==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE RECEPTOR 22-APR-10 3MNP . COMPND 2 MOLECULE: GLUCOCORTICOID RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR G.A.SCHOCH,T.SEITZ,J.BENZ,D.BANNER,M.STIHLE,B.D'ARCY,R.THOMA . 267 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13736.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 197 73.8 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 3.4 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 . 11 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 54.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 1 0 0 0 1 0 0 1 0 1 0 0 1 0 0 0 1 0 0 0 1 0 1 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 1 526 A M 0 0 239 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.5 -54.2 -19.5 15.3 2 527 A V - 0 0 132 3,-0.0 3,-0.1 0, 0.0 2,-0.0 -0.969 360.0 -98.3-140.0 156.0 -50.9 -19.2 13.4 3 528 A P - 0 0 118 0, 0.0 2,-0.1 0, 0.0 0, 0.0 -0.317 46.3 -97.1 -70.5 160.0 -47.4 -20.7 13.8 4 529 A A + 0 0 105 -2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.457 58.5 155.7 -69.0 145.5 -44.6 -18.8 15.5 5 530 A A - 0 0 92 -2,-0.1 3,-0.1 -3,-0.1 -3,-0.0 -0.944 45.5-109.8-168.0 151.0 -42.4 -17.0 12.9 6 531 A L - 0 0 164 -2,-0.3 3,-0.1 1,-0.1 0, 0.0 -0.649 52.9 -95.9 -81.9 145.2 -40.0 -14.1 12.5 7 532 A P - 0 0 100 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.241 45.6 -97.1 -62.7 151.0 -41.5 -11.3 10.3 8 533 A Q - 0 0 173 -3,-0.1 2,-0.1 1,-0.0 -3,-0.0 -0.599 35.2-148.8 -78.8 114.8 -40.5 -11.3 6.6 9 534 A L - 0 0 78 -2,-0.7 -1,-0.0 -3,-0.1 7,-0.0 -0.349 10.3-158.8 -70.2 155.4 -37.7 -9.0 5.8 10 535 A T - 0 0 71 2,-0.2 2,-2.3 -2,-0.1 6,-0.2 -0.930 34.0 -98.5-130.0 161.9 -37.6 -7.4 2.4 11 536 A P S S+ 0 0 142 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.331 87.8 103.0 -82.0 63.6 -34.6 -5.9 0.6 12 537 A T S > S- 0 0 49 -2,-2.3 4,-1.6 1,-0.1 -2,-0.2 -0.973 76.3-123.6-138.5 153.4 -35.4 -2.3 1.5 13 538 A L H > S+ 0 0 43 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.909 110.2 53.9 -66.2 -40.0 -33.8 -0.0 4.2 14 539 A V H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.878 103.9 55.7 -65.2 -33.1 -37.1 0.7 5.9 15 540 A S H > S+ 0 0 11 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.935 111.1 44.8 -63.4 -42.9 -37.8 -3.0 6.3 16 541 A L H X S+ 0 0 49 -4,-1.6 4,-2.3 1,-0.2 5,-0.2 0.932 109.6 55.5 -65.9 -45.1 -34.4 -3.4 8.1 17 542 A L H X S+ 0 0 1 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.879 105.7 52.8 -54.3 -42.8 -35.1 -0.3 10.2 18 543 A E H < S+ 0 0 78 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.913 111.4 45.2 -60.4 -41.6 -38.3 -1.8 11.4 19 544 A V H < S+ 0 0 71 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.851 115.7 45.0 -73.8 -29.5 -36.6 -5.0 12.5 20 545 A I H < S+ 0 0 35 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.529 80.4 118.2 -90.1 -8.6 -33.6 -3.3 14.3 21 546 A E S < S- 0 0 41 -4,-1.0 34,-0.1 -3,-0.4 124,-0.0 -0.465 72.0-117.5 -60.1 123.0 -35.8 -0.6 16.1 22 547 A P - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.236 29.7-104.1 -64.3 145.9 -35.2 -1.3 19.8 23 548 A E - 0 0 177 1,-0.1 2,-0.2 -3,-0.1 31,-0.0 -0.353 45.0 -91.0 -66.1 151.3 -38.2 -2.3 21.9 24 549 A V - 0 0 84 1,-0.1 2,-0.2 -2,-0.0 -1,-0.1 -0.462 47.0-133.9 -67.0 129.4 -39.7 0.4 24.1 25 550 A L - 0 0 51 -2,-0.2 2,-0.3 79,-0.2 -1,-0.1 -0.599 5.1-134.4 -88.5 145.7 -38.1 0.2 27.6 26 551 A Y - 0 0 139 -2,-0.2 79,-0.0 79,-0.2 -1,-0.0 -0.693 11.2-139.0 -91.1 149.8 -40.0 0.3 30.9 27 552 A A - 0 0 23 -2,-0.3 3,-0.1 2,-0.0 -1,-0.1 0.786 25.9-129.4 -78.2 -29.2 -38.5 2.5 33.5 28 553 A G - 0 0 68 1,-0.2 2,-0.4 -3,-0.0 80,-0.0 0.889 41.4-161.7 75.9 40.4 -39.1 0.1 36.4 29 554 A Y - 0 0 56 1,-0.1 2,-1.2 2,-0.1 -1,-0.2 -0.465 23.6-151.4 -69.2 120.5 -40.6 3.1 38.0 30 555 A D > - 0 0 97 -2,-0.4 3,-1.2 1,-0.2 -1,-0.1 -0.728 15.3-175.1 -86.6 91.4 -41.1 3.1 41.8 31 556 A S T 3 + 0 0 94 -2,-1.2 -1,-0.2 1,-0.2 -2,-0.1 0.387 64.5 88.5 -73.7 6.4 -44.2 5.4 41.9 32 557 A S T 3 + 0 0 98 2,-0.0 -1,-0.2 0, 0.0 -2,-0.0 0.663 66.3 101.7 -77.4 -15.5 -44.2 5.5 45.7 33 558 A V S < S- 0 0 39 -3,-1.2 2,-0.1 1,-0.1 3,-0.0 -0.251 82.2-105.2 -65.6 154.7 -41.8 8.5 45.7 34 559 A P - 0 0 79 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.435 43.9 -93.0 -76.8 160.6 -43.1 11.9 46.4 35 560 A D + 0 0 81 -2,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.602 61.9 148.6 -75.1 124.4 -43.4 14.3 43.4 36 561 A S > - 0 0 29 -2,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.938 49.4-133.5-158.3 135.2 -40.3 16.4 43.0 37 562 A A H > S+ 0 0 7 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.889 107.9 49.5 -58.1 -40.9 -38.5 17.9 40.0 38 563 A W H > S+ 0 0 122 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.913 112.2 47.0 -67.2 -39.6 -35.1 16.8 41.2 39 564 A R H > S+ 0 0 128 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.922 113.2 49.6 -67.0 -42.3 -36.2 13.3 41.8 40 565 A I H X S+ 0 0 10 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.952 108.8 52.7 -60.5 -48.4 -38.0 13.2 38.4 41 566 A M H X S+ 0 0 14 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.926 109.9 47.5 -55.5 -46.5 -34.9 14.5 36.6 42 567 A T H X S+ 0 0 24 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.938 111.8 51.0 -59.2 -46.3 -32.6 11.8 38.1 43 568 A T H X S+ 0 0 42 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.910 110.0 49.8 -57.1 -43.9 -35.2 9.1 37.2 44 569 A L H X S+ 0 0 20 -4,-2.9 4,-3.0 1,-0.2 -1,-0.2 0.914 109.3 51.7 -64.1 -41.1 -35.3 10.4 33.6 45 570 A N H X S+ 0 0 29 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.892 107.7 51.1 -63.4 -39.2 -31.5 10.4 33.4 46 571 A M H X S+ 0 0 64 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.919 113.8 45.1 -65.4 -39.6 -31.3 6.7 34.6 47 572 A L H X S+ 0 0 5 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.933 110.5 56.4 -65.0 -44.2 -33.9 5.7 32.0 48 573 A G H X S+ 0 0 11 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.882 101.9 54.2 -55.8 -40.0 -32.0 7.8 29.4 49 574 A G H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.918 109.5 48.0 -64.9 -38.8 -28.8 6.0 30.0 50 575 A R H X S+ 0 0 109 -4,-1.3 4,-1.9 1,-0.2 -1,-0.2 0.894 112.4 49.3 -66.2 -40.2 -30.5 2.7 29.2 51 576 A Q H X S+ 0 0 28 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.886 108.8 52.7 -68.0 -35.8 -32.1 4.1 26.1 52 577 A V H X S+ 0 0 3 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.924 106.5 52.4 -67.2 -39.4 -28.8 5.5 24.9 53 578 A I H X S+ 0 0 56 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.933 110.8 48.3 -60.6 -42.9 -27.1 2.1 25.3 54 579 A A H X S+ 0 0 25 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.892 109.7 53.1 -64.0 -35.7 -30.0 0.6 23.2 55 580 A A H X S+ 0 0 11 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.817 105.0 53.9 -68.9 -30.6 -29.5 3.4 20.6 56 581 A V H X S+ 0 0 1 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.939 109.3 48.2 -70.3 -39.5 -25.8 2.6 20.3 57 582 A K H X S+ 0 0 128 -4,-2.0 4,-0.7 1,-0.2 -2,-0.2 0.853 112.3 50.5 -67.1 -34.6 -26.6 -1.0 19.5 58 583 A W H >< S+ 0 0 9 -4,-1.8 3,-1.2 1,-0.2 4,-0.5 0.941 107.6 51.8 -67.8 -48.2 -29.2 0.2 17.0 59 584 A A H >< S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.3 -2,-0.2 0.871 102.2 60.5 -57.8 -38.6 -26.7 2.5 15.3 60 585 A K H 3< S+ 0 0 48 -4,-1.9 6,-0.4 1,-0.3 -1,-0.3 0.790 104.6 50.7 -61.9 -27.0 -24.2 -0.3 14.9 61 586 A A T << S+ 0 0 46 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.469 81.8 108.3 -87.0 -7.1 -26.8 -2.2 12.8 62 587 A I S X> S- 0 0 4 -3,-1.5 3,-2.0 -4,-0.5 4,-0.6 -0.627 87.0-100.2 -74.9 123.9 -27.5 0.7 10.4 63 588 A P T 34 S+ 0 0 52 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.171 103.5 6.1 -50.0 123.4 -26.0 -0.2 7.0 64 589 A G T >> S+ 0 0 16 -4,-0.1 3,-1.4 -3,-0.0 4,-0.6 0.003 99.4 104.2 93.5 -26.8 -22.7 1.6 6.5 65 590 A F G X4 S+ 0 0 3 -3,-2.0 3,-1.6 1,-0.3 -5,-0.1 0.920 82.0 48.2 -51.8 -50.8 -22.5 3.1 10.0 66 591 A R G 3< S+ 0 0 127 -4,-0.6 -1,-0.3 -6,-0.4 7,-0.1 0.638 103.2 65.1 -68.3 -10.2 -19.9 0.6 11.2 67 592 A N G <4 S+ 0 0 116 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.574 83.1 92.8 -87.3 -11.5 -17.9 1.3 8.0 68 593 A L S << S- 0 0 5 -3,-1.6 5,-0.1 -4,-0.6 96,-0.0 -0.472 99.5 -80.1 -73.9 156.4 -17.3 4.9 9.1 69 594 A H >> - 0 0 83 1,-0.1 4,-2.0 -2,-0.1 3,-0.9 -0.242 42.1-116.8 -54.8 144.9 -14.1 5.6 11.1 70 595 A L H 3> S+ 0 0 52 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.853 116.9 55.1 -55.9 -35.0 -14.5 4.6 14.7 71 596 A D H 3> S+ 0 0 60 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.833 106.3 51.1 -65.7 -36.0 -13.9 8.3 15.7 72 597 A D H <> S+ 0 0 4 -3,-0.9 4,-2.8 2,-0.2 5,-0.2 0.884 108.5 52.4 -66.6 -41.8 -16.8 9.3 13.4 73 598 A Q H X S+ 0 0 11 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.935 112.2 44.5 -60.4 -48.5 -19.0 6.7 15.0 74 599 A M H X S+ 0 0 8 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.919 115.0 48.2 -62.2 -45.6 -18.3 8.0 18.5 75 600 A T H X S+ 0 0 24 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.907 109.4 51.9 -61.4 -45.4 -18.7 11.6 17.5 76 601 A L H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.913 112.9 45.7 -61.4 -40.5 -22.0 11.1 15.6 77 602 A L H X S+ 0 0 5 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.890 113.4 49.5 -70.8 -38.0 -23.4 9.3 18.7 78 603 A Q H < S+ 0 0 9 -4,-2.4 4,-0.3 1,-0.2 -2,-0.2 0.884 117.0 41.3 -67.1 -35.1 -22.1 12.0 21.1 79 604 A Y H < S+ 0 0 2 -4,-2.7 4,-0.2 -5,-0.2 -2,-0.2 0.838 123.7 36.3 -80.1 -32.9 -23.6 14.8 18.9 80 605 A S H >X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 3,-0.5 0.549 83.3 96.7 -99.5 -13.0 -26.9 13.1 18.1 81 606 A W H 3X S+ 0 0 14 -4,-1.8 4,-2.9 1,-0.3 5,-0.2 0.892 87.5 49.2 -51.3 -41.9 -27.9 11.2 21.3 82 607 A M H 3> S+ 0 0 20 -4,-0.3 4,-2.6 1,-0.2 5,-0.3 0.885 110.5 51.6 -65.2 -36.7 -30.2 14.0 22.5 83 608 A F H <> S+ 0 0 9 -3,-0.5 4,-2.4 -4,-0.2 -1,-0.2 0.935 111.8 46.7 -62.1 -48.5 -31.9 14.2 19.1 84 609 A L H X S+ 0 0 6 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.928 115.1 46.3 -61.8 -43.7 -32.5 10.4 19.1 85 610 A M H X S+ 0 0 25 -4,-2.9 4,-2.2 -5,-0.2 -2,-0.2 0.915 115.2 44.4 -67.2 -42.4 -33.9 10.4 22.6 86 611 A V H X S+ 0 0 6 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.876 112.5 51.6 -70.7 -36.4 -36.2 13.4 22.2 87 612 A F H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.926 112.4 45.5 -68.0 -40.1 -37.5 12.3 18.8 88 613 A A H X S+ 0 0 14 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.900 111.8 51.9 -69.5 -38.3 -38.4 8.8 20.2 89 614 A L H X S+ 0 0 6 -4,-2.2 4,-2.5 1,-0.2 14,-0.4 0.917 109.9 51.3 -60.6 -39.0 -40.0 10.4 23.3 90 615 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.909 109.0 49.9 -62.1 -45.6 -41.9 12.5 20.8 91 616 A W H X S+ 0 0 35 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.947 112.7 45.5 -60.6 -50.4 -43.1 9.4 18.9 92 617 A R H X S+ 0 0 32 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.912 114.2 49.4 -58.8 -43.9 -44.3 7.6 22.1 93 618 A S H X S+ 0 0 0 -4,-2.5 6,-2.5 -5,-0.2 4,-1.2 0.835 113.7 46.1 -67.4 -32.4 -46.0 10.8 23.4 94 619 A Y H X S+ 0 0 7 -4,-2.1 4,-1.9 4,-0.3 -2,-0.2 0.944 117.6 41.4 -71.8 -51.8 -47.7 11.2 20.0 95 620 A R H < S+ 0 0 130 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.882 126.4 33.2 -67.2 -37.3 -48.9 7.6 19.6 96 621 A Q H < S+ 0 0 147 -4,-2.8 -1,-0.2 -5,-0.3 -3,-0.2 0.706 138.6 12.9 -91.5 -24.8 -49.9 7.1 23.3 97 622 A A H >< S- 0 0 16 -4,-1.2 3,-2.0 -5,-0.3 -3,-0.2 0.258 92.6-112.9-141.1 14.2 -51.2 10.6 24.1 98 623 A S T 3< S- 0 0 63 -4,-1.9 -4,-0.3 1,-0.3 -3,-0.1 0.757 80.2 -60.5 54.6 27.5 -51.6 12.7 21.0 99 624 A G T 3 S+ 0 0 2 -6,-2.5 -1,-0.3 2,-0.2 33,-0.2 0.618 117.8 108.8 79.3 14.4 -48.8 14.9 22.2 100 625 A N S < S+ 0 0 108 -3,-2.0 2,-0.3 -7,-0.5 -2,-0.1 0.683 76.0 32.8 -95.9 -21.9 -50.5 15.9 25.4 101 626 A L S S- 0 0 57 -8,-0.4 2,-0.8 -4,-0.1 -2,-0.2 -0.971 85.8-108.3-133.5 152.2 -48.5 14.0 28.0 102 627 A L E -A 110 0A 0 8,-1.8 8,-2.8 -2,-0.3 2,-1.2 -0.697 30.3-164.1 -84.9 109.0 -44.9 13.1 28.2 103 628 A C E +A 109 0A 5 -2,-0.8 6,-0.2 -14,-0.4 -10,-0.1 -0.663 22.9 160.2 -96.2 79.3 -44.7 9.3 27.6 104 629 A F E S- 0 0 15 4,-1.4 -1,-0.2 -2,-1.2 5,-0.2 0.887 73.6 -20.1 -66.4 -40.4 -41.2 8.4 28.8 105 630 A A E > S-A 108 0A 4 3,-1.6 3,-2.0 -3,-0.2 -1,-0.3 -0.951 74.1 -95.3-160.5 163.5 -42.0 4.8 29.3 106 631 A P T 3 S+ 0 0 61 0, 0.0 3,-0.2 0, 0.0 -80,-0.1 0.825 130.0 40.2 -60.7 -25.7 -45.3 2.8 29.7 107 632 A D T 3 S+ 0 0 49 1,-0.2 2,-0.2 -4,-0.0 -81,-0.1 0.212 113.9 58.3-105.4 14.5 -44.7 3.0 33.5 108 633 A L E < +A 105 0A 11 -3,-2.0 -3,-1.6 2,-0.0 -4,-1.4 -0.693 60.6 155.0-147.5 84.0 -43.5 6.6 33.5 109 634 A I E -A 103 0A 80 -2,-0.2 2,-0.7 -6,-0.2 -6,-0.2 -0.967 31.7-146.8-114.4 123.2 -46.0 9.0 32.0 110 635 A I E -A 102 0A 3 -8,-2.8 -8,-1.8 -2,-0.5 -2,-0.0 -0.842 19.9-154.2 -97.7 110.4 -45.7 12.6 33.1 111 636 A N > - 0 0 57 -2,-0.7 4,-2.8 -10,-0.2 5,-0.2 -0.084 32.3 -90.2 -78.1 175.8 -49.2 14.2 33.3 112 637 A E H > S+ 0 0 119 1,-0.2 4,-0.9 2,-0.2 5,-0.1 0.879 124.0 50.6 -55.0 -43.8 -50.2 17.9 33.0 113 638 A Q H >4 S+ 0 0 148 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.939 114.0 43.3 -62.6 -47.8 -49.9 18.5 36.7 114 639 A R H >4 S+ 0 0 81 1,-0.2 3,-1.3 2,-0.2 -2,-0.2 0.868 110.9 55.9 -66.4 -33.5 -46.5 17.1 37.0 115 640 A M H 3< S+ 0 0 8 -4,-2.8 -1,-0.2 1,-0.3 9,-0.2 0.667 107.8 50.9 -70.9 -15.9 -45.4 18.8 33.8 116 641 A T T << S+ 0 0 61 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.258 76.1 125.3-109.0 14.0 -46.4 22.2 35.4 117 642 A L S X> S- 0 0 52 -3,-1.3 4,-2.5 1,-0.1 3,-1.9 -0.347 79.7 -98.4 -63.3 155.2 -44.6 21.9 38.7 118 643 A P T 34 S+ 0 0 122 0, 0.0 4,-0.4 0, 0.0 -1,-0.1 0.835 121.2 31.7 -48.2 -48.7 -42.3 25.0 39.2 119 644 A C T 34 S+ 0 0 63 1,-0.2 4,-0.2 2,-0.1 -2,-0.1 0.285 120.1 53.5 -98.1 11.1 -39.0 23.4 38.0 120 645 A M T <> S+ 0 0 0 -3,-1.9 4,-2.7 3,-0.1 5,-0.3 0.646 87.5 81.6-106.4 -29.2 -40.7 21.1 35.5 121 646 A Y H X S+ 0 0 123 -4,-2.5 4,-1.9 1,-0.2 5,-0.2 0.889 95.3 38.0 -46.7 -58.8 -42.7 23.6 33.5 122 647 A D H > S+ 0 0 63 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.955 119.1 44.8 -66.1 -50.5 -40.0 25.0 31.2 123 648 A Q H > S+ 0 0 16 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.898 112.5 52.6 -64.3 -37.2 -38.1 21.8 30.4 124 649 A C H X S+ 0 0 2 -4,-2.7 4,-2.3 -9,-0.2 -1,-0.2 0.885 104.3 55.7 -67.6 -35.2 -41.3 19.8 29.9 125 650 A K H X S+ 0 0 99 -4,-1.9 4,-1.4 -5,-0.3 -1,-0.2 0.941 111.8 44.8 -58.6 -45.3 -42.6 22.3 27.4 126 651 A H H X S+ 0 0 38 -4,-1.7 4,-0.5 1,-0.2 -2,-0.2 0.890 113.5 49.7 -65.3 -40.8 -39.4 21.9 25.4 127 652 A M H < S+ 0 0 22 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.810 113.2 45.8 -66.8 -34.3 -39.5 18.1 25.7 128 653 A L H >X S+ 0 0 23 -4,-2.3 4,-1.4 -5,-0.2 3,-0.7 0.708 89.7 87.8 -81.9 -21.9 -43.1 17.8 24.6 129 654 A F H >X S+ 0 0 86 -4,-1.4 4,-1.4 1,-0.2 3,-0.5 0.880 85.1 49.3 -47.7 -53.9 -42.8 20.2 21.6 130 655 A I H 3X S+ 0 0 0 -4,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.876 105.3 60.0 -60.8 -32.1 -41.7 17.7 18.9 131 656 A S H <> S+ 0 0 0 -3,-0.7 4,-2.3 -4,-0.3 -1,-0.2 0.922 102.1 52.9 -59.5 -41.4 -44.6 15.3 19.9 132 657 A T H S+ 0 0 0 -4,-2.4 5,-1.8 2,-0.2 4,-0.7 0.904 113.9 47.1 -62.7 -39.2 -45.6 14.6 15.0 135 660 A Q H ><5S+ 0 0 61 -4,-2.3 3,-0.7 -5,-0.2 -2,-0.2 0.937 111.8 49.4 -65.4 -48.4 -49.3 14.8 15.9 136 661 A R H 3<5S+ 0 0 145 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.935 118.0 39.5 -56.7 -47.0 -49.9 17.9 13.7 137 662 A L H 3<5S- 0 0 9 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.479 101.3-133.3 -82.8 -7.5 -48.3 16.3 10.7 138 663 A Q T <<5 - 0 0 101 -3,-0.7 -3,-0.2 -4,-0.7 -4,-0.1 0.928 30.6-157.8 51.4 52.3 -49.7 12.8 11.4 139 664 A V < - 0 0 2 -5,-1.8 -1,-0.2 -6,-0.1 2,-0.2 -0.346 4.8-133.4 -64.4 136.9 -46.3 11.2 10.8 140 665 A S > - 0 0 32 -3,-0.1 4,-2.9 1,-0.1 5,-0.2 -0.466 20.8-110.4 -86.6 163.7 -46.3 7.6 9.9 141 666 A Y H > S+ 0 0 89 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.916 119.0 49.8 -62.9 -39.1 -44.1 4.9 11.4 142 667 A E H > S+ 0 0 38 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 111.8 48.2 -65.9 -41.2 -42.1 4.5 8.2 143 668 A E H > S+ 0 0 0 38,-0.2 4,-2.7 1,-0.2 5,-0.2 0.941 112.1 50.9 -58.9 -47.4 -41.5 8.3 7.9 144 669 A Y H X S+ 0 0 6 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.913 107.9 51.3 -57.8 -48.3 -40.5 8.3 11.6 145 670 A L H X S+ 0 0 2 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.908 113.2 45.1 -58.1 -43.2 -38.0 5.5 11.2 146 671 A C H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.921 114.0 48.9 -66.9 -43.8 -36.3 7.3 8.3 147 672 A M H X S+ 0 0 0 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.880 107.7 55.0 -62.6 -39.0 -36.3 10.6 10.0 148 673 A K H X S+ 0 0 9 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.922 107.7 49.3 -64.6 -38.5 -34.9 9.1 13.2 149 674 A T H X S+ 0 0 0 -4,-1.8 4,-0.9 1,-0.2 3,-0.4 0.914 107.7 54.9 -64.5 -40.6 -31.9 7.7 11.2 150 675 A L H >< S+ 0 0 0 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.882 102.6 57.6 -59.9 -32.2 -31.4 11.1 9.6 151 676 A L H >< S+ 0 0 0 -4,-1.8 3,-1.4 1,-0.3 -1,-0.2 0.863 99.6 56.4 -68.8 -32.7 -31.1 12.6 13.1 152 677 A L H 3< S+ 0 0 1 -4,-1.4 -1,-0.3 -3,-0.4 3,-0.3 0.790 115.7 40.9 -60.7 -28.1 -28.2 10.2 13.9 153 678 A L T << S+ 0 0 3 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 -0.057 91.8 90.4-113.0 30.6 -26.7 11.8 10.8 154 679 A S S < S+ 0 0 2 -3,-1.4 99,-2.9 1,-0.2 2,-0.4 0.484 79.9 50.6-107.0 -6.8 -27.6 15.5 11.3 155 680 A S E +B 252 0B 2 -3,-0.3 97,-0.2 97,-0.2 -1,-0.2 -0.992 61.3 165.7-137.9 128.5 -24.7 16.9 13.4 156 681 A V E -B 251 0B 2 95,-2.5 95,-3.1 -2,-0.4 2,-0.1 -0.892 44.9 -78.2-137.1 167.9 -21.0 16.7 12.5 157 682 A P E > -B 250 0B 6 0, 0.0 3,-2.3 0, 0.0 93,-0.2 -0.399 42.1-122.2 -68.1 142.9 -17.7 18.2 13.5 158 683 A K T 3 S+ 0 0 150 91,-1.9 3,-0.1 1,-0.3 92,-0.1 0.832 113.0 52.4 -52.0 -36.1 -17.2 21.6 12.0 159 684 A E T 3 S- 0 0 136 1,-0.2 -1,-0.3 90,-0.1 2,-0.1 0.473 119.3-106.5 -82.3 -4.3 -14.0 20.4 10.3 160 685 A G < - 0 0 22 -3,-2.3 -1,-0.2 3,-0.0 2,-0.2 -0.143 35.0 -73.7 99.0 166.1 -15.7 17.3 8.8 161 686 A L > - 0 0 15 1,-0.1 3,-0.9 -3,-0.1 4,-0.1 -0.539 33.8-120.0 -92.8 164.8 -15.6 13.6 9.6 162 687 A K T 3 S+ 0 0 129 1,-0.3 2,-0.3 -2,-0.2 3,-0.2 0.890 117.2 39.1 -70.1 -39.1 -12.8 11.3 8.8 163 688 A S T 3> S+ 0 0 29 1,-0.2 4,-2.5 -94,-0.1 -1,-0.3 -0.393 78.1 148.5-104.6 52.3 -15.0 9.2 6.5 164 689 A Q H <> + 0 0 56 -3,-0.9 4,-2.8 -2,-0.3 5,-0.2 0.874 65.6 50.9 -57.0 -44.8 -16.9 12.2 5.0 165 690 A E H > S+ 0 0 169 -3,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.937 113.2 45.0 -63.8 -42.3 -17.6 10.7 1.6 166 691 A L H > S+ 0 0 50 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.911 112.2 52.9 -65.7 -45.2 -19.1 7.5 2.9 167 692 A F H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.940 107.8 50.7 -56.1 -47.2 -21.1 9.5 5.5 168 693 A D H X S+ 0 0 69 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.915 111.6 49.0 -58.5 -41.0 -22.5 11.8 2.8 169 694 A E H X S+ 0 0 117 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.930 112.0 46.9 -62.8 -50.5 -23.5 8.7 0.8 170 695 A I H X S+ 0 0 12 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.934 111.6 52.0 -58.2 -46.4 -25.2 7.0 3.8 171 696 A R H X S+ 0 0 33 -4,-2.9 4,-2.0 1,-0.2 3,-0.3 0.923 108.0 50.9 -58.8 -44.7 -27.1 10.2 4.6 172 697 A M H X S+ 0 0 111 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.851 103.5 59.8 -63.6 -32.8 -28.4 10.5 1.1 173 698 A T H X S+ 0 0 51 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.899 109.0 43.8 -60.2 -39.9 -29.7 6.9 1.2 174 699 A Y H X S+ 0 0 1 -4,-1.6 4,-2.3 -3,-0.3 -2,-0.2 0.811 108.9 55.7 -78.3 -27.4 -31.9 7.8 4.1 175 700 A I H X S+ 0 0 33 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.952 112.1 44.8 -62.1 -47.8 -33.0 11.1 2.6 176 701 A K H X S+ 0 0 157 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.915 110.2 55.0 -60.5 -39.4 -34.1 9.0 -0.4 177 702 A E H X S+ 0 0 14 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.891 105.0 53.0 -63.3 -39.0 -35.7 6.4 1.9 178 703 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.921 107.5 51.6 -59.9 -43.1 -37.7 9.2 3.5 179 704 A G H X S+ 0 0 24 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.928 109.4 50.2 -59.6 -39.6 -39.0 10.2 0.1 180 705 A K H X S+ 0 0 119 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.938 109.1 51.6 -65.8 -41.5 -40.0 6.6 -0.6 181 706 A A H < S+ 0 0 6 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.869 112.9 44.9 -62.1 -38.6 -41.9 6.4 2.8 182 707 A I H >< S+ 0 0 3 -4,-2.2 3,-1.3 -5,-0.2 5,-0.4 0.944 114.1 49.3 -67.7 -50.2 -43.8 9.6 1.9 183 708 A A H >< S+ 0 0 42 -4,-2.9 3,-2.5 1,-0.3 -2,-0.2 0.809 97.8 68.0 -61.1 -33.7 -44.5 8.4 -1.7 184 709 A K T 3< S+ 0 0 151 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.749 83.2 74.4 -60.5 -24.1 -45.8 5.0 -0.5 185 710 A R T < S- 0 0 126 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.625 110.3-122.4 -59.4 -20.0 -48.7 6.8 1.0 186 711 A G < + 0 0 66 -3,-2.5 -2,-0.1 1,-0.2 -3,-0.1 0.646 57.6 149.0 84.9 19.4 -49.9 7.2 -2.6 187 712 A G - 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