==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/IMMUNE SYSTEM 18-APR-11 3RKD . COMPND 2 MOLECULE: CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS E VIRUS; . AUTHOR X.H.TANG,J.SIVARAMAN . 1153 8 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48562.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 745 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 460 39.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.0 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 . 113 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 2 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 RESIDUES PER ALPHA HELIX . 0 4 0 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 0 PARALLEL BRIDGES PER LADDER . 12 7 17 10 15 17 2 2 4 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 4 8 2 6 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 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 1 459 A S 0 0 163 0, 0.0 46,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.0 -0.5 25.3 -35.7 2 460 A R - 0 0 42 45,-0.1 47,-0.2 2,-0.0 45,-0.0 -0.782 360.0-127.5 -92.1 122.0 -2.1 21.9 -35.8 3 461 A P > - 0 0 78 0, 0.0 3,-1.7 0, 0.0 46,-0.1 -0.269 23.6-113.6 -62.0 154.4 -3.0 20.5 -32.4 4 462 A F T 3 S+ 0 0 13 46,-0.3 47,-0.1 1,-0.3 45,-0.0 0.921 114.5 63.1 -55.6 -44.8 -1.7 17.0 -31.7 5 463 A S T 3 S+ 0 0 27 1,-0.2 57,-2.6 45,-0.1 2,-1.2 0.585 84.6 81.5 -58.4 -13.2 -5.2 15.6 -31.6 6 464 A V E < +a 62 0A 49 -3,-1.7 2,-0.2 55,-0.2 -1,-0.2 -0.767 69.6 177.0 -97.4 89.5 -5.7 16.5 -35.3 7 465 A L E -a 63 0A 1 55,-2.4 57,-2.2 -2,-1.2 58,-0.6 -0.633 10.7-169.7 -95.4 154.1 -3.9 13.6 -36.9 8 466 A R > - 0 0 130 55,-0.2 3,-1.9 -2,-0.2 135,-0.2 -0.957 36.3 -81.1-140.0 155.8 -3.6 12.8 -40.7 9 467 A A T 3 S+ 0 0 25 -2,-0.3 135,-0.2 1,-0.3 3,-0.1 -0.270 116.0 21.7 -55.9 141.3 -2.5 9.9 -42.8 10 468 A N T 3 S+ 0 0 95 133,-3.2 -1,-0.3 1,-0.3 2,-0.2 0.509 84.4 142.8 75.1 6.7 1.3 9.8 -43.2 11 469 A D < - 0 0 14 -3,-1.9 132,-2.2 132,-0.1 2,-0.6 -0.541 48.6-134.4 -70.3 146.3 1.9 11.9 -40.0 12 470 A V E -C 142 0B 50 130,-0.2 33,-2.7 -2,-0.2 2,-0.5 -0.936 19.1-161.9-109.5 119.6 4.9 10.5 -38.3 13 471 A L E -CD 141 44B 0 128,-3.0 128,-2.6 -2,-0.6 2,-0.6 -0.887 7.7-152.9-106.0 128.1 4.5 9.9 -34.5 14 472 A W E -CD 140 43B 112 29,-2.8 29,-1.7 -2,-0.5 2,-0.4 -0.878 18.4-162.9 -97.6 119.3 7.5 9.5 -32.2 15 473 A L E -CD 139 42B 0 124,-3.2 124,-2.1 -2,-0.6 2,-0.5 -0.827 13.5-167.9-106.0 140.9 6.5 7.5 -29.2 16 474 A S E -CD 138 41B 35 25,-2.1 25,-1.7 -2,-0.4 2,-0.8 -0.938 6.9-168.9-127.0 105.4 8.5 7.3 -26.0 17 475 A L E > -CD 137 40B 0 120,-3.1 120,-2.7 -2,-0.5 3,-0.7 -0.857 11.3-153.7 -98.8 107.5 7.2 4.5 -23.8 18 476 A T E 3 S- 0 0 28 21,-2.9 21,-0.5 -2,-0.8 20,-0.2 -0.644 71.8 -5.2 -84.0 136.0 8.7 4.8 -20.3 19 477 A A E 3 S- 0 0 13 -2,-0.3 -1,-0.2 1,-0.1 117,-0.2 0.854 85.9-178.7 51.3 44.5 9.1 1.7 -18.2 20 478 A A E < -C 135 0B 0 115,-1.9 115,-2.0 -3,-0.7 2,-0.3 -0.358 8.5-155.6 -70.2 153.5 7.3 -0.5 -20.7 21 479 A E E -H 36 0C 26 15,-2.1 15,-2.1 113,-0.2 112,-0.2 -0.979 20.3-106.7-135.2 147.6 6.8 -4.2 -19.8 22 480 A Y E -H 35 0C 45 110,-2.3 2,-0.4 -2,-0.3 13,-0.2 -0.494 39.8-176.7 -69.4 136.0 6.3 -7.4 -21.8 23 481 A D E +H 34 0C 15 11,-2.8 11,-2.1 -2,-0.2 6,-0.2 -0.963 27.7 152.8-143.3 121.8 2.8 -8.7 -21.6 24 482 A Q S S+ 0 0 93 -2,-0.4 6,-0.1 4,-0.2 8,-0.1 0.082 79.2 46.8-131.6 23.6 1.2 -11.8 -23.1 25 483 A S S S+ 0 0 103 4,-0.2 4,-0.1 5,-0.1 5,-0.1 0.547 119.5 17.3-137.3 -20.8 -1.6 -12.4 -20.6 26 484 A T S S+ 0 0 36 3,-0.1 -3,-0.0 538,-0.0 3,-0.0 0.712 138.5 16.2-121.9 -55.6 -3.5 -9.2 -19.9 27 485 A Y S S+ 0 0 4 7,-0.1 2,-0.2 2,-0.0 8,-0.1 0.530 137.7 29.5 -96.0 -9.6 -2.9 -6.5 -22.5 28 486 A G S S- 0 0 1 6,-0.1 2,-0.3 46,-0.1 -4,-0.2 -0.761 73.4-143.2-135.5 179.9 -1.5 -9.2 -24.8 29 487 A S B > -M 32 0D 29 3,-1.6 3,-1.9 -2,-0.2 -4,-0.2 -0.867 37.7 -93.9-141.1 174.1 -2.0 -12.9 -25.4 30 488 A S T 3 S+ 0 0 86 1,-0.3 -5,-0.1 -2,-0.3 -6,-0.0 0.755 129.4 44.3 -63.9 -23.4 0.2 -15.9 -26.3 31 489 A T T 3 S+ 0 0 94 1,-0.2 -1,-0.3 -7,-0.1 -7,-0.0 0.164 128.8 26.7-105.1 16.6 -0.7 -15.3 -30.0 32 490 A G B < S-M 29 0D 19 -3,-1.9 -3,-1.6 -8,-0.1 -1,-0.2 -0.201 74.2-176.7-174.2 70.9 -0.2 -11.6 -29.7 33 491 A P - 0 0 3 0, 0.0 92,-1.6 0, 0.0 2,-0.3 -0.260 10.6-169.2 -71.2 164.7 2.3 -10.3 -27.0 34 492 A V E -HI 23 124C 13 -11,-2.1 -11,-2.8 90,-0.2 2,-0.5 -0.959 28.6-127.0-149.2 163.4 2.8 -6.6 -26.5 35 493 A Y E -HI 22 123C 0 88,-2.1 88,-2.5 -2,-0.3 2,-0.3 -0.966 41.8-174.2-108.8 131.0 5.1 -4.1 -24.7 36 494 A V E +HI 21 122C 3 -15,-2.1 -15,-2.1 -2,-0.5 2,-0.3 -0.964 13.3 173.5-133.5 148.9 2.7 -1.9 -22.7 37 495 A S E - I 0 121C 3 84,-1.5 84,-2.3 -2,-0.3 3,-0.1 -0.988 30.6-155.3-155.1 146.0 3.1 1.3 -20.7 38 496 A D S S+ 0 0 22 -2,-0.3 2,-0.4 82,-0.2 16,-0.2 0.267 90.7 70.0-101.8 8.2 1.0 3.9 -18.8 39 497 A S + 0 0 0 -21,-0.5 -21,-2.9 82,-0.1 2,-0.4 -0.746 69.7 141.8-127.0 81.3 3.8 6.5 -19.1 40 498 A V E -D 17 0B 1 -2,-0.4 13,-2.6 -23,-0.2 2,-0.4 -0.976 31.3-165.3-131.2 136.2 3.9 7.4 -22.8 41 499 A T E -DE 16 52B 9 -25,-1.7 -25,-2.1 -2,-0.4 2,-0.4 -0.891 8.7-159.8-115.6 147.9 4.4 10.6 -24.8 42 500 A L E -DE 15 51B 2 9,-2.7 9,-2.5 -2,-0.4 2,-0.4 -0.989 4.7-169.3-128.8 137.9 3.6 11.1 -28.5 43 501 A V E -DE 14 50B 42 -29,-1.7 -29,-2.8 -2,-0.4 2,-1.1 -0.993 24.4-135.8-130.3 131.2 5.0 13.7 -30.8 44 502 A N E > -D 13 0B 0 5,-3.3 4,-3.4 -2,-0.4 5,-0.3 -0.766 25.9-153.4 -81.5 104.6 3.9 14.6 -34.3 45 503 A V T 4 S+ 0 0 78 -33,-2.7 -1,-0.2 -2,-1.1 -32,-0.1 0.848 86.1 45.9 -51.1 -44.0 7.5 14.8 -35.7 46 504 A A T 4 S+ 0 0 90 -34,-0.4 -1,-0.2 1,-0.2 -33,-0.1 0.910 124.2 30.4 -69.6 -43.8 6.6 17.3 -38.5 47 505 A T T 4 S- 0 0 55 2,-0.1 -2,-0.2 -3,-0.1 -1,-0.2 0.743 95.5-132.3 -88.6 -25.4 4.5 19.7 -36.5 48 506 A G < + 0 0 50 -4,-3.4 -3,-0.1 1,-0.3 2,-0.1 0.364 55.2 145.5 88.8 -5.8 6.2 19.3 -33.2 49 507 A A - 0 0 19 -5,-0.3 -5,-3.3 -47,-0.2 -1,-0.3 -0.403 27.4-172.7 -66.3 140.6 2.8 18.9 -31.4 50 508 A Q E -E 43 0B 85 -7,-0.2 2,-0.3 -3,-0.1 -46,-0.3 -0.903 14.2-174.0-136.7 163.9 3.0 16.5 -28.5 51 509 A A E -E 42 0B 7 -9,-2.5 -9,-2.7 -2,-0.3 2,-0.6 -0.978 25.6-128.6-152.2 160.7 0.8 14.7 -26.0 52 510 A V E > -E 41 0B 11 -2,-0.3 3,-1.4 3,-0.3 -11,-0.2 -0.978 24.6-142.1-112.5 120.1 0.9 12.5 -22.9 53 511 A A G > S+ 0 0 0 -13,-2.6 3,-1.0 -2,-0.6 -1,-0.1 0.887 97.0 53.4 -51.6 -48.4 -1.3 9.5 -23.5 54 512 A R G 3 S+ 0 0 0 -14,-0.3 64,-0.4 1,-0.3 -1,-0.3 0.668 113.8 45.4 -65.2 -14.9 -2.7 9.3 -19.9 55 513 A S G < S+ 0 0 58 -3,-1.4 2,-0.4 63,-0.1 -3,-0.3 -0.310 92.2 95.0-124.5 51.0 -3.7 12.9 -20.0 56 514 A L S < S- 0 0 25 -3,-1.0 2,-1.2 -5,-0.1 556,-0.2 -0.994 73.9-122.5-138.5 142.6 -5.4 13.3 -23.4 57 515 A D > - 0 0 41 -2,-0.4 3,-1.2 1,-0.2 4,-0.2 -0.759 28.2-174.1 -85.5 99.7 -9.1 13.0 -24.4 58 516 A W G > S+ 0 0 3 -2,-1.2 3,-0.5 1,-0.3 10,-0.4 0.617 77.1 67.6 -71.8 -12.9 -8.8 10.2 -26.9 59 517 A T G 3 S+ 0 0 85 1,-0.2 -1,-0.3 8,-0.1 -2,-0.1 0.688 100.7 50.3 -78.3 -17.6 -12.5 10.6 -27.8 60 518 A K G < S+ 0 0 150 -3,-1.2 2,-0.2 7,-0.1 -1,-0.2 0.406 86.6 107.0 -98.9 -0.0 -11.7 14.0 -29.3 61 519 A V < - 0 0 0 -3,-0.5 7,-0.8 -4,-0.2 2,-0.3 -0.559 52.1-165.9 -77.9 142.7 -8.8 12.7 -31.4 62 520 A T E -aB 6 67A 38 -57,-2.6 -55,-2.4 -2,-0.2 2,-0.5 -0.965 16.8-156.8-132.3 150.0 -9.4 12.5 -35.2 63 521 A L E > S-aB 7 66A 5 3,-2.9 3,-1.7 -2,-0.3 -55,-0.2 -0.984 88.4 -15.0-126.2 114.5 -7.6 10.8 -38.0 64 522 A D T 3 S- 0 0 55 -57,-2.2 -56,-0.1 -2,-0.5 -1,-0.1 0.878 132.0 -53.5 57.8 37.4 -8.3 12.4 -41.4 65 523 A G T 3 S+ 0 0 62 -58,-0.6 -1,-0.3 1,-0.2 -57,-0.1 0.320 118.1 104.3 83.7 -8.0 -11.3 14.1 -39.8 66 524 A R E < S-B 63 0A 136 -3,-1.7 -3,-2.9 1,-0.1 -1,-0.2 -0.798 75.7-103.3-110.1 150.6 -12.9 11.0 -38.3 67 525 A P E -B 62 0A 99 0, 0.0 -5,-0.2 0, 0.0 2,-0.1 -0.277 48.1 -95.1 -64.1 154.2 -13.0 9.7 -34.7 68 526 A L - 0 0 18 -7,-0.8 2,-0.1 -10,-0.4 13,-0.1 -0.443 39.3-123.3 -69.9 144.2 -10.7 6.8 -33.9 69 527 A S - 0 0 74 11,-0.5 11,-2.6 -2,-0.1 2,-0.3 -0.459 24.7-145.6 -82.9 162.1 -12.3 3.4 -34.2 70 528 A T E -J 79 0C 73 9,-0.2 2,-0.3 -2,-0.1 9,-0.2 -0.919 10.8-164.4-129.0 155.7 -12.3 1.1 -31.1 71 529 A I E -J 78 0C 53 7,-2.2 7,-2.6 -2,-0.3 2,-0.5 -0.917 19.4-126.5-135.1 161.1 -12.0 -2.6 -30.7 72 530 A Q E +J 77 0C 157 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.944 40.0 155.4-110.1 128.2 -12.7 -5.1 -28.0 73 531 A Q E > +J 76 0C 74 3,-2.6 3,-1.6 -2,-0.5 -2,-0.1 -0.966 63.1 3.8-155.6 135.6 -9.8 -7.4 -27.2 74 532 A H T 3 S- 0 0 66 -2,-0.3 3,-0.1 1,-0.3 -46,-0.1 0.842 128.5 -62.2 57.7 33.4 -8.7 -9.4 -24.1 75 533 A S T 3 S+ 0 0 133 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.722 118.5 105.0 64.3 24.1 -11.9 -8.1 -22.4 76 534 A K E < -J 73 0C 20 -3,-1.6 -3,-2.6 -49,-0.0 2,-0.5 -0.875 69.3-122.5-129.3 161.5 -10.7 -4.5 -22.8 77 535 A T E -J 72 0C 44 -2,-0.3 38,-2.9 -5,-0.2 2,-0.4 -0.921 30.0-173.8-109.4 130.8 -11.6 -1.6 -25.1 78 536 A F E -JK 71 114C 0 -7,-2.6 -7,-2.2 -2,-0.5 2,-0.3 -0.958 24.8-133.4-127.8 143.1 -8.9 0.0 -27.2 79 537 A F E -JK 70 113C 11 34,-3.3 34,-2.0 -2,-0.4 2,-0.4 -0.689 34.5-139.2 -84.0 144.9 -8.7 3.0 -29.5 80 538 A V E - 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