.6 163.5 13.5 -4.2 29.6 85 1511 A A E - E 0 165A 5 52,-0.3 51,-2.8 -2,-0.3 80,-0.2 -0.750 24.9-141.7 -81.6 132.4 16.1 -3.1 32.1 86 1512 A Q S S+ 0 0 25 78,-2.7 2,-0.6 -2,-0.5 -1,-0.1 0.890 96.5 41.4 -64.6 -35.3 19.2 -1.8 30.2 87 1513 A D S > S- 0 0 0 77,-0.5 3,-2.0 3,-0.4 -1,-0.2 -0.943 74.0-157.7-111.4 108.7 21.5 -3.5 32.8 88 1514 A A T 3 S+ 0 0 16 46,-2.4 34,-0.7 -2,-0.6 33,-0.4 0.716 95.2 53.7 -53.5 -24.0 20.1 -7.0 33.7 89 1515 A N T 3 S+ 0 0 23 45,-0.3 35,-0.9 1,-0.3 -1,-0.3 0.406 113.7 38.3 -96.6 -4.1 22.1 -6.7 36.9 90 1516 A Y S < S+ 0 0 18 -3,-2.0 -3,-0.4 33,-0.1 73,-0.3 -0.550 81.0 139.7-134.2 66.0 20.6 -3.4 38.1 91 1517 A A + 0 0 5 -3,-0.4 2,-2.7 31,-0.4 27,-0.2 0.540 23.8 108.5 -91.5 -10.2 17.2 -4.2 36.8 92 1518 A S + 0 0 5 25,-0.1 2,-0.2 -3,-0.1 -1,-0.1 -0.164 40.7 154.1 -82.9 52.9 14.8 -2.8 39.5 93 1519 A E - 0 0 0 -2,-2.7 25,-2.3 71,-0.1 2,-0.5 -0.561 34.8-141.1 -80.8 141.8 13.3 0.1 37.7 94 1520 A H E +H 117 0B 5 23,-0.2 63,-1.6 -2,-0.2 2,-0.3 -0.896 31.2 157.5-107.3 126.0 9.9 1.3 38.7 95 1521 A Y E -HI 116 156B 5 21,-2.5 21,-2.5 -2,-0.5 2,-0.3 -0.955 20.3-161.8-144.2 162.5 7.4 2.4 36.1 96 1522 A A E -HI 115 155B 0 59,-2.0 59,-3.1 -2,-0.3 2,-0.4 -0.973 12.2-141.4-142.3 160.2 3.7 2.9 35.5 97 1523 A V E -HI 114 154B 0 17,-2.5 16,-2.4 -2,-0.3 17,-1.2 -0.979 24.3-177.1-122.4 132.1 1.3 3.3 32.6 98 1524 A Y E - 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