==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 08-FEB-09 3G6Q . COMPND 2 MOLECULE: GLUCOCORTICOID RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.A.PUFALL,K.R.YAMAMOTO,S.H.MEIJSING . 152 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9332.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 81 53.3 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 . 11 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 1 1 2 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 . 2 1 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 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 1 437 B S 0 0 150 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-131.4 47.6 26.2 28.0 2 438 B H + 0 0 123 2,-0.1 9,-0.8 17,-0.1 2,-0.4 -0.108 360.0 108.2-147.7 43.9 43.9 26.6 27.6 3 439 B M B S-A 10 0A 116 7,-0.3 7,-0.2 18,-0.0 16,-0.1 -0.986 73.2-108.7-119.3 135.0 43.0 25.2 24.2 4 440 B C > - 0 0 2 5,-3.1 4,-1.1 -2,-0.4 16,-0.3 -0.317 18.5-141.2 -57.6 132.6 41.1 21.9 23.7 5 441 B L T 4 S+ 0 0 102 14,-3.2 -1,-0.2 1,-0.1 15,-0.1 0.600 99.1 41.1 -71.6 -9.5 43.3 19.2 22.4 6 442 B V T 4 S+ 0 0 6 13,-0.3 42,-0.2 3,-0.1 -1,-0.1 0.840 135.6 6.7-105.3 -52.8 40.5 17.9 20.2 7 443 B C T 4 S- 0 0 0 2,-0.1 43,-0.5 40,-0.0 -2,-0.1 0.476 89.9-122.2-114.4 -5.7 38.7 21.0 18.8 8 444 B S < + 0 0 72 -4,-1.1 -3,-0.1 41,-0.2 42,-0.1 0.754 62.9 141.2 69.3 23.0 41.0 23.8 19.9 9 445 B D S S- 0 0 34 1,-0.1 -5,-3.1 40,-0.1 2,-0.9 -0.244 74.0 -68.8 -74.9 178.8 38.2 25.6 21.7 10 446 B E B -A 3 0A 145 -7,-0.2 12,-0.3 -3,-0.1 2,-0.3 -0.665 59.4-135.8 -74.5 107.7 39.0 27.3 25.0 11 447 B A - 0 0 13 -2,-0.9 10,-0.3 -9,-0.8 8,-0.1 -0.505 10.9-155.8 -70.9 126.1 39.6 24.2 27.2 12 448 B S - 0 0 86 8,-0.6 9,-0.2 -2,-0.3 -1,-0.1 0.973 59.8 -65.9 -64.3 -55.9 38.0 24.4 30.6 13 449 B G E S-B 20 0B 37 7,-1.1 7,-0.6 5,-0.2 2,-0.4 -0.435 78.5 -30.5-158.9-125.1 40.4 22.0 32.3 14 450 B C E -B 19 0B 92 5,-0.2 2,-0.4 -2,-0.1 5,-0.3 -0.981 53.9-179.5-123.5 125.8 41.4 18.4 32.2 15 451 B H E > -B 18 0B 42 3,-3.5 3,-2.1 -2,-0.4 55,-0.1 -0.981 62.6 -12.4-136.4 124.5 38.8 15.6 31.3 16 452 B Y T 3 S- 0 0 58 -2,-0.4 54,-3.6 1,-0.4 56,-0.2 0.569 135.7 -61.2 60.0 21.9 39.0 11.9 31.0 17 453 B G T 3 S+ 0 0 41 52,-0.3 -1,-0.4 54,-0.1 2,-0.3 0.189 117.2 94.2-124.3 104.9 41.8 13.0 31.2 18 454 B V E < S-B 15 0B 8 -3,-2.1 -3,-3.5 2,-0.0 2,-1.4 -0.954 80.9 -87.8-140.1 156.3 43.0 15.5 28.5 19 455 B L E S+B 14 0B 70 -2,-0.3 -14,-3.2 -5,-0.3 2,-0.3 -0.530 72.3 152.7 -63.9 92.1 42.9 19.2 28.1 20 456 B T E -B 13 0B 0 -2,-1.4 -7,-1.1 -7,-0.6 -8,-0.6 -0.908 46.8-114.8-128.5 155.5 39.4 19.5 26.6 21 457 B C > - 0 0 2 -2,-0.3 4,-1.3 -10,-0.3 -10,-0.2 -0.158 41.6-103.2 -68.9 176.4 36.6 22.0 26.4 22 458 B G H > S+ 0 0 37 -12,-0.3 4,-2.0 2,-0.2 5,-0.3 0.788 118.3 58.6 -76.4 -28.2 33.3 21.1 28.1 23 459 B S H > S+ 0 0 40 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.966 108.6 43.9 -62.6 -54.2 31.6 20.2 24.8 24 460 B C H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.859 109.5 59.7 -60.4 -36.3 34.1 17.5 24.0 25 461 B K H X S+ 0 0 84 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.985 114.6 32.3 -53.1 -65.4 34.0 16.3 27.6 26 462 B V H X S+ 0 0 49 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.844 116.1 58.3 -65.9 -37.4 30.3 15.4 27.5 27 463 B F H X S+ 0 0 22 -4,-3.1 4,-2.5 -5,-0.3 -1,-0.2 0.960 105.7 51.1 -52.9 -51.9 30.4 14.5 23.8 28 464 B F H X S+ 0 0 4 -4,-2.8 4,-2.1 1,-0.2 5,-0.3 0.913 107.2 51.1 -56.5 -49.6 33.0 11.9 24.6 29 465 B K H X S+ 0 0 74 -4,-1.8 4,-2.8 1,-0.2 5,-0.3 0.939 113.0 47.5 -52.4 -46.3 31.0 10.3 27.4 30 466 B R H X S+ 0 0 149 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.872 109.0 52.8 -65.1 -39.4 28.0 10.1 25.1 31 467 B A H < S+ 0 0 0 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.865 118.7 35.0 -63.7 -38.2 30.0 8.6 22.2 32 468 B V H < S+ 0 0 57 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.908 120.4 47.0 -82.2 -44.6 31.4 5.8 24.3 33 469 B E H < S+ 0 0 128 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.976 117.7 30.6 -66.6 -61.3 28.4 5.2 26.6 34 470 B G S < S- 0 0 35 -4,-1.5 2,-0.2 -5,-0.3 0, 0.0 -0.135 82.4-119.8 -84.1-174.9 25.6 5.0 24.1 35 471 B Q + 0 0 111 2,-0.1 2,-0.1 -2,-0.0 -4,-0.1 -0.614 40.7 144.0-176.5 121.4 25.7 3.9 20.5 36 472 B H - 0 0 93 -2,-0.2 2,-0.4 -5,-0.1 0, 0.0 0.122 47.2-110.2 91.2 116.7 25.1 5.4 18.0 37 473 B N - 0 0 152 -2,-0.1 2,-0.3 2,-0.0 21,-0.1 -0.870 27.1-170.0-138.9 122.5 26.8 5.0 14.7 38 474 B Y + 0 0 52 -2,-0.4 2,-0.4 19,-0.1 88,-0.1 -0.735 5.0 179.7-102.6 139.9 29.0 7.6 13.2 39 475 B L - 0 0 90 -2,-0.3 19,-0.2 86,-0.1 2,-0.1 -0.989 26.7-123.5-144.3 133.7 30.4 7.5 9.7 40 476 B C - 0 0 9 -2,-0.4 86,-0.1 1,-0.1 16,-0.1 -0.466 10.6-160.8 -76.2 144.9 32.7 10.1 8.1 41 477 B A S S+ 0 0 5 -2,-0.1 80,-2.5 85,-0.1 -1,-0.1 0.390 80.6 38.0-104.1 0.1 31.4 11.6 4.8 42 478 B G S S- 0 0 24 78,-0.2 74,-0.1 74,-0.0 -2,-0.0 0.517 119.9 -54.8-112.8-103.3 34.8 12.7 3.8 43 479 B R S S- 0 0 119 77,-0.0 73,-0.0 0, 0.0 77,-0.0 0.105 71.2 -96.0-139.1 18.5 38.2 11.0 4.2 44 480 B N S S+ 0 0 104 1,-0.1 -4,-0.0 0, 0.0 0, 0.0 0.646 109.6 90.3 68.0 13.4 38.4 10.2 7.9 45 481 B D + 0 0 122 2,-0.0 2,-0.1 70,-0.0 -1,-0.1 -0.326 56.6 166.4-128.3 54.1 40.5 13.4 8.3 46 482 B C - 0 0 8 1,-0.1 2,-0.6 10,-0.1 70,-0.2 -0.432 43.7-110.5 -72.3 140.9 37.9 16.1 9.0 47 483 B I - 0 0 87 68,-3.1 2,-0.6 -2,-0.1 -1,-0.1 -0.576 36.3-161.2 -63.2 114.3 38.8 19.6 10.3 48 484 B I + 0 0 13 -2,-0.6 2,-0.2 -42,-0.2 -1,-0.0 -0.900 28.7 134.6-107.3 112.4 37.5 19.6 13.9 49 485 B D > - 0 0 41 -2,-0.6 4,-2.8 -41,-0.1 5,-0.2 -0.854 69.8 -71.4-144.6-175.5 37.1 23.1 15.5 50 486 B K T 4 S+ 0 0 125 -43,-0.5 4,-0.1 1,-0.3 -42,-0.1 0.814 131.8 29.3 -52.4 -35.6 34.6 25.1 17.6 51 487 B I T 4 S+ 0 0 109 -44,-0.1 3,-0.3 1,-0.1 -1,-0.3 0.777 124.9 43.7 -96.8 -28.5 32.2 25.4 14.7 52 488 B R T >> S+ 0 0 60 1,-0.2 3,-1.8 2,-0.1 4,-0.6 0.646 85.0 86.9 -95.4 -18.1 32.9 22.2 12.7 53 489 B R T 3< S+ 0 0 25 -4,-2.8 3,-0.4 1,-0.3 7,-0.2 0.746 85.3 62.1 -54.9 -23.9 33.1 19.6 15.4 54 490 B K T 34 S+ 0 0 177 -3,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 0.847 94.7 64.5 -67.2 -34.2 29.3 19.3 15.1 55 491 B N T <4 S+ 0 0 29 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.728 110.2 24.9 -65.3 -31.7 29.7 18.1 11.5 56 492 B C X + 0 0 3 -4,-0.6 4,-2.2 -3,-0.4 -1,-0.2 -0.691 51.4 172.4-145.2 90.6 31.5 14.9 11.9 57 493 B P H > S+ 0 0 27 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.732 82.6 64.2 -72.0 -21.3 31.3 13.0 15.2 58 494 B A H > S+ 0 0 17 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.974 111.1 37.5 -60.2 -50.4 33.2 10.0 13.7 59 495 B C H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.835 115.8 52.4 -71.5 -35.5 36.2 12.3 13.3 60 496 B R H X S+ 0 0 21 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.982 111.8 46.8 -62.5 -54.8 35.6 14.1 16.6 61 497 B Y H X S+ 0 0 48 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.930 111.0 51.8 -50.8 -52.4 35.4 10.8 18.4 62 498 B R H X S+ 0 0 53 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.902 109.3 49.9 -52.7 -46.3 38.5 9.5 16.7 63 499 B K H X S+ 0 0 49 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.892 108.5 53.6 -62.2 -37.8 40.5 12.6 17.7 64 500 B C H <>S+ 0 0 0 -4,-2.3 5,-1.8 2,-0.2 -2,-0.2 0.925 111.1 45.7 -57.6 -47.5 39.2 12.1 21.3 65 501 B L H ><5S+ 0 0 81 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.946 111.5 51.6 -64.3 -45.5 40.5 8.6 21.3 66 502 B Q H 3<5S+ 0 0 139 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.712 103.1 57.2 -68.9 -22.8 43.8 9.5 19.8 67 503 B A T 3<5S- 0 0 39 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.333 126.0-104.9 -85.0 7.4 44.5 12.3 22.3 68 504 B G T < 5 + 0 0 48 -3,-1.9 2,-0.2 1,-0.2 -3,-0.2 0.872 57.7 168.4 78.0 41.0 44.1 9.5 24.8 69 505 B M < + 0 0 9 -5,-1.8 2,-0.3 -4,-0.1 -52,-0.3 -0.595 3.6 170.9 -83.3 152.9 40.7 10.0 26.4 70 506 B N - 0 0 92 -54,-3.6 -41,-0.1 -2,-0.2 3,-0.0 -0.934 43.0-124.8-163.4 131.4 39.4 7.1 28.5 71 507 B L S S+ 0 0 44 -2,-0.3 2,-0.4 1,-0.2 -55,-0.1 0.551 104.7 53.3 -66.6 -3.1 36.3 7.0 30.8 72 508 B E + 0 0 144 -56,-0.2 -1,-0.2 1,-0.1 0, 0.0 -0.882 53.8 133.2-133.6 103.0 38.7 6.0 33.6 73 509 B A 0 0 66 -2,-0.4 -1,-0.1 -3,-0.0 -2,-0.1 0.511 360.0 360.0-118.7 -15.6 41.7 8.1 34.3 74 510 B R 0 0 296 -58,-0.0 -2,-0.1 0, 0.0 0, 0.0 0.739 360.0 360.0 -90.6 360.0 41.4 8.4 38.1 75 !* 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 76 438 A H 0 0 180 0, 0.0 9,-2.7 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 144.2 13.2 6.2 -8.2 77 439 A M B -C 84 0C 88 7,-0.2 7,-0.2 1,-0.1 6,-0.1 -0.712 360.0-106.5-122.3 147.7 15.7 8.3 -6.3 78 440 A C > - 0 0 2 5,-3.1 4,-1.0 -2,-0.3 16,-0.3 -0.280 25.3-146.0 -55.9 135.5 16.5 11.7 -4.8 79 441 A L T 4 S+ 0 0 102 14,-2.2 -1,-0.2 2,-0.1 15,-0.1 0.576 96.0 45.8 -85.6 -5.7 19.0 13.5 -6.9 80 442 A V T 4 S+ 0 0 0 13,-0.2 42,-0.2 3,-0.1 -1,-0.1 0.859 134.8 2.6 -98.3 -49.7 20.6 15.0 -3.8 81 443 A C T 4 S- 0 0 0 2,-0.1 43,-0.3 40,-0.0 -2,-0.1 0.511 86.2-122.2-123.4 -4.2 20.9 12.2 -1.4 82 444 A S < + 0 0 63 -4,-1.0 2,-0.1 1,-0.2 -3,-0.1 0.647 66.0 133.4 68.5 15.5 19.7 9.0 -3.2 83 445 A D S S- 0 0 37 1,-0.2 -5,-3.1 40,-0.1 2,-0.3 -0.307 77.6 -59.0 -75.2 176.0 17.0 8.2 -0.6 84 446 A E B -C 77 0C 133 -7,-0.2 12,-0.4 -2,-0.1 -7,-0.2 -0.463 60.0-127.3 -64.9 124.8 13.6 7.4 -2.1 85 447 A A - 0 0 16 -9,-2.7 10,-0.3 -2,-0.3 3,-0.1 -0.475 19.9-168.0 -75.9 142.1 12.3 10.2 -4.3 86 448 A S - 0 0 73 8,-2.3 2,-0.2 1,-0.5 9,-0.1 0.242 57.3 -61.4-115.6 11.5 8.8 11.5 -3.5 87 449 A G S S- 0 0 29 7,-0.4 7,-1.7 2,-0.1 -1,-0.5 -0.719 74.0 -47.7 136.2 173.8 8.2 13.7 -6.5 88 450 A C E +D 93 0D 99 5,-0.2 2,-0.4 -2,-0.2 5,-0.3 -0.694 57.7 179.7 -74.9 132.4 9.6 16.8 -8.2 89 451 A H E > -D 92 0D 37 3,-2.3 3,-2.4 -2,-0.4 55,-0.1 -0.994 68.7 -6.2-135.1 134.7 10.2 19.5 -5.6 90 452 A Y T 3 S- 0 0 52 -2,-0.4 54,-1.8 1,-0.3 56,-0.1 0.823 136.2 -52.5 44.9 34.4 11.6 23.0 -6.4 91 453 A G T 3 S+ 0 0 51 52,-0.2 2,-0.4 1,-0.1 -1,-0.3 0.421 121.2 88.7 94.8 3.5 12.1 21.5 -9.9 92 454 A V E < S-D 89 0D 11 -3,-2.4 -3,-2.3 52,-0.1 2,-0.8 -0.994 82.2-107.6-140.0 137.7 14.0 18.4 -9.0 93 455 A L E +D 88 0D 44 -2,-0.4 -14,-2.2 -5,-0.3 2,-0.3 -0.483 62.3 149.2 -58.9 101.4 13.2 14.8 -8.2 94 456 A T - 0 0 0 -7,-1.7 -8,-2.3 -2,-0.8 -7,-0.4 -0.848 46.9-106.5-130.7 169.4 14.1 14.8 -4.4 95 457 A C > - 0 0 2 -10,-0.3 4,-1.3 -2,-0.3 3,-0.2 -0.386 42.2 -98.8 -85.8 174.7 13.0 13.0 -1.3 96 458 A G H > S+ 0 0 34 -12,-0.4 4,-2.2 1,-0.2 3,-0.5 0.933 119.0 53.4 -60.5 -50.1 10.9 14.7 1.3 97 459 A S H > S+ 0 0 41 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.827 109.9 48.0 -59.9 -33.2 13.7 15.5 3.7 98 460 A C H > S+ 0 0 0 2,-0.2 4,-2.8 -3,-0.2 -1,-0.3 0.783 107.8 57.4 -78.9 -26.8 15.8 17.3 1.0 99 461 A K H X S+ 0 0 76 -4,-1.3 4,-2.2 -3,-0.5 -2,-0.2 0.963 113.4 36.6 -67.4 -53.3 12.8 19.2 -0.1 100 462 A V H X S+ 0 0 44 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.787 115.0 58.9 -72.2 -21.1 12.2 20.8 3.3 101 463 A F H X S+ 0 0 27 -4,-1.3 4,-1.8 -5,-0.3 -2,-0.2 0.979 108.7 42.6 -68.0 -52.9 16.0 21.0 3.8 102 464 A F H X S+ 0 0 3 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.918 112.0 54.4 -56.0 -46.0 16.4 23.1 0.7 103 465 A K H X S+ 0 0 55 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.889 109.8 47.0 -59.5 -40.0 13.4 25.2 1.5 104 466 A R H X S+ 0 0 173 -4,-1.8 4,-0.9 2,-0.2 -1,-0.2 0.805 112.8 48.9 -70.1 -34.1 14.8 26.0 5.0 105 467 A A H < S+ 0 0 0 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.862 113.7 46.6 -72.2 -36.9 18.3 26.8 3.7 106 468 A V H < S+ 0 0 46 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.835 115.4 43.2 -77.3 -35.3 16.9 29.2 1.0 107 469 A E H < S+ 0 0 132 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.721 124.4 30.9 -82.6 -23.1 14.5 31.1 3.2 108 470 A G S < S- 0 0 35 -4,-0.9 2,-0.3 -5,-0.2 -3,-0.1 -0.097 107.7 -52.6-112.0-149.8 16.9 31.4 6.0 109 471 A Q - 0 0 168 -2,-0.1 -1,-0.1 -5,-0.1 -2,-0.1 -0.732 35.7-173.3 -91.9 140.7 20.6 31.7 6.5 110 472 A H + 0 0 85 -2,-0.3 2,-1.7 -4,-0.1 -5,-0.1 -0.284 29.8 143.4-127.4 49.3 22.9 29.1 4.9 111 473 A N + 0 0 142 2,-0.0 2,-0.3 0, 0.0 21,-0.1 -0.537 29.4 157.9 -86.8 72.4 26.3 30.1 6.4 112 474 A Y - 0 0 79 -2,-1.7 2,-0.5 19,-0.1 -2,-0.1 -0.714 33.1-141.9 -99.7 149.4 27.5 26.5 6.7 113 475 A L - 0 0 65 -2,-0.3 2,-0.3 -62,-0.1 19,-0.2 -0.932 8.2-140.3-111.1 127.7 31.1 25.3 6.9 114 476 A C - 0 0 15 -2,-0.5 16,-0.1 1,-0.1 -62,-0.1 -0.686 5.8-160.4 -77.6 137.4 32.4 22.1 5.2 115 477 A A S S+ 0 0 3 -2,-0.3 -68,-3.1 -63,-0.1 -1,-0.1 0.286 77.4 36.5 -97.5 6.1 34.9 20.3 7.5 116 478 A G S S- 0 0 24 -70,-0.2 -2,-0.1 -74,-0.1 -74,-0.0 -0.084 118.4 -54.3-129.9-136.1 36.4 18.4 4.6 117 479 A R S S- 0 0 176 -2,-0.1 -71,-0.0 -71,-0.0 -2,-0.0 -0.018 73.1 -99.4-110.2 30.6 37.1 19.2 0.9 118 480 A N S S+ 0 0 104 1,-0.1 -76,-0.0 0, 0.0 -4,-0.0 0.861 109.0 88.9 59.5 31.6 33.7 20.4 -0.2 119 481 A D + 0 0 67 2,-0.0 -1,-0.1 -78,-0.0 3,-0.1 -0.062 55.4 161.0-143.2 33.6 32.9 17.0 -1.8 120 482 A C - 0 0 12 1,-0.1 2,-0.7 10,-0.0 -78,-0.2 -0.193 48.0-105.9 -59.6 151.3 31.4 15.3 1.2 121 483 A I - 0 0 74 -80,-2.5 2,-0.9 1,-0.0 -1,-0.1 -0.726 32.3-162.5 -82.7 112.8 29.3 12.2 0.4 122 484 A I + 0 0 5 -2,-0.7 2,-0.2 -42,-0.2 5,-0.0 -0.832 34.7 130.6-100.3 98.9 25.6 13.1 0.8 123 485 A D S > S- 0 0 35 -2,-0.9 4,-1.5 -41,-0.1 -41,-0.2 -0.626 72.0 -68.7-128.5-163.3 23.6 9.8 1.1 124 486 A K T 4 S+ 0 0 120 -43,-0.3 4,-0.2 -2,-0.2 3,-0.2 0.893 127.9 30.4 -68.3 -46.5 21.0 8.7 3.5 125 487 A I T >4 S+ 0 0 116 1,-0.2 3,-0.5 2,-0.1 -1,-0.2 0.890 125.6 45.2 -77.2 -33.5 22.9 8.3 6.8 126 488 A R G >> S+ 0 0 51 1,-0.2 3,-1.5 2,-0.1 4,-0.7 0.526 82.2 92.8 -87.0 -5.8 25.5 11.0 6.0 127 489 A R G 3< S+ 0 0 26 -4,-1.5 -1,-0.2 1,-0.3 7,-0.1 0.732 83.2 57.3 -68.6 -20.1 23.3 13.8 4.7 128 490 A K G <4 S+ 0 0 157 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.1 0.752 94.2 72.2 -70.7 -28.5 23.1 15.4 8.2 129 491 A N T <4 S+ 0 0 24 -3,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.869 106.1 23.5 -61.4 -45.0 26.9 15.6 8.4 130 492 A C X + 0 0 4 -4,-0.7 4,-1.9 1,-0.2 3,-0.3 -0.731 50.9 172.7-135.6 89.7 27.5 18.4 6.0 131 493 A P H > S+ 0 0 31 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.858 84.7 64.4 -52.7 -36.8 24.7 20.9 5.2 132 494 A A H > S+ 0 0 19 -19,-0.2 4,-1.5 1,-0.2 -18,-0.1 0.931 109.6 35.0 -58.9 -48.7 27.3 22.9 3.3 133 495 A C H > S+ 0 0 0 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.746 115.5 56.7 -75.7 -26.9 27.8 20.1 0.7 134 496 A R H X S+ 0 0 21 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.961 108.8 46.8 -69.5 -46.0 24.1 19.1 0.8 135 497 A Y H X S+ 0 0 31 -4,-3.2 4,-2.4 1,-0.2 5,-0.2 0.903 111.0 52.8 -59.8 -39.9 23.0 22.6 -0.1 136 498 A R H X S+ 0 0 74 -4,-1.5 4,-2.7 -5,-0.3 -1,-0.2 0.904 107.6 49.3 -64.7 -43.5 25.6 22.7 -2.8 137 499 A K H X S+ 0 0 57 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.826 109.3 55.2 -64.4 -33.5 24.3 19.5 -4.3 138 500 A C H X>S+ 0 0 0 -4,-2.0 5,-2.2 2,-0.2 4,-0.7 0.931 112.7 41.0 -59.9 -48.7 20.8 21.0 -4.1 139 501 A L H ><5S+ 0 0 88 -4,-2.4 3,-0.6 1,-0.2 -2,-0.2 0.887 114.5 52.5 -69.3 -35.5 21.9 24.0 -6.1 140 502 A Q H 3<5S+ 0 0 147 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.841 106.0 52.8 -70.8 -34.7 23.9 21.9 -8.5 141 503 A A H 3<5S- 0 0 42 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.623 123.9-107.9 -76.2 -15.3 21.0 19.7 -9.2 142 504 A G T <<5 + 0 0 41 -4,-0.7 -3,-0.2 -3,-0.6 -2,-0.1 0.621 54.8 167.6 106.6 17.7 19.1 22.8 -10.0 143 505 A M < + 0 0 8 -5,-2.2 2,-0.3 -52,-0.0 -1,-0.2 -0.352 3.5 166.6 -67.3 139.9 16.6 23.4 -7.2 144 506 A N - 0 0 75 -54,-1.8 3,-0.3 1,-0.1 -52,-0.1 -0.974 37.7-134.3-150.6 148.5 14.9 26.8 -7.1 145 507 A L S > S+ 0 0 50 -2,-0.3 2,-2.4 1,-0.3 3,-0.7 0.952 102.0 56.8 -68.0 -51.7 11.9 28.1 -5.1 146 508 A E T 3 S+ 0 0 123 1,-0.2 -1,-0.3 2,-0.1 0, 0.0 -0.434 73.9 106.7 -81.9 66.5 10.2 29.9 -8.0 147 509 A A T 3 S+ 0 0 18 -2,-2.4 -1,-0.2 -3,-0.3 -2,-0.1 0.345 75.8 52.1-121.0 -3.7 10.1 26.7 -10.1 148 510 A R S < S+ 0 0 232 -3,-0.7 3,-0.4 2,-0.2 -2,-0.1 0.834 119.3 32.3 -94.8 -53.4 6.3 26.2 -9.7 149 511 A K S > S+ 0 0 63 -4,-0.2 4,-0.7 1,-0.2 3,-0.1 0.457 125.6 50.8 -79.2 -2.3 5.2 29.7 -10.6 150 512 A T T 4 S+ 0 0 62 2,-0.2 -1,-0.2 -5,-0.1 -2,-0.2 0.378 98.2 60.0-117.2 -2.6 8.2 29.7 -13.0 151 513 A K T 4 S+ 0 0 86 -3,-0.4 -1,-0.1 2,-0.1 -2,-0.1 -0.152 107.5 57.9-100.9 30.8 7.5 26.3 -14.7 152 514 A K T 4 0 0 76 -3,-0.1 -2,-0.2 0, 0.0 -3,-0.1 0.673 360.0 360.0-121.2 -60.7 4.3 28.2 -15.6 153 515 A K < 0 0 142 -4,-0.7 -3,-0.1 0, 0.0 -2,-0.1 0.956 360.0 360.0 -64.1 360.0 5.0 31.4 -17.6