==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE RECEPTOR 20-DEC-02 1NHZ . COMPND 2 MOLECULE: GLUCOCORTICOID RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.KAUPPI,C.JAKOB,M.FARNEGARDH,J.YANG,H.AHOLA,M.ALARCON,K.CAL . 239 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13915.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 74.5 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 . 9 3.8 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 9 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 130 54.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 1 1 1 0 0 1 0 0 0 0 1 0 0 0 0 1 1 1 0 0 0 1 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 . 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 530 A P 0 0 154 0, 0.0 2,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 132.2 1.2 42.1 -12.8 2 531 A T > - 0 0 85 1,-0.1 4,-1.4 4,-0.0 5,-0.1 -0.342 360.0-116.4 -65.3 161.4 3.8 41.0 -10.2 3 532 A L H > S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.804 112.3 50.9 -73.4 -32.9 4.7 37.4 -10.0 4 533 A V H > S+ 0 0 8 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.810 105.1 57.1 -77.0 -29.5 3.4 36.9 -6.4 5 534 A S H > S+ 0 0 39 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.903 106.9 49.5 -65.8 -36.4 0.1 38.4 -7.4 6 535 A L H X S+ 0 0 67 -4,-1.4 4,-1.7 1,-0.2 -2,-0.2 0.910 108.9 52.6 -69.0 -36.3 -0.2 35.7 -10.1 7 536 A L H X S+ 0 0 2 -4,-1.7 4,-0.7 1,-0.2 -2,-0.2 0.904 107.6 52.9 -61.2 -40.6 0.7 33.1 -7.4 8 537 A E H >< S+ 0 0 104 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.922 107.6 50.9 -60.4 -43.2 -2.1 34.4 -5.3 9 538 A V H 3< S+ 0 0 108 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.874 112.7 43.7 -68.8 -36.1 -4.7 34.1 -8.1 10 539 A I H 3< S+ 0 0 46 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.490 81.4 124.8 -87.7 -1.9 -3.8 30.5 -9.0 11 540 A E << - 0 0 41 -3,-0.8 -3,-0.0 -4,-0.7 124,-0.0 -0.356 69.8-108.7 -58.9 126.4 -3.7 29.3 -5.3 12 541 A P - 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.273 27.0-112.8 -59.7 142.2 -6.2 26.4 -4.9 13 542 A E - 0 0 175 1,-0.1 2,-0.5 -3,-0.1 31,-0.0 -0.371 40.7 -98.0 -60.9 154.1 -9.4 26.7 -3.1 14 543 A V - 0 0 76 -2,-0.0 2,-0.2 1,-0.0 -1,-0.1 -0.670 41.7-142.8 -79.3 126.0 -9.7 24.7 0.2 15 544 A L - 0 0 50 -2,-0.5 2,-0.2 79,-0.2 26,-0.0 -0.634 7.6-123.6 -91.4 148.9 -11.6 21.5 -0.4 16 545 A Y - 0 0 143 -2,-0.2 -1,-0.0 79,-0.2 79,-0.0 -0.516 9.2-144.7 -80.0 156.6 -14.0 19.8 2.0 17 546 A A - 0 0 12 -2,-0.2 20,-0.1 2,-0.1 -1,-0.1 0.729 27.4-129.6 -92.0 -28.9 -13.3 16.2 3.1 18 547 A G + 0 0 67 1,-0.3 2,-0.4 19,-0.0 80,-0.0 0.750 51.3 155.6 76.1 27.8 -16.9 15.0 3.3 19 548 A Y - 0 0 18 78,-0.0 2,-0.5 2,-0.0 -1,-0.3 -0.657 33.7-145.5 -78.5 134.3 -16.5 13.6 6.8 20 549 A D > - 0 0 96 -2,-0.4 3,-0.7 1,-0.1 78,-0.0 -0.931 9.5-161.1-108.0 130.3 -19.6 13.3 8.8 21 550 A S T 3 S+ 0 0 90 -2,-0.5 4,-0.1 1,-0.2 -1,-0.1 0.340 73.8 91.7 -80.2 1.0 -19.3 13.9 12.6 22 551 A S T 3 S+ 0 0 90 2,-0.1 -1,-0.2 0, 0.0 3,-0.0 0.607 81.5 62.4 -76.5 -16.4 -22.6 12.1 13.3 23 552 A V S < S- 0 0 65 -3,-0.7 3,-0.1 1,-0.1 2,-0.1 -0.817 103.4 -97.4 -99.0 147.9 -20.8 8.8 13.8 24 553 A P - 0 0 107 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.381 52.3 -96.0 -56.6 141.8 -18.2 8.3 16.5 25 554 A D + 0 0 44 -4,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.277 45.1 179.1 -57.0 144.5 -14.7 8.9 15.2 26 555 A S > - 0 0 39 1,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.979 38.8-124.7-140.9 154.7 -12.6 5.9 14.2 27 556 A T H > S+ 0 0 28 -2,-0.3 4,-2.5 1,-0.2 5,-0.3 0.925 114.3 53.3 -58.5 -41.3 -9.1 5.7 12.8 28 557 A W H > S+ 0 0 185 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.913 109.0 47.3 -59.1 -48.4 -10.5 3.7 9.9 29 558 A R H > S+ 0 0 45 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.922 114.8 45.9 -62.3 -47.1 -13.1 6.4 9.0 30 559 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.922 115.1 45.0 -62.8 -45.3 -10.6 9.2 9.2 31 560 A M H X S+ 0 0 62 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.851 113.1 51.4 -69.9 -34.2 -7.8 7.5 7.2 32 561 A T H X S+ 0 0 55 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.940 112.2 45.8 -65.6 -48.1 -10.3 6.4 4.6 33 562 A T H X S+ 0 0 25 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.899 111.0 53.4 -60.2 -42.6 -11.7 9.9 4.2 34 563 A L H X S+ 0 0 31 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.785 102.9 59.0 -67.7 -26.4 -8.1 11.3 4.1 35 564 A N H X S+ 0 0 90 -4,-1.4 4,-1.8 -3,-0.2 -1,-0.2 0.948 110.0 42.0 -63.6 -47.3 -7.4 8.8 1.2 36 565 A M H X S+ 0 0 133 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.949 116.2 47.5 -66.7 -47.7 -10.1 10.3 -0.9 37 566 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.900 110.0 54.7 -60.5 -41.1 -9.3 13.9 0.1 38 567 A G H X S+ 0 0 20 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.891 106.3 50.2 -62.0 -41.1 -5.5 13.3 -0.6 39 568 A G H X S+ 0 0 42 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.941 111.5 49.6 -58.0 -46.9 -6.2 12.0 -4.1 40 569 A R H X S+ 0 0 109 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.875 109.1 51.3 -62.0 -36.7 -8.3 15.1 -4.7 41 570 A Q H X S+ 0 0 30 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.866 106.5 54.5 -70.7 -37.9 -5.6 17.4 -3.4 42 571 A V H X S+ 0 0 38 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.926 107.2 50.8 -55.6 -48.8 -3.0 15.8 -5.7 43 572 A I H X S+ 0 0 121 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.897 112.1 47.1 -57.7 -41.2 -5.2 16.6 -8.7 44 573 A A H X S+ 0 0 28 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.815 108.5 55.2 -71.3 -31.6 -5.5 20.2 -7.5 45 574 A A H X S+ 0 0 11 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.872 108.5 48.5 -63.3 -39.7 -1.6 20.4 -7.0 46 575 A V H X S+ 0 0 38 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.951 111.4 49.2 -66.7 -46.7 -1.1 19.3 -10.6 47 576 A K H < S+ 0 0 157 -4,-1.9 4,-0.5 -5,-0.2 -2,-0.2 0.884 113.5 47.1 -60.7 -39.2 -3.5 21.9 -11.8 48 577 A W H >< S+ 0 0 9 -4,-1.9 3,-1.7 2,-0.2 4,-0.3 0.970 111.6 49.8 -63.3 -55.5 -1.8 24.6 -9.7 49 578 A A H >< S+ 0 0 0 -4,-2.8 3,-2.4 1,-0.3 -2,-0.2 0.893 103.1 61.1 -52.9 -43.2 1.7 23.6 -10.9 50 579 A K T 3< S+ 0 0 97 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.670 105.9 48.0 -61.5 -19.2 0.7 23.7 -14.6 51 580 A A T < S+ 0 0 33 -3,-1.7 -1,-0.3 -4,-0.5 -2,-0.2 0.358 81.5 116.0-101.6 5.8 -0.2 27.3 -14.2 52 581 A I S <> S- 0 0 1 -3,-2.4 4,-2.3 -4,-0.3 -3,-0.0 -0.604 73.9-117.7 -74.0 121.0 3.1 28.3 -12.4 53 582 A P T 4 S+ 0 0 39 0, 0.0 2,-1.8 0, 0.0 -2,-0.1 -0.224 95.2 12.4 -57.4 149.1 4.9 30.7 -14.8 54 583 A G T >4 S+ 0 0 22 1,-0.2 3,-2.5 -3,-0.0 4,-0.3 -0.523 121.6 65.1 79.7 -77.7 8.3 29.4 -16.0 55 584 A F G >4 S+ 0 0 0 -2,-1.8 3,-2.3 1,-0.3 -1,-0.2 0.875 92.6 63.8 -32.8 -50.8 7.6 25.8 -14.7 56 585 A R G 3< S+ 0 0 141 -4,-2.3 -1,-0.3 1,-0.3 -6,-0.1 0.581 96.2 58.4 -64.4 -8.4 4.7 25.5 -17.2 57 586 A N G < S+ 0 0 116 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.405 82.5 102.2-101.6 -3.6 7.2 25.8 -20.1 58 587 A L S < S- 0 0 5 -3,-2.3 -4,-0.0 -4,-0.3 5,-0.0 -0.507 90.8 -91.1 -65.9 147.4 9.2 22.8 -19.1 59 588 A H > - 0 0 108 -2,-0.2 4,-2.2 1,-0.1 3,-0.5 -0.320 40.5-110.2 -49.4 145.3 8.6 19.7 -21.1 60 589 A L H > S+ 0 0 81 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.802 118.5 61.0 -51.7 -34.8 5.8 17.6 -19.4 61 590 A D H > S+ 0 0 74 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.937 108.1 43.8 -59.4 -46.6 8.4 14.9 -18.4 62 591 A D H > S+ 0 0 3 -3,-0.5 4,-2.6 2,-0.2 5,-0.2 0.949 114.2 49.5 -62.6 -46.9 10.2 17.5 -16.4 63 592 A Q H X S+ 0 0 9 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.920 114.1 45.5 -57.1 -42.2 6.9 18.9 -14.9 64 593 A M H X S+ 0 0 74 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.841 111.2 52.4 -73.4 -33.7 5.7 15.4 -14.0 65 594 A T H X S+ 0 0 31 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.968 111.3 47.4 -63.5 -50.2 9.1 14.5 -12.5 66 595 A L H X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.923 113.9 46.7 -55.9 -49.8 9.1 17.6 -10.3 67 596 A L H >X S+ 0 0 10 -4,-2.4 4,-2.4 -5,-0.2 3,-0.6 0.896 108.5 56.2 -58.5 -43.2 5.5 16.9 -9.2 68 597 A Q H 3< S+ 0 0 129 -4,-2.2 4,-0.3 1,-0.2 -2,-0.2 0.922 113.3 41.4 -54.1 -45.8 6.3 13.3 -8.5 69 598 A Y H 3< S+ 0 0 57 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.640 125.2 33.0 -78.4 -12.8 9.1 14.4 -6.1 70 599 A S H S+ 0 0 45 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.937 111.8 51.0 -70.6 -43.0 3.7 15.3 -0.5 73 602 A S H > S+ 0 0 6 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.913 111.2 48.4 -56.3 -44.8 5.8 18.3 0.4 74 603 A L H X S+ 0 0 8 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.899 113.3 46.0 -66.7 -42.4 3.3 20.8 -1.2 75 604 A M H X S+ 0 0 24 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.873 113.4 48.1 -69.0 -38.1 0.3 19.2 0.5 76 605 A A H X S+ 0 0 5 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.862 112.6 51.2 -69.3 -34.4 2.0 19.1 4.0 77 606 A F H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.916 112.3 43.9 -69.5 -44.3 3.1 22.7 3.5 78 607 A A H X S+ 0 0 15 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.881 112.4 53.3 -70.0 -37.2 -0.4 24.0 2.6 79 608 A L H X S+ 0 0 7 -4,-2.2 4,-2.3 2,-0.2 14,-0.4 0.926 108.5 51.0 -56.2 -45.1 -1.8 21.8 5.4 80 609 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.920 111.0 48.4 -58.0 -43.2 0.8 23.6 7.7 81 610 A W H X S+ 0 0 24 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.918 110.7 48.8 -65.9 -47.0 -0.4 27.0 6.5 82 611 A R H X S+ 0 0 42 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.886 112.6 48.9 -57.7 -42.5 -4.1 26.2 6.9 83 612 A S H X S+ 0 0 0 -4,-2.3 6,-2.1 2,-0.2 4,-1.6 0.903 113.1 47.3 -69.4 -42.8 -3.4 24.9 10.5 84 613 A Y H X S+ 0 0 10 -4,-2.5 4,-1.0 4,-0.3 -2,-0.2 0.929 119.7 39.4 -57.2 -47.0 -1.4 28.0 11.3 85 614 A R H < S+ 0 0 132 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.899 120.7 38.9 -79.9 -44.4 -4.1 30.4 9.9 86 615 A Q H < S+ 0 0 152 -4,-3.0 -1,-0.2 -5,-0.2 -3,-0.2 0.801 136.2 14.8 -76.5 -30.2 -7.3 28.7 11.0 87 616 A S H >< S- 0 0 20 -4,-1.6 3,-2.3 -5,-0.3 -2,-0.2 0.116 100.8-107.2-135.4 19.4 -6.2 27.6 14.5 88 617 A S T 3< S- 0 0 71 -4,-1.0 -4,-0.3 1,-0.3 -3,-0.2 0.826 80.4 -60.8 47.8 37.1 -3.0 29.5 15.3 89 618 A A T 3 S+ 0 0 20 -6,-2.1 -1,-0.3 2,-0.2 -5,-0.2 0.578 114.1 117.5 69.9 14.3 -1.2 26.2 14.8 90 619 A N S < S+ 0 0 127 -3,-2.3 2,-0.3 -7,-0.4 -2,-0.1 0.806 75.5 25.6 -74.0 -32.5 -3.2 24.6 17.7 91 620 A L S S- 0 0 48 -8,-0.4 2,-0.8 -4,-0.1 -2,-0.2 -0.945 81.3-107.4-140.7 150.5 -4.9 21.9 15.5 92 621 A L E -A 100 0A 1 8,-1.0 8,-2.6 -2,-0.3 2,-1.0 -0.725 31.5-163.9 -86.5 114.8 -4.4 20.0 12.2 93 622 A C E +A 99 0A 7 -2,-0.8 6,-0.2 -14,-0.4 -11,-0.1 -0.670 23.1 161.5-104.5 77.7 -6.8 21.4 9.7 94 623 A F E S- 0 0 16 -2,-1.0 -1,-0.2 4,-0.9 -79,-0.2 0.881 76.9 -14.8 -57.3 -41.5 -7.0 18.9 6.9 95 624 A A E > S-A 98 0A 2 3,-1.2 3,-2.4 -3,-0.2 -1,-0.2 -0.963 75.7 -97.0-159.3 158.0 -10.3 20.4 5.7 96 625 A P T 3 S+ 0 0 60 0, 0.0 3,-0.1 0, 0.0 -80,-0.1 0.802 128.8 39.8 -54.4 -28.9 -12.9 22.8 7.1 97 626 A D T 3 S+ 0 0 45 1,-0.2 2,-0.3 -4,-0.0 -81,-0.1 0.247 112.4 59.4-103.7 13.3 -14.9 19.7 8.1 98 627 A L E < +A 95 0A 0 -3,-2.4 -3,-1.2 -80,-0.0 -4,-0.9 -0.692 60.8 157.0-144.9 89.2 -11.9 17.5 9.2 99 628 A I E -A 93 0A 54 -2,-0.3 2,-1.2 -6,-0.2 -6,-0.2 -0.944 38.3-134.0-117.6 129.7 -9.9 19.0 12.1 100 629 A I E -A 92 0A 4 -8,-2.6 -8,-1.0 -2,-0.4 2,-0.1 -0.708 32.7-174.0 -89.5 98.8 -7.8 16.8 14.3 101 630 A N > - 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