==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JUN-11 3SKY . COMPND 2 MOLECULE: COPPER-EXPORTING P-TYPE ATPASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR S.JAYAKANTHAN,S.A.ROBERTS,A.WEICHSEL,J.M.ARGUELLO,M.M.MCEVOY . 260 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13393.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 14.6 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 . 2 0.8 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 . 15 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.7 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 2 1 0 1 2 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 1 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 2 0 1 1 1 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 . 0 0 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 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 1 375 A Q > 0 0 183 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 11.5 22.3 4.1 53.6 2 376 A A H > + 0 0 14 236,-0.2 4,-1.0 2,-0.2 237,-0.1 0.939 360.0 45.0 -68.5 -50.5 24.9 5.3 56.1 3 377 A F H >4 S+ 0 0 69 1,-0.2 3,-1.2 2,-0.2 4,-0.5 0.957 112.0 54.9 -54.7 -53.3 27.9 3.9 54.3 4 378 A E H >4 S+ 0 0 53 1,-0.2 3,-0.9 2,-0.2 -2,-0.2 0.893 110.4 43.7 -47.6 -50.0 26.5 5.2 51.0 5 379 A R H >< S+ 0 0 82 -4,-2.0 3,-1.4 1,-0.2 -1,-0.2 0.602 89.4 86.7 -82.1 -4.3 26.2 8.8 52.3 6 380 A A G X< S+ 0 0 1 -3,-1.2 3,-1.8 -4,-1.0 -1,-0.2 0.791 77.0 70.9 -60.0 -27.7 29.7 8.8 54.0 7 381 A K G < S+ 0 0 44 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.1 0.761 93.8 54.5 -60.5 -27.7 31.2 9.9 50.7 8 382 A D G < S+ 0 0 101 -3,-1.4 -1,-0.3 -4,-0.2 195,-0.2 0.236 78.7 128.9 -93.0 10.7 29.6 13.3 51.0 9 383 A L < + 0 0 3 -3,-1.8 195,-0.2 1,-0.1 3,-0.1 -0.441 28.0 173.3 -64.7 137.2 31.1 14.0 54.4 10 384 A Q + 0 0 89 193,-3.1 148,-2.8 1,-0.3 2,-0.4 0.598 65.7 31.8-113.4 -25.6 32.9 17.4 54.6 11 385 A A E -ab 158 204A 0 192,-2.4 194,-2.7 146,-0.2 2,-0.4 -0.987 58.8-162.0-136.7 141.0 33.7 17.5 58.4 12 386 A V E -ab 159 205A 0 146,-2.9 148,-2.8 -2,-0.4 2,-0.5 -0.988 6.1-163.9-124.9 126.8 34.5 14.9 61.0 13 387 A I E -ab 160 206A 0 192,-3.0 194,-2.9 -2,-0.4 2,-0.4 -0.928 7.8-161.3-107.1 123.2 34.2 15.7 64.7 14 388 A F E -ab 161 207A 0 146,-2.1 148,-2.3 -2,-0.5 2,-0.3 -0.856 18.6-130.8 -98.7 137.6 35.9 13.3 67.2 15 389 A D E > -a 162 0A 8 192,-2.8 5,-0.8 -2,-0.4 148,-0.2 -0.649 26.9-143.0 -74.2 142.4 35.0 13.1 70.8 16 390 A K I >>>S+ 0 0 0 146,-1.9 4,-1.8 -2,-0.3 5,-1.7 0.997 70.1 72.7 -74.1 -66.8 38.4 13.2 72.6 17 391 A T I 345S- 0 0 70 1,-0.3 5,-0.1 2,-0.2 -1,-0.1 -0.265 117.8 -3.6 -70.6 115.3 38.5 11.0 75.6 18 392 A G I 345S+ 0 0 20 -2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.129 131.4 63.2 95.9 -20.7 38.7 7.3 74.8 19 393 A T I <45S+ 0 0 5 -3,-1.5 -2,-0.2 -4,-0.1 -3,-0.2 0.877 121.5 10.4-100.9 -65.9 38.4 8.0 71.1 20 394 A L I < - 0 0 66 -2,-0.2 4,-2.1 1,-0.1 -3,-0.1 -0.280 20.0-136.1 -71.1 149.9 68.9 10.8 86.1 37 411 A E H > S+ 0 0 87 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.859 103.7 54.7 -73.2 -40.5 65.4 10.1 84.7 38 412 A D H > S+ 0 0 86 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.944 113.2 41.9 -56.4 -49.9 65.6 6.3 85.1 39 413 A E H > S+ 0 0 35 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.905 112.3 55.9 -62.7 -42.4 66.4 6.7 88.8 40 414 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.924 111.5 42.8 -57.3 -44.7 63.8 9.4 89.2 41 415 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.895 113.6 50.7 -67.9 -42.8 61.1 7.1 87.8 42 416 A Q H X S+ 0 0 37 -4,-2.2 4,-1.7 -5,-0.2 29,-0.4 0.875 114.3 45.2 -64.0 -36.9 62.3 4.1 89.8 43 417 A I H X S+ 0 0 12 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.928 112.7 48.9 -73.2 -45.1 62.2 6.2 93.0 44 418 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.3 -2,-0.2 0.908 113.1 48.2 -63.8 -41.3 58.9 7.8 92.3 45 419 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.862 107.5 54.5 -67.3 -38.4 57.3 4.5 91.5 46 420 A S H >< S+ 0 0 1 -4,-1.7 3,-0.6 1,-0.2 27,-0.2 0.944 114.1 42.1 -58.9 -46.2 58.7 2.8 94.7 47 421 A L H >< S+ 0 0 0 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.842 117.2 48.5 -67.3 -33.5 57.1 5.5 96.8 48 422 A E H >< S+ 0 0 16 -4,-2.0 3,-1.3 1,-0.2 -1,-0.2 0.526 81.8 97.5 -85.3 -5.3 53.9 5.4 94.7 49 423 A A T << S+ 0 0 48 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.1 0.678 83.4 48.5 -64.3 -20.4 53.5 1.6 94.8 50 424 A R T < S+ 0 0 125 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.1 0.733 90.8 104.1 -87.2 -22.1 51.0 1.7 97.7 51 425 A S < - 0 0 40 -3,-1.3 -3,-0.0 -4,-0.2 33,-0.0 -0.220 51.6-162.7 -76.2 148.9 48.7 4.4 96.4 52 426 A E + 0 0 182 4,-0.1 -1,-0.1 5,-0.0 5,-0.0 0.524 55.8 120.6 -96.4 -10.7 45.2 4.0 94.8 53 427 A H S > S- 0 0 112 1,-0.1 4,-2.3 -5,-0.1 5,-0.2 -0.271 71.3-127.1 -54.8 134.5 45.4 7.5 93.2 54 428 A P H > S+ 0 0 84 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.823 108.7 50.1 -55.1 -34.0 45.0 7.2 89.4 55 429 A I H > S+ 0 0 10 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.922 109.3 50.5 -73.1 -44.3 48.2 9.3 88.9 56 430 A A H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.912 109.1 52.1 -54.7 -44.7 50.3 7.2 91.3 57 431 A A H X S+ 0 0 50 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.886 107.2 52.5 -62.2 -38.7 49.1 4.1 89.4 58 432 A A H X S+ 0 0 11 -4,-1.5 4,-1.7 2,-0.2 -31,-0.4 0.868 107.8 52.0 -67.3 -33.3 50.2 5.5 86.1 59 433 A I H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.955 111.6 46.2 -66.1 -46.4 53.7 6.2 87.5 60 434 A V H X S+ 0 0 28 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.932 109.8 55.0 -61.4 -43.1 54.0 2.6 88.7 61 435 A E H X S+ 0 0 125 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.874 106.1 51.6 -58.0 -38.7 52.7 1.3 85.3 62 436 A E H X S+ 0 0 12 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.855 107.0 52.2 -70.2 -36.0 55.5 3.2 83.5 63 437 A A H <>S+ 0 0 0 -4,-1.7 5,-2.5 2,-0.2 4,-0.4 0.901 110.3 49.6 -64.4 -39.7 58.1 1.7 85.7 64 438 A E H ><5S+ 0 0 119 -4,-2.2 3,-0.8 3,-0.2 -2,-0.2 0.881 107.9 54.8 -61.6 -40.4 56.6 -1.7 84.8 65 439 A K H 3<5S+ 0 0 145 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.880 112.1 42.0 -61.2 -39.6 56.8 -0.7 81.1 66 440 A R T 3<5S- 0 0 110 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.441 114.2-118.4 -90.1 3.1 60.5 0.1 81.4 67 441 A G T < 5 + 0 0 65 -3,-0.8 2,-0.6 -4,-0.4 -3,-0.2 0.810 55.4 158.8 68.3 32.5 61.1 -3.0 83.5 68 442 A F < - 0 0 51 -5,-2.5 -1,-0.2 -6,-0.1 2,-0.1 -0.806 36.1-133.5 -90.8 121.3 62.4 -1.2 86.6 69 443 A G - 0 0 59 -2,-0.6 -23,-0.1 1,-0.1 2,-0.1 -0.438 23.3-118.7 -70.2 140.4 62.2 -3.1 89.9 70 444 A L - 0 0 73 -2,-0.1 2,-0.4 -25,-0.1 -1,-0.1 -0.337 18.2-133.7 -79.5 159.6 60.8 -1.3 92.9 71 445 A T - 0 0 63 -29,-0.4 2,-0.2 -28,-0.1 -1,-0.0 -0.936 24.2-109.8-116.0 136.4 62.6 -0.6 96.1 72 446 A E - 0 0 165 -2,-0.4 2,-0.3 1,-0.1 -25,-0.1 -0.463 37.5-136.5 -60.1 127.5 61.2 -1.2 99.6 73 447 A V - 0 0 9 -27,-0.2 3,-0.4 -2,-0.2 2,-0.3 -0.729 11.5-146.7 -93.8 139.6 60.6 2.2 101.2 74 448 A E E S+G 87 0B 52 13,-2.3 13,-3.3 -2,-0.3 0, 0.0 -0.791 77.7 7.8-104.8 152.2 61.5 3.0 104.8 75 449 A E E S- 0 0 134 -2,-0.3 -1,-0.2 11,-0.2 2,-0.1 0.895 88.4-169.7 43.6 46.6 59.6 5.3 107.2 76 450 A F E + 0 0 59 -3,-0.4 2,-0.3 10,-0.1 10,-0.3 -0.417 9.6 178.4 -63.5 136.6 56.9 5.5 104.5 77 451 A R E -G 85 0B 116 8,-3.1 8,-2.5 -2,-0.1 2,-0.5 -0.990 22.0-151.6-142.3 137.7 54.2 8.2 105.0 78 452 A A E -G 84 0B 61 -2,-0.3 6,-0.2 6,-0.2 -2,-0.0 -0.934 13.5-165.6-102.1 126.0 51.1 9.3 103.0 79 453 A I E >> -G 83 0B 45 4,-2.8 3,-2.2 -2,-0.5 4,-1.7 -0.904 13.8-142.8-114.3 99.4 50.2 12.9 103.5 80 454 A P T 34 S+ 0 0 130 0, 0.0 4,-0.0 0, 0.0 -2,-0.0 -0.457 93.1 33.8 -57.8 132.2 46.7 13.8 102.2 81 455 A G T 34 S+ 0 0 65 -2,-0.1 15,-0.0 1,-0.1 16,-0.0 0.269 130.7 34.3 98.4 -9.1 47.0 17.4 100.8 82 456 A K T <4 S- 0 0 9 -3,-2.2 15,-2.1 1,-0.2 18,-0.3 0.482 98.3-112.5-131.0 -68.7 50.6 16.8 99.6 83 457 A G E < -GH 79 96B 23 -4,-1.7 -4,-2.8 13,-0.2 2,-0.3 -0.885 47.9 -39.1 158.3-133.8 51.6 13.3 98.4 84 458 A V E -GH 78 95B 10 11,-2.5 11,-2.7 -2,-0.3 2,-0.3 -0.930 41.6-173.5-138.3 155.8 53.9 10.6 99.7 85 459 A E E +GH 77 94B 19 -8,-2.5 -8,-3.1 -2,-0.3 2,-0.3 -0.995 13.2 145.4-151.4 149.8 57.2 10.3 101.4 86 460 A G E - H 0 93B 0 7,-2.3 7,-2.4 -2,-0.3 2,-0.5 -0.961 46.2 -93.7-173.3 167.0 59.8 7.7 102.4 87 461 A I E +GH 74 92B 37 -13,-3.3 -13,-2.3 -2,-0.3 2,-0.4 -0.832 35.1 179.2 -95.3 132.1 63.5 7.1 102.8 88 462 A V E > S- H 0 91B 10 3,-2.2 3,-0.5 -2,-0.5 -15,-0.1 -0.954 71.6 -16.8-132.1 110.9 65.3 5.4 99.9 89 463 A N T 3 S- 0 0 147 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.874 126.5 -49.5 65.2 43.4 69.0 4.8 100.2 90 464 A G T 3 S+ 0 0 74 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.667 118.1 100.9 74.2 17.0 69.7 7.2 103.1 91 465 A R E < S-H 88 0B 113 -3,-0.5 -3,-2.2 -5,-0.0 2,-0.8 -0.981 73.9-122.9-130.0 142.4 67.9 10.1 101.5 92 466 A R E -H 87 0B 97 -2,-0.3 36,-2.9 -5,-0.2 37,-0.4 -0.804 35.8-173.1 -87.7 112.2 64.4 11.4 102.3 93 467 A Y E -HI 86 127B 7 -7,-2.4 -7,-2.3 -2,-0.8 2,-0.3 -0.774 6.5-175.6-103.4 150.5 62.4 11.4 99.1 94 468 A M E -HI 85 126B 16 32,-2.0 32,-2.3 -2,-0.3 2,-0.5 -0.989 18.4-154.0-141.3 148.6 58.8 12.7 98.5 95 469 A V E +HI 84 125B 2 -11,-2.7 -11,-2.5 -2,-0.3 2,-0.3 -0.978 35.0 166.1-123.4 116.7 56.4 12.7 95.6 96 470 A V E -HI 83 124B 3 28,-2.5 28,-2.8 -2,-0.5 -13,-0.2 -0.835 34.1-106.3-134.4 161.8 54.1 15.7 95.8 97 471 A S > - 0 0 43 -15,-2.1 4,-2.0 -2,-0.3 3,-0.4 -0.413 35.9-109.3 -84.2 160.2 51.5 17.8 94.0 98 472 A P H > S+ 0 0 42 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.775 120.7 61.9 -55.5 -27.3 52.0 21.3 92.6 99 473 A G H > S+ 0 0 20 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.906 103.5 46.0 -65.4 -45.5 49.6 22.4 95.4 100 474 A Y H > S+ 0 0 65 -3,-0.4 4,-1.8 -18,-0.3 5,-0.2 0.927 110.4 54.3 -61.6 -47.5 52.1 21.1 98.1 101 475 A I H X>S+ 0 0 1 -4,-2.0 5,-1.9 1,-0.2 4,-0.8 0.913 109.9 46.4 -52.0 -48.0 55.0 22.8 96.3 102 476 A R H <5S+ 0 0 180 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.850 110.9 52.9 -65.6 -36.0 53.2 26.2 96.3 103 477 A E H <5S+ 0 0 140 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.764 110.3 47.5 -71.0 -27.6 52.2 25.7 100.0 104 478 A L H <5S- 0 0 73 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.549 111.5-120.5 -90.1 -9.4 55.8 25.1 101.0 105 479 A G T <5 + 0 0 68 -4,-0.8 2,-0.3 -3,-0.3 -3,-0.2 0.688 55.6 158.5 80.0 20.5 57.2 28.1 99.1 106 480 A I < - 0 0 42 -5,-1.9 2,-0.4 -6,-0.2 -1,-0.3 -0.587 41.8-122.5 -81.3 136.7 59.4 26.0 96.9 107 481 A K - 0 0 165 -2,-0.3 2,-0.5 24,-0.0 24,-0.2 -0.657 20.6-147.7 -80.8 128.4 60.5 27.5 93.6 108 482 A T - 0 0 32 -2,-0.4 5,-0.1 1,-0.1 16,-0.0 -0.833 29.7-101.8 -98.5 130.9 59.6 25.4 90.5 109 483 A D > - 0 0 70 -2,-0.5 3,-1.6 1,-0.1 4,-0.4 -0.159 29.6-118.6 -50.9 143.0 62.0 25.6 87.6 110 484 A E T > S+ 0 0 128 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.775 109.2 67.2 -59.0 -28.9 60.8 27.9 84.8 111 485 A S T >> S+ 0 0 52 1,-0.2 3,-1.0 2,-0.2 4,-0.6 0.732 86.2 69.6 -63.2 -25.9 60.7 24.9 82.3 112 486 A V H <> S+ 0 0 1 -3,-1.6 4,-1.8 1,-0.2 3,-0.4 0.752 84.3 69.6 -67.2 -24.3 57.9 23.2 84.2 113 487 A E H <> S+ 0 0 82 -3,-1.1 4,-2.3 -4,-0.4 -1,-0.2 0.821 91.0 61.1 -64.9 -29.2 55.5 25.9 83.1 114 488 A K H <> S+ 0 0 146 -3,-1.0 4,-0.6 -4,-0.4 -1,-0.2 0.878 103.6 49.3 -63.2 -36.5 55.7 24.5 79.6 115 489 A L H ><>S+ 0 0 15 -4,-0.6 5,-1.7 -3,-0.4 3,-1.1 0.934 110.6 49.3 -66.7 -46.8 54.3 21.2 80.8 116 490 A K H ><5S+ 0 0 72 -4,-1.8 3,-2.0 1,-0.3 -2,-0.2 0.872 104.7 59.9 -57.3 -39.9 51.4 23.0 82.6 117 491 A Q H 3<5S+ 0 0 110 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.680 100.9 55.1 -64.8 -20.5 50.8 24.9 79.4 118 492 A Q T <<5S- 0 0 60 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.351 117.9-115.7 -88.8 5.6 50.2 21.5 77.7 119 493 A G T < 5 + 0 0 20 -3,-2.0 -3,-0.2 1,-0.2 50,-0.2 0.600 64.3 152.6 70.0 12.8 47.5 20.8 80.3 120 494 A K < - 0 0 20 -5,-1.7 2,-0.5 48,-0.1 -1,-0.2 -0.427 49.3-118.9 -72.2 149.1 49.7 17.9 81.6 121 495 A T E - J 0 137B 59 16,-2.6 16,-2.8 -2,-0.1 2,-0.4 -0.786 35.0-157.4 -90.2 129.4 49.4 16.9 85.3 122 496 A V E - J 0 136B 3 -2,-0.5 2,-0.4 14,-0.2 14,-0.2 -0.865 14.0-169.4-114.8 139.1 52.7 17.3 87.0 123 497 A V E - J 0 135B 15 12,-2.5 12,-2.4 -2,-0.4 2,-0.4 -0.971 17.2-137.3-122.9 148.7 54.2 15.7 90.1 124 498 A F E -IJ 96 134B 1 -28,-2.8 -28,-2.5 -2,-0.4 2,-0.6 -0.862 3.3-149.3-107.2 136.3 57.4 16.8 91.8 125 499 A I E -IJ 95 133B 0 8,-3.0 7,-3.6 -2,-0.4 8,-1.4 -0.938 17.2-162.8-103.4 117.8 60.1 14.5 93.2 126 500 A L E -IJ 94 131B 4 -32,-2.3 -32,-2.0 -2,-0.6 2,-0.4 -0.863 8.3-166.5 -99.9 140.5 61.9 16.0 96.2 127 501 A K E > S-IJ 93 130B 64 3,-3.0 3,-1.4 -2,-0.4 -34,-0.2 -0.987 80.3 -19.5-124.7 113.8 65.3 14.8 97.5 128 502 A N T 3 S- 0 0 103 -36,-2.9 -35,-0.1 -2,-0.4 3,-0.1 0.875 130.4 -49.4 52.6 39.8 66.2 16.1 101.0 129 503 A G T 3 S+ 0 0 53 -37,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.510 119.3 102.2 85.3 2.7 63.7 19.0 100.6 130 504 A E E < S- J 0 127B 147 -3,-1.4 -3,-3.0 -24,-0.0 2,-0.4 -0.911 82.1 -98.8-120.0 151.0 64.8 20.1 97.1 131 505 A V E + J 0 126B 30 -2,-0.3 -5,-0.3 -5,-0.2 3,-0.1 -0.524 39.8 172.9 -72.8 117.9 63.2 19.5 93.7 132 506 A S E - 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0 0 50 -122,-2.5 3,-1.5 1,-0.1 4,-0.6 -0.409 22.5-123.2 -62.2 142.9 46.3 6.8 70.7 143 517 A P T 34 S+ 0 0 101 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.836 112.6 53.3 -53.1 -37.9 49.2 5.7 68.3 144 518 A E T 3> S+ 0 0 60 1,-0.2 4,-1.7 2,-0.1 -2,-0.1 0.508 90.0 81.3 -71.5 -13.5 46.6 5.4 65.5 145 519 A S H <> S+ 0 0 0 -3,-1.5 4,-2.1 2,-0.2 5,-0.2 0.906 84.5 53.1 -73.1 -44.7 45.2 8.9 65.9 146 520 A R H X S+ 0 0 110 -4,-0.6 4,-2.4 -3,-0.3 -1,-0.2 0.940 114.6 44.4 -51.2 -48.9 47.8 11.0 64.1 147 521 A E H > S+ 0 0 82 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.822 107.2 59.8 -67.7 -32.6 47.3 8.8 61.0 148 522 A A H X S+ 0 0 0 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.920 111.8 40.5 -58.1 -46.0 43.5 8.9 61.4 149 523 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.903 113.7 50.5 -73.1 -45.4 43.6 12.7 61.0 150 524 A S H X S+ 0 0 66 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.913 109.6 51.9 -62.4 -40.1 46.2 12.9 58.2 151 525 A K H X S+ 0 0 80 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.915 112.4 47.1 -59.6 -40.5 44.3 10.3 56.2 152 526 A L H ><>S+ 0 0 0 -4,-1.3 5,-2.0 -5,-0.2 3,-1.1 0.934 112.2 47.4 -68.8 -44.1 41.1 12.4 56.6 153 527 A K H ><5S+ 0 0 86 -4,-2.8 3,-2.2 1,-0.3 -1,-0.2 0.886 103.2 63.8 -65.6 -36.5 42.8 15.8 55.8 154 528 A A H 3<5S+ 0 0 87 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.749 104.3 47.3 -56.4 -26.0 44.4 14.2 52.7 155 529 A I T <<5S- 0 0 43 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.189 125.6-100.9-105.8 17.4 40.8 13.6 51.3 156 530 A G T < 5S+ 0 0 54 -3,-2.2 2,-0.4 1,-0.3 -3,-0.2 0.514 73.5 143.8 83.4 10.3 39.7 17.2 52.1 157 531 A I < - 0 0 2 -5,-2.0 2,-0.4 -6,-0.1 -1,-0.3 -0.666 51.0-126.6 -86.2 129.9 37.8 16.4 55.3 158 532 A K E -a 11 0A 83 -148,-2.8 -146,-2.9 -2,-0.4 2,-0.5 -0.667 25.7-145.5 -77.0 129.5 37.9 19.1 58.0 159 533 A C E +a 12 0A 0 -2,-0.4 21,-2.2 -148,-0.2 22,-1.4 -0.848 26.5 164.7-105.9 121.2 39.1 17.4 61.2 160 534 A M E -ac 13 181A 10 -148,-2.8 -146,-2.1 -2,-0.5 2,-0.3 -0.772 19.3-154.5-128.4 173.0 37.7 18.6 64.6 161 535 A M E -ac 14 182A 0 20,-0.7 22,-2.3 -2,-0.2 2,-0.3 -0.995 1.4-164.4-147.5 142.6 37.4 17.5 68.2 162 536 A L E +ac 15 183A 0 -148,-2.3 -146,-1.9 -2,-0.3 2,-0.3 -0.958 17.9 162.1-124.1 152.8 35.2 18.2 71.1 163 537 A T - 0 0 2 20,-1.6 23,-2.7 -2,-0.3 24,-0.1 -0.977 45.9-133.2-161.9 150.9 35.8 17.5 74.7 164 538 A G S S+ 0 0 44 -2,-0.3 20,-0.1 21,-0.3 23,-0.1 0.519 80.2 107.2 -75.6 -13.0 34.7 18.4 78.3 165 539 A D S S- 0 0 50 1,-0.1 20,-3.2 20,-0.1 21,-0.2 -0.130 81.5 -87.0 -63.9 164.5 38.4 18.7 79.1 166 540 A N > - 0 0 55 18,-0.2 4,-2.1 19,-0.1 5,-0.2 -0.199 38.1-102.7 -75.6 168.1 40.0 22.1 79.6 167 541 A R H > S+ 0 0 155 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.719 116.4 57.3 -68.9 -20.5 41.4 24.3 76.9 168 542 A F H > S+ 0 0 86 2,-0.2 4,-2.3 3,-0.2 -1,-0.2 0.964 110.8 42.0 -73.9 -48.3 45.1 23.5 77.7 169 543 A V H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.913 116.5 49.3 -58.8 -45.7 44.6 19.8 77.2 170 544 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.905 110.8 49.5 -65.2 -43.9 42.4 20.3 74.1 171 545 A K H X S+ 0 0 78 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.909 110.2 52.0 -59.2 -43.8 44.9 22.7 72.6 172 546 A W H X S+ 0 0 21 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.946 112.2 44.2 -60.8 -49.4 47.7 20.2 73.2 173 547 A V H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.944 112.7 52.1 -59.6 -47.5 45.9 17.4 71.5 174 548 A A H X>S+ 0 0 5 -4,-2.5 5,-2.0 1,-0.2 4,-1.7 0.907 111.9 46.2 -56.2 -45.7 44.8 19.6 68.6 175 549 A E H <5S+ 0 0 121 -4,-2.5 3,-0.2 1,-0.2 -1,-0.2 0.931 111.0 51.3 -67.2 -45.6 48.4 20.7 68.0 176 550 A E H <5S+ 0 0 79 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.816 120.1 36.7 -55.8 -35.2 49.8 17.2 68.2 177 551 A L H <5S- 0 0 13 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.633 104.0-124.4 -95.1 -17.0 47.2 16.0 65.7 178 552 A G T <5 - 0 0 29 -4,-1.7 -3,-0.2 -3,-0.2 -19,-0.2 0.865 42.9-177.2 70.6 38.0 47.1 19.0 63.3 179 553 A L < - 0 0 20 -5,-2.0 -19,-0.2 -6,-0.2 -1,-0.2 -0.361 31.4-136.1 -65.3 146.2 43.3 19.3 63.8 180 554 A D S S- 0 0 68 -21,-2.2 2,-0.3 1,-0.2 -20,-0.2 0.812 81.6 -10.9 -71.5 -33.7 41.5 22.0 61.9 181 555 A D E -c 160 0A 77 -22,-1.4 -20,-0.7 -7,-0.0 2,-0.3 -0.985 60.1-166.6-158.2 164.0 39.4 23.1 64.9 182 556 A Y E -c 161 0A 75 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.988 12.3-147.4-152.2 157.1 38.5 22.0 68.4 183 557 A F E -c 162 0A 41 -22,-2.3 -20,-1.6 -2,-0.3 3,-0.3 -0.992 21.1-166.9-126.3 121.3 36.0 22.9 71.1 184 558 A A + 0 0 25 -2,-0.4 -18,-0.2 -22,-0.2 -20,-0.2 -0.566 61.8 28.5-102.4 168.6 37.0 22.6 74.8 185 559 A E S S+ 0 0 105 -20,-3.2 2,-0.7 1,-0.2 -21,-0.3 0.806 74.2 157.1 59.1 33.6 35.0 22.6 78.1 186 560 A V - 0 0 3 -23,-2.7 -1,-0.2 -3,-0.3 5,-0.1 -0.809 33.6-143.6 -95.7 111.1 31.9 21.1 76.4 187 561 A L >> - 0 0 98 -2,-0.7 3,-2.2 1,-0.1 4,-0.6 -0.247 30.3 -99.8 -70.1 164.7 29.7 19.4 79.0 188 562 A P G >4 S+ 0 0 95 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.858 123.6 50.9 -58.7 -35.9 27.8 16.2 77.8 189 563 A H G 34 S+ 0 0 151 1,-0.2 4,-0.2 2,-0.1 -2,-0.1 0.464 108.0 56.2 -76.0 -0.7 24.5 18.0 77.2 190 564 A E G <> S+ 0 0 54 -3,-2.2 4,-1.1 2,-0.1 -1,-0.2 0.461 82.3 83.7-108.4 -6.0 26.3 20.6 75.0 191 565 A K H S+ 0 0 25 -4,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.870 105.2 53.8 -60.7 -36.0 24.9 18.0 70.2 193 567 A E H > S+ 0 0 99 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.829 104.6 54.1 -72.7 -30.5 24.8 21.8 69.8 194 568 A K H X S+ 0 0 38 -4,-1.1 4,-2.0 -3,-0.4 -1,-0.2 0.852 106.5 52.5 -68.2 -36.6 28.4 22.0 68.8 195 569 A V H X S+ 0 0 0 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.898 108.4 50.6 -63.7 -40.3 27.7 19.5 66.0 196 570 A K H X S+ 0 0 131 -4,-1.8 4,-0.8 2,-0.2 -2,-0.2 0.873 107.3 54.5 -66.2 -33.0 24.8 21.6 64.9 197 571 A E H >< S+ 0 0 84 -4,-1.7 3,-0.7 2,-0.2 4,-0.3 0.919 111.3 43.8 -66.3 -40.3 27.2 24.7 64.8 198 572 A V H >X S+ 0 0 11 -4,-2.0 4,-2.2 1,-0.2 3,-2.0 0.892 105.8 64.0 -70.2 -36.1 29.6 22.8 62.5 199 573 A Q H 3< S+ 0 0 40 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.697 82.5 77.4 -60.2 -19.6 26.6 21.6 60.5 200 574 A Q T << S+ 0 0 156 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.803 117.1 15.8 -58.1 -28.2 25.9 25.3 59.6 201 575 A K T <4 S+ 0 0 158 -3,-2.0 2,-0.4 -4,-0.3 -2,-0.2 0.737 124.0 47.4-109.6 -34.1 28.8 24.8 57.1 202 576 A Y S < S- 0 0 56 -4,-2.2 2,-0.6 -192,-0.0 -1,-0.2 -0.880 70.2-119.4-130.4 142.1 29.5 21.1 56.7 203 577 A V - 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0 0 23 13,-2.0 4,-0.5 15,-0.3 3,-0.3 0.699 40.2-153.2 -80.8 -21.5 31.7 -1.0 70.4 229 603 A G - 0 0 35 13,-3.4 -1,-0.1 12,-0.3 14,-0.1 -0.074 28.4 -86.2 70.3-177.8 33.3 -4.4 70.8 230 604 A T S S+ 0 0 132 3,-0.1 -1,-0.2 1,-0.0 3,-0.1 0.194 113.6 67.0-111.1 11.8 31.7 -7.7 69.8 231 605 A D S S+ 0 0 158 -3,-0.3 2,-0.3 1,-0.3 -2,-0.1 0.907 102.5 26.2 -94.4 -68.0 29.9 -8.3 73.2 232 606 A V S S- 0 0 116 -4,-0.5 -1,-0.3 2,-0.0 2,-0.3 -0.833 79.2-130.0-109.2 143.4 27.2 -5.6 73.5 233 607 A A - 0 0 71 -2,-0.3 2,-0.6 -3,-0.1 -3,-0.1 -0.690 1.7-142.0-102.3 142.5 25.5 -3.9 70.6 234 608 A V 0 0 35 -2,-0.3 -9,-0.1 1,-0.1 -6,-0.0 -0.903 360.0 360.0-100.8 120.7 24.9 -0.2 69.8 235 609 A E 0 0 201 -2,-0.6 -1,-0.1 -25,-0.1 5,-0.0 0.547 360.0 360.0-109.1 360.0 21.5 0.3 68.2 236 ! 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 0.0 237 611 A A 0 0 51 0, 0.0 -13,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 159.8 24.2 5.2 65.8 238 612 A D + 0 0 71 -15,-0.9 2,-0.4 1,-0.2 -236,-0.2 0.902 360.0 12.0 -74.7 -45.3 24.4 5.2 61.9 239 613 A I E S-e 224 0A 33 -16,-2.1 -14,-2.6 -237,-0.1 2,-0.5 -0.994 70.5-153.2-131.0 144.1 27.6 3.1 61.7 240 614 A V E -e 225 0A 54 -2,-0.4 2,-0.6 -16,-0.2 -14,-0.2 -0.965 2.2-156.0-117.5 128.7 29.2 1.1 64.4 241 615 A L - 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