==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 04-OCT-10 3P30 . COMPND 2 MOLECULE: HIV-1 GP41; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR G.FREY,J.CHEN,S.RITS-VOLLOCH,M.M.FREEMAN,S.ZOLLA-PAZNER,B.CH . 521 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24663.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 348 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 171 32.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 47 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 17.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 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 2 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 5 5 6 0 4 7 3 0 2 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 . 1 0 3 3 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 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 1 538 A T > 0 0 153 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -44.4 0.7 -5.6 -17.3 2 539 A V H > + 0 0 132 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.920 360.0 41.9 -68.1 -45.9 0.8 -9.3 -16.3 3 540 A Q H > S+ 0 0 33 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.746 112.4 56.2 -72.7 -26.2 3.4 -8.6 -13.6 4 541 A V H > S+ 0 0 55 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.906 103.0 53.2 -71.8 -44.5 1.6 -5.5 -12.5 5 542 A R H X S+ 0 0 62 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.845 111.4 46.9 -59.3 -37.0 -1.7 -7.2 -11.9 6 543 A K H X S+ 0 0 48 -4,-1.1 4,-1.2 2,-0.2 -1,-0.2 0.822 114.3 47.6 -73.0 -33.9 0.2 -9.7 -9.6 7 544 A L H X S+ 0 0 16 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.918 109.9 50.8 -72.9 -46.6 2.0 -6.9 -7.8 8 545 A L H X S+ 0 0 103 -4,-3.4 4,-2.3 1,-0.2 5,-0.2 0.891 109.1 52.9 -56.8 -42.4 -1.1 -4.8 -7.3 9 546 A S H X S+ 0 0 82 -4,-1.5 4,-1.8 -5,-0.2 -1,-0.2 0.871 108.8 50.1 -60.3 -40.0 -2.8 -7.9 -5.8 10 547 A G H X S+ 0 0 7 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.843 110.5 48.9 -67.5 -36.9 0.1 -8.4 -3.4 11 548 A I H X S+ 0 0 75 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.893 110.0 50.6 -71.5 -42.2 0.0 -4.8 -2.2 12 549 A V H X S+ 0 0 97 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.911 111.8 48.5 -60.9 -43.9 -3.8 -4.8 -1.6 13 550 A Q H X S+ 0 0 95 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.886 109.6 52.2 -63.1 -41.2 -3.4 -8.0 0.4 14 551 A Q H X S+ 0 0 13 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.821 105.8 55.5 -64.8 -33.0 -0.5 -6.5 2.4 15 552 A Q H X S+ 0 0 138 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.855 107.6 48.1 -67.5 -36.8 -2.7 -3.4 3.2 16 553 A S H X S+ 0 0 47 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.847 109.5 54.9 -69.4 -35.8 -5.4 -5.7 4.7 17 554 A N H X S+ 0 0 8 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.906 109.5 44.8 -62.8 -45.7 -2.7 -7.5 6.7 18 555 A L H X S+ 0 0 91 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.853 111.1 54.9 -67.9 -36.6 -1.5 -4.2 8.3 19 556 A L H X S+ 0 0 93 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.937 108.3 47.6 -60.6 -49.7 -5.1 -3.1 8.9 20 557 A R H X S+ 0 0 153 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.873 110.1 53.5 -59.4 -40.3 -5.8 -6.3 10.9 21 558 A A H X S+ 0 0 14 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.910 111.3 45.3 -59.8 -44.5 -2.6 -5.9 12.8 22 559 A I H X S+ 0 0 112 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.879 112.4 51.5 -67.6 -39.7 -3.7 -2.3 13.8 23 560 A E H X S+ 0 0 110 -4,-2.7 4,-0.9 1,-0.2 -2,-0.2 0.891 114.2 43.9 -61.4 -41.7 -7.2 -3.5 14.7 24 561 A A H X S+ 0 0 8 -4,-2.5 4,-1.1 1,-0.2 3,-0.2 0.842 110.1 54.3 -74.7 -36.4 -5.7 -6.3 16.9 25 562 A Q H X S+ 0 0 99 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.790 101.4 60.8 -67.5 -29.2 -3.1 -4.0 18.5 26 563 A Q H X S+ 0 0 114 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.865 101.1 53.0 -64.4 -37.6 -6.0 -1.6 19.5 27 564 A H H X S+ 0 0 93 -4,-0.9 4,-1.4 2,-0.2 -1,-0.2 0.811 107.4 51.7 -67.6 -32.1 -7.5 -4.4 21.5 28 565 A L H X S+ 0 0 39 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.884 108.3 51.6 -66.8 -41.0 -4.2 -4.8 23.3 29 566 A L H X S+ 0 0 95 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.879 108.2 51.0 -62.6 -41.0 -4.2 -1.1 24.1 30 567 A K H X S+ 0 0 54 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.854 110.4 50.5 -63.3 -36.2 -7.7 -1.3 25.5 31 568 A L H X S+ 0 0 20 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.794 109.1 49.9 -73.8 -31.0 -6.5 -4.2 27.7 32 569 A T H X S+ 0 0 66 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.879 110.9 49.5 -73.1 -39.7 -3.5 -2.2 29.0 33 570 A V H X S+ 0 0 72 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.904 108.4 54.9 -61.4 -42.4 -5.7 0.8 29.8 34 571 A W H X S+ 0 0 105 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.884 107.9 48.7 -57.3 -43.1 -8.0 -1.7 31.6 35 572 A G H X S+ 0 0 7 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.867 111.2 49.1 -65.9 -39.7 -5.1 -2.9 33.8 36 573 A I H X S+ 0 0 117 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.904 111.4 48.7 -67.3 -43.3 -4.0 0.6 34.7 37 574 A K H X S+ 0 0 151 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.777 108.9 55.4 -66.2 -28.1 -7.5 1.7 35.7 38 575 A Q H X S+ 0 0 93 -4,-1.4 4,-0.5 -5,-0.2 -1,-0.2 0.867 111.5 42.1 -71.3 -39.2 -7.7 -1.5 37.8 39 576 A L H X S+ 0 0 117 -4,-1.6 4,-1.5 1,-0.2 3,-0.3 0.741 107.2 62.7 -78.1 -25.9 -4.6 -0.6 39.7 40 577 A Q H < S+ 0 0 68 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.775 96.5 59.1 -68.6 -28.7 -5.7 3.1 39.9 41 578 A A H < S+ 0 0 90 -4,-0.9 -1,-0.2 -3,-0.1 -2,-0.2 0.794 109.8 43.7 -69.8 -30.6 -8.8 1.9 42.0 42 579 A R H < 0 0 82 -4,-0.5 -2,-0.2 -3,-0.3 -3,-0.1 0.978 360.0 360.0 -76.6 -75.8 -6.5 0.4 44.6 43 580 A V < 0 0 167 -4,-1.5 -1,-0.0 0, 0.0 0, 0.0 -0.156 360.0 360.0-128.7 360.0 -3.7 3.0 45.2 44 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 45 628 A W > 0 0 148 0, 0.0 4,-0.8 0, 0.0 -10,-0.0 0.000 360.0 360.0 360.0 -30.9 -7.8 -10.6 36.4 46 629 A L H > + 0 0 81 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.842 360.0 54.3 -72.9 -36.1 -6.8 -14.2 35.3 47 630 A Q H > S+ 0 0 61 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.740 99.0 64.7 -68.5 -25.1 -8.8 -13.8 32.1 48 631 A W H > S+ 0 0 52 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.890 99.8 50.8 -62.9 -42.3 -6.8 -10.7 31.4 49 632 A D H X S+ 0 0 92 -4,-0.8 4,-1.6 -3,-0.3 -1,-0.2 0.846 112.7 46.2 -64.4 -37.1 -3.6 -12.8 31.1 50 633 A K H X S+ 0 0 50 -4,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.900 112.4 49.7 -71.3 -43.5 -5.4 -15.1 28.6 51 634 A E H X S+ 0 0 81 -4,-2.5 4,-2.0 2,-0.2 5,-0.2 0.867 109.9 50.9 -64.4 -39.6 -6.8 -12.3 26.6 52 635 A I H X S+ 0 0 38 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.919 113.3 46.3 -61.0 -45.0 -3.4 -10.6 26.3 53 636 A S H X S+ 0 0 51 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.879 109.1 56.7 -64.0 -40.2 -1.9 -13.9 25.2 54 637 A N H X S+ 0 0 99 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.919 110.1 41.3 -58.4 -50.3 -4.8 -14.4 22.7 55 638 A Y H X S+ 0 0 65 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.836 108.9 59.9 -70.3 -34.5 -4.3 -11.1 20.8 56 639 A T H X S+ 0 0 37 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.884 103.3 52.7 -60.4 -40.3 -0.5 -11.4 20.8 57 640 A H H X S+ 0 0 38 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.885 110.6 47.3 -59.3 -42.2 -0.9 -14.7 18.9 58 641 A I H X S+ 0 0 94 -4,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.898 113.1 48.6 -67.7 -42.2 -3.1 -13.0 16.3 59 642 A I H X S+ 0 0 7 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.939 112.9 44.7 -65.4 -50.2 -0.7 -10.0 15.9 60 643 A Y H X S+ 0 0 63 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.774 111.2 54.1 -70.1 -26.3 2.5 -12.1 15.5 61 644 A E H X S+ 0 0 39 -4,-1.4 4,-1.8 -5,-0.2 -1,-0.2 0.854 112.4 45.4 -68.9 -36.4 0.8 -14.4 13.0 62 645 A L H X S+ 0 0 20 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.840 111.9 50.6 -73.9 -37.2 -0.1 -11.3 11.0 63 646 A I H X S+ 0 0 51 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.936 110.2 50.4 -64.8 -47.3 3.4 -9.9 11.3 64 647 A E H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.925 114.1 44.4 -53.3 -49.8 4.9 -13.2 10.1 65 648 A E H X S+ 0 0 65 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.873 112.8 51.9 -64.0 -39.5 2.5 -13.2 7.1 66 649 A S H X S+ 0 0 10 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.838 108.1 51.6 -66.4 -35.8 3.1 -9.5 6.5 67 650 A Q H X S+ 0 0 16 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.896 112.3 46.1 -65.8 -42.2 6.9 -10.1 6.5 68 651 A K H X S+ 0 0 40 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.903 114.8 46.8 -65.3 -44.0 6.4 -12.9 3.9 69 652 A Q H X S+ 0 0 19 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.850 108.5 55.8 -67.6 -36.2 4.1 -10.8 1.8 70 653 A Q H X S+ 0 0 62 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.865 108.3 48.1 -64.0 -37.8 6.5 -7.8 2.0 71 654 A E H X S+ 0 0 2 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.820 108.6 53.9 -72.9 -33.3 9.3 -9.9 0.6 72 655 A K H X S+ 0 0 93 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.881 110.4 47.3 -65.0 -40.9 7.0 -11.3 -2.3 73 656 A N H X S+ 0 0 12 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.869 110.6 51.0 -68.7 -39.6 6.2 -7.7 -3.3 74 657 A E H X S+ 0 0 57 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.803 110.9 48.6 -69.3 -32.1 9.9 -6.5 -3.2 75 658 A Q H X S+ 0 0 31 -4,-1.5 4,-1.3 249,-0.2 -1,-0.2 0.858 112.0 48.1 -75.0 -38.5 11.0 -9.5 -5.4 76 659 A E H X S+ 0 0 54 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.840 108.4 54.8 -70.5 -35.5 8.2 -8.9 -8.0 77 660 A L H X S+ 0 0 97 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.857 108.4 48.7 -65.0 -38.2 9.0 -5.1 -8.1 78 661 A L H X S+ 0 0 109 -4,-1.2 4,-1.2 2,-0.2 -1,-0.2 0.815 112.8 48.7 -68.5 -32.6 12.6 -6.0 -8.9 79 662 A E H X S+ 0 0 105 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.865 110.7 49.9 -73.4 -39.0 11.3 -8.4 -11.6 80 663 A L H X S+ 0 0 46 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.863 111.5 48.6 -66.3 -38.2 9.0 -5.7 -13.0 81 664 A D H X S+ 0 0 91 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.807 109.5 54.4 -70.1 -32.1 11.9 -3.2 -13.1 82 665 A K H < S+ 0 0 69 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.888 110.5 43.9 -68.3 -42.3 14.0 -5.9 -14.9 83 666 A W H < S+ 0 0 208 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.692 111.4 56.0 -77.2 -20.4 11.5 -6.5 -17.7 84 667 A A H < 0 0 79 -4,-1.1 -2,-0.2 -5,-0.1 -1,-0.2 0.900 360.0 360.0 -76.7 -44.5 10.9 -2.7 -18.1 85 668 A N < 0 0 168 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.1 0.770 360.0 360.0 -82.6 360.0 14.5 -1.8 -18.8 86 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 87 3 L V 0 0 113 0, 0.0 2,-0.3 0, 0.0 100,-0.1 0.000 360.0 360.0 360.0 -35.5 23.0 -25.9 28.7 88 4 L L B -a 187 0A 5 98,-0.9 100,-0.9 85,-0.1 2,-0.5 -0.582 360.0-131.0 -75.2 129.5 19.2 -26.7 28.3 89 5 L T B +B 107 0B 90 18,-2.9 18,-2.0 -2,-0.3 98,-0.1 -0.706 29.7 174.6 -90.8 124.8 18.3 -30.1 29.6 90 6 L Q - 0 0 17 -2,-0.5 16,-0.1 16,-0.2 14,-0.0 -0.979 34.4-110.8-127.7 141.1 16.2 -32.4 27.4 91 7 L P - 0 0 34 0, 0.0 100,-0.1 0, 0.0 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