==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 05-OCT-12 4BDL . COMPND 2 MOLECULE: GLUTAMATE RECEPTOR, IONOTROPIC KAINATE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR N.NAYEEM,O.MAYANS,T.GREEN . 499 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22713.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 328 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 22 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 30.1 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 4 2 0 2 4 2 2 0 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 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 PARALLEL BRIDGES PER LADDER . 8 2 4 4 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 2 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 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 1 431 A R 0 0 210 0, 0.0 46,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 159.7 56.3 19.5 18.5 2 432 A S - 0 0 59 44,-0.1 46,-0.3 1,-0.1 2,-0.2 -0.390 360.0-122.5 -66.5 146.4 53.4 21.6 17.3 3 433 A L E -a 48 0A 3 44,-2.8 46,-2.4 -2,-0.1 2,-0.6 -0.617 11.9-129.7 -88.4 149.8 50.5 19.8 15.8 4 434 A I E -a 49 0A 27 -2,-0.2 77,-2.9 44,-0.2 78,-1.5 -0.903 24.7-162.1 -96.8 122.9 49.2 20.3 12.3 5 435 A V E -ab 50 82A 1 44,-2.6 46,-3.1 -2,-0.6 2,-0.3 -0.930 2.0-155.7-112.5 118.5 45.4 20.8 12.4 6 436 A T E +ab 51 83A 0 76,-2.6 78,-2.0 -2,-0.6 2,-0.3 -0.660 25.6 152.5 -89.9 145.6 43.4 20.4 9.3 7 437 A T E -a 52 0A 1 44,-1.3 46,-3.1 -2,-0.3 2,-0.3 -0.896 30.9-127.1-156.5-175.7 40.1 22.2 8.9 8 438 A I - 0 0 15 -2,-0.3 2,-0.4 76,-0.3 44,-0.0 -0.988 29.5-100.5-146.1 145.6 37.7 23.6 6.3 9 439 A L + 0 0 76 -2,-0.3 2,-0.2 44,-0.1 6,-0.2 -0.572 58.1 141.0 -70.6 124.2 36.0 27.0 5.8 10 440 A E B >> -E 14 0B 20 4,-2.3 4,-2.4 -2,-0.4 3,-1.5 -0.724 50.4 -89.5-167.0 112.2 32.4 26.7 6.9 11 441 A E T 34 S+ 0 0 106 1,-0.3 184,-0.1 2,-0.2 183,-0.1 -0.433 102.4 1.6 -69.1 139.7 30.3 29.4 8.7 12 442 A P T 34 S+ 0 0 2 0, 0.0 20,-2.5 0, 0.0 -1,-0.3 -0.843 128.0 59.7-100.3 23.3 30.1 29.7 11.7 13 443 A Y T <4 S+ 0 0 0 -3,-1.5 20,-1.9 1,-0.3 21,-0.9 0.910 121.7 3.9 -75.0 -46.0 32.5 26.8 12.5 14 444 A V B < S+E 10 0B 1 -4,-2.4 -4,-2.3 19,-0.2 2,-0.3 -0.965 77.0 151.4-146.8 121.8 35.6 28.2 10.7 15 445 A L E -F 30 0C 22 15,-2.7 15,-2.4 -2,-0.3 2,-0.5 -0.977 48.8 -94.4-146.7 159.4 35.8 31.6 9.0 16 446 A F E -F 29 0C 101 -2,-0.3 13,-0.2 13,-0.2 2,-0.2 -0.666 45.2-121.6 -73.0 126.0 38.3 34.2 8.1 17 447 A K - 0 0 102 11,-2.8 2,-0.2 -2,-0.5 6,-0.1 -0.494 28.4-124.8 -66.6 133.1 38.3 36.9 10.7 18 448 A K + 0 0 171 -2,-0.2 2,-0.3 4,-0.0 3,-0.1 -0.593 45.1 145.0 -80.8 143.1 37.5 40.3 9.1 19 449 A S - 0 0 60 -2,-0.2 4,-0.1 1,-0.1 0, 0.0 -0.929 54.8-125.0-171.1 153.8 39.9 43.2 9.6 20 450 A D S S+ 0 0 142 -2,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.820 99.4 61.7 -71.5 -31.5 41.3 46.2 7.8 21 451 A K S S- 0 0 124 -3,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.780 98.9-101.6 -99.3 141.1 44.8 45.0 8.4 22 452 A P - 0 0 94 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.294 35.4-148.7 -60.3 138.7 46.1 41.7 7.0 23 453 A L - 0 0 53 -6,-0.1 2,-0.3 -4,-0.1 5,-0.1 -0.784 9.6-153.5-109.7 156.4 46.3 38.8 9.5 24 454 A Y > - 0 0 166 -2,-0.3 3,-1.5 0, 0.0 4,-0.2 -0.912 46.3 -17.7-130.6 155.4 48.8 35.9 9.5 25 455 A G G > S- 0 0 37 -2,-0.3 3,-1.6 1,-0.3 4,-0.2 -0.201 126.3 -7.6 57.4-138.8 49.0 32.3 10.6 26 456 A N G > S+ 0 0 53 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.727 124.9 74.6 -65.3 -21.2 46.4 31.1 13.2 27 457 A D G < S+ 0 0 117 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.703 81.3 71.4 -64.4 -20.7 45.2 34.7 13.6 28 458 A R G < S+ 0 0 86 -3,-1.6 -11,-2.8 -4,-0.2 2,-0.3 0.769 93.0 67.4 -66.4 -24.2 43.4 34.5 10.2 29 459 A F E < +F 16 0C 10 -3,-1.5 2,-0.3 -13,-0.2 -13,-0.2 -0.765 49.8 157.3-111.9 143.7 40.8 32.1 11.6 30 460 A E E +F 15 0C 47 -15,-2.4 -15,-2.7 -2,-0.3 2,-0.2 -0.935 21.8 96.3-145.1 170.8 37.9 32.3 14.0 31 461 A G S > S- 0 0 0 -2,-0.3 4,-2.6 -17,-0.2 3,-0.4 -0.705 81.3 -54.3 136.0 175.8 34.6 30.4 14.7 32 462 A Y H > S+ 0 0 1 -20,-2.5 4,-2.3 1,-0.2 -19,-0.2 0.897 132.5 45.8 -51.9 -46.4 33.1 27.7 16.8 33 463 A C H > S+ 0 0 0 -20,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.785 110.5 53.4 -74.8 -23.6 35.7 25.1 15.8 34 464 A I H > S+ 0 0 8 -21,-0.9 4,-2.6 -3,-0.4 -1,-0.2 0.894 109.6 48.0 -75.1 -39.7 38.6 27.5 16.3 35 465 A D H X S+ 0 0 20 -4,-2.6 4,-2.6 -22,-0.2 -2,-0.2 0.918 111.7 52.1 -61.6 -42.0 37.3 28.2 19.9 36 466 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.3 -2,-0.2 0.939 109.6 48.1 -57.9 -49.1 37.1 24.4 20.3 37 467 A L H X S+ 0 0 2 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.921 111.1 51.0 -58.7 -45.5 40.7 24.0 19.1 38 468 A R H X S+ 0 0 147 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.910 111.4 47.6 -58.2 -42.2 41.8 26.7 21.5 39 469 A E H X S+ 0 0 47 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.906 112.7 48.8 -67.7 -40.5 40.0 25.1 24.4 40 470 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.905 109.0 53.8 -62.6 -43.3 41.5 21.7 23.5 41 471 A S H X>S+ 0 0 23 -4,-2.9 4,-2.0 1,-0.2 5,-0.6 0.886 108.0 50.3 -58.0 -42.0 45.0 23.2 23.2 42 472 A T H <5S+ 0 0 111 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.940 114.3 43.6 -61.7 -49.0 44.6 24.7 26.8 43 473 A I H <5S+ 0 0 53 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.917 124.0 33.4 -63.2 -45.3 43.6 21.3 28.3 44 474 A L H <5S- 0 0 50 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.646 101.5-128.0 -94.3 -17.0 46.1 19.1 26.5 45 475 A G T <5 + 0 0 65 -4,-2.0 2,-0.3 -5,-0.3 -3,-0.2 0.742 56.4 137.2 80.7 25.3 48.9 21.6 26.4 46 476 A F < - 0 0 11 -5,-0.6 2,-0.3 -6,-0.2 -1,-0.2 -0.693 43.9-142.5-100.5 155.6 49.8 21.5 22.7 47 477 A T - 0 0 90 -2,-0.3 -44,-2.8 -46,-0.2 2,-0.3 -0.751 29.2-175.7-103.3 164.6 50.7 24.3 20.2 48 478 A Y E -a 3 0A 38 -46,-0.3 2,-0.4 -2,-0.3 -44,-0.2 -0.978 30.4-133.3-156.3 162.0 49.4 24.0 16.6 49 479 A E E -a 4 0A 82 -46,-2.4 -44,-2.6 -2,-0.3 2,-0.4 -0.996 26.8-139.3-121.4 123.5 49.3 25.4 13.1 50 480 A I E -a 5 0A 2 -2,-0.4 2,-0.4 -46,-0.2 -44,-0.2 -0.684 23.8-178.9 -80.4 129.2 45.9 25.6 11.5 51 481 A R E -a 6 0A 115 -46,-3.1 -44,-1.3 -2,-0.4 2,-0.1 -0.976 26.5-127.9-130.6 122.4 45.9 24.6 7.8 52 482 A L E -a 7 0A 55 -2,-0.4 -44,-0.2 -46,-0.2 -46,-0.1 -0.441 46.7 -91.2 -62.7 134.8 42.9 24.6 5.5 53 483 A V > - 0 0 8 -46,-3.1 3,-1.4 1,-0.1 -1,-0.1 -0.243 36.6-131.8 -51.4 127.9 42.5 21.2 3.8 54 484 A E T 3 S+ 0 0 177 1,-0.3 -1,-0.1 16,-0.1 -2,-0.1 0.858 102.2 40.9 -57.6 -41.5 44.4 21.5 0.6 55 485 A D T 3 S- 0 0 77 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.466 104.6-124.9 -90.1 -0.5 41.7 20.0 -1.7 56 486 A G < + 0 0 47 -3,-1.4 2,-0.3 1,-0.2 -2,-0.1 0.661 67.0 125.1 70.3 19.1 38.8 21.8 0.0 57 487 A K - 0 0 89 1,-0.1 14,-1.3 3,-0.0 -1,-0.2 -0.781 61.8-140.2-113.9 153.8 36.9 18.6 0.7 58 488 A Y - 0 0 22 -2,-0.3 14,-1.2 12,-0.2 13,-0.7 0.953 65.2 -86.7 -69.0 -53.8 35.4 17.0 3.8 59 489 A G + 0 0 3 78,-0.3 2,-0.3 11,-0.2 11,-0.2 0.017 53.9 165.4 140.0 110.0 36.4 13.5 2.8 60 490 A A - 0 0 17 7,-0.1 9,-1.2 -2,-0.0 2,-0.5 -0.929 36.6-107.8-137.6 166.8 34.7 10.8 0.7 61 491 A Q B -G 68 0D 104 -2,-0.3 7,-0.2 7,-0.2 2,-0.1 -0.826 35.0-116.4 -97.7 127.6 35.8 7.6 -0.9 62 492 A D > - 0 0 72 5,-3.1 4,-1.7 -2,-0.5 -1,-0.0 -0.434 19.3-140.3 -59.6 130.8 36.1 7.5 -4.7 63 493 A D T 4 S+ 0 0 129 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.534 96.0 42.9 -78.3 -3.3 33.5 5.1 -6.0 64 494 A V T 4 S+ 0 0 128 3,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.807 131.2 14.8-103.6 -43.8 35.9 3.7 -8.6 65 495 A N T 4 S- 0 0 103 2,-0.1 -2,-0.2 0, 0.0 -3,-0.0 0.443 91.4-127.6-115.5 -3.3 39.3 3.3 -6.9 66 496 A G < + 0 0 27 -4,-1.7 2,-0.1 1,-0.2 -3,-0.1 0.469 55.6 147.9 76.6 2.4 38.2 3.6 -3.2 67 497 A Q - 0 0 99 -6,-0.1 -5,-3.1 1,-0.1 -1,-0.2 -0.441 42.0-128.5 -72.6 144.5 40.8 6.3 -2.4 68 498 A W B -G 61 0D 21 -7,-0.2 2,-0.2 -2,-0.1 -7,-0.2 -0.556 24.6-175.6 -88.4 153.6 39.9 8.9 0.2 69 499 A N > + 0 0 53 -9,-1.2 4,-1.8 -2,-0.2 3,-0.4 -0.655 41.8 32.2-128.5-170.9 40.2 12.7 -0.2 70 500 A G H > S- 0 0 1 1,-0.2 4,-1.9 2,-0.2 -12,-0.2 -0.051 115.9 -24.2 65.8-156.1 39.7 15.7 1.9 71 501 A M H > S+ 0 0 0 -14,-1.3 4,-1.9 -13,-0.7 -1,-0.2 0.858 136.1 59.5 -65.2 -33.7 40.4 16.0 5.6 72 502 A V H > S+ 0 0 0 -14,-1.2 4,-2.4 -3,-0.4 -1,-0.2 0.947 107.0 45.7 -58.6 -48.9 39.9 12.3 6.0 73 503 A R H X S+ 0 0 74 -4,-1.8 4,-2.5 1,-0.2 6,-0.2 0.854 107.0 58.3 -63.1 -36.6 42.8 11.6 3.6 74 504 A E H <>S+ 0 0 31 -4,-1.9 5,-2.7 1,-0.2 6,-1.2 0.890 110.2 44.4 -63.5 -35.2 45.0 14.2 5.3 75 505 A L H ><5S+ 0 0 0 -4,-1.9 3,-1.6 -3,-0.2 -2,-0.2 0.918 110.5 53.2 -71.5 -44.9 44.7 12.2 8.5 76 506 A I H 3<5S+ 0 0 56 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.915 113.2 44.9 -56.2 -41.2 45.2 8.8 6.9 77 507 A D T 3<5S- 0 0 76 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.409 112.6-118.7 -86.2 4.9 48.4 10.1 5.3 78 508 A H T < 5S+ 0 0 137 -3,-1.6 -3,-0.2 2,-0.2 -4,-0.1 0.783 76.1 129.9 59.1 31.0 49.6 11.7 8.5 79 509 A K S - 0 0 12 -2,-0.7 4,-2.5 1,-0.1 5,-0.2 -0.894 45.8-117.5-129.3 155.0 30.2 8.3 10.0 91 521 A Y H > S+ 0 0 50 391,-0.3 4,-0.9 -2,-0.3 392,-0.1 0.919 114.8 46.9 -48.8 -52.6 30.4 4.4 9.7 92 522 A V H 4 S+ 0 0 34 1,-0.2 3,-0.4 2,-0.2 4,-0.3 0.879 114.0 46.4 -68.7 -36.6 32.6 4.6 6.6 93 523 A R H >> S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 3,-1.8 0.877 104.5 60.7 -70.1 -36.9 35.0 7.2 7.9 94 524 A E H 3< S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.716 94.3 66.4 -66.5 -17.5 35.4 5.5 11.2 95 525 A K T 3< S+ 0 0 99 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.726 115.0 26.4 -70.6 -20.9 36.8 2.5 9.3 96 526 A V T <4 S+ 0 0 46 -3,-1.8 124,-0.6 -4,-0.3 2,-0.3 0.637 129.2 21.3-118.1 -21.6 39.8 4.6 8.2 97 527 A I E < S-D 219 0A 0 -4,-2.2 2,-0.4 122,-0.2 -1,-0.2 -0.851 77.1-111.1-137.1 173.1 40.3 7.2 10.9 98 528 A D E -D 218 0A 6 120,-2.8 120,-2.7 -2,-0.3 2,-0.4 -0.911 23.4-155.3-111.5 138.3 39.3 7.6 14.6 99 529 A F E -D 217 0A 10 -2,-0.4 118,-0.2 118,-0.2 130,-0.0 -0.878 12.6-131.0-107.7 145.9 36.7 10.1 15.9 100 530 A S - 0 0 10 116,-2.2 3,-0.1 -2,-0.4 126,-0.1 -0.194 50.8 -67.1 -69.8 173.9 36.5 11.6 19.4 101 531 A A S S- 0 0 16 1,-0.1 115,-0.5 114,-0.1 -1,-0.2 -0.324 74.4 -87.0 -54.6 150.3 33.3 11.7 21.3 102 532 A P - 0 0 16 0, 0.0 113,-0.3 0, 0.0 -1,-0.1 -0.383 32.0-165.6 -71.0 143.7 31.0 14.1 19.6 103 533 A F S S+ 0 0 10 111,-2.4 2,-0.3 1,-0.3 112,-0.1 0.526 79.7 22.7 -98.7 -8.5 31.1 17.8 20.4 104 534 A M E -I 214 0E 13 110,-0.9 110,-2.1 2,-0.0 2,-0.4 -0.979 68.7-146.7-154.9 143.2 27.8 18.5 18.7 105 535 A T E +I 213 0E 56 -2,-0.3 2,-0.2 108,-0.2 108,-0.2 -0.906 34.1 137.4-113.6 144.9 24.8 16.5 17.8 106 536 A L E -I 212 0E 4 106,-2.8 106,-2.4 -2,-0.4 2,-0.3 -0.844 29.1-144.8-159.6-168.0 22.7 17.1 14.7 107 537 A G - 0 0 0 -2,-0.2 82,-2.9 104,-0.2 2,-0.2 -0.976 34.2 -79.0-166.6 167.5 20.9 15.6 11.8 108 538 A I E +J 188 0F 0 -2,-0.3 101,-3.1 80,-0.2 102,-0.5 -0.505 56.1 154.6 -71.3 136.8 20.0 16.0 8.1 109 539 A S E -J 187 0F 0 78,-2.9 78,-2.4 99,-0.2 2,-0.4 -0.825 39.7 -89.5-146.6-168.4 17.1 18.4 7.5 110 540 A I E -JK 186 205F 2 95,-0.8 95,-2.5 97,-0.3 2,-0.5 -0.926 21.5-159.1-117.1 130.6 15.7 20.7 4.8 111 541 A L E +JK 185 204F 0 74,-3.0 74,-2.6 -2,-0.4 2,-0.3 -0.919 34.4 136.3-103.3 130.1 16.4 24.3 4.1 112 542 A Y E - K 0 203F 7 91,-2.2 91,-2.9 -2,-0.5 2,-0.1 -0.916 53.5 -71.9-158.8 178.0 13.8 26.2 2.0 113 543 A R E - K 0 202F 97 -2,-0.3 3,-0.4 89,-0.2 89,-0.2 -0.467 51.8-108.2 -80.6 154.7 11.8 29.4 1.8 114 544 A K S S+ 0 0 116 87,-2.1 -1,-0.1 1,-0.2 89,-0.0 -0.273 89.5 40.3 -74.4 165.2 9.0 30.2 4.2 115 555 A G S S+ 0 0 88 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.760 81.3 120.4 73.3 30.0 5.3 30.2 3.5 116 566 A T S S- 0 0 43 -3,-0.4 -1,-0.2 2,-0.2 -4,-0.0 -0.733 71.0-117.7-117.1 169.0 5.0 27.1 1.3 117 667 A P S S+ 0 0 123 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 0.635 77.3 115.4 -79.4 -13.7 2.9 23.9 1.6 118 668 A I + 0 0 17 1,-0.2 -2,-0.2 5,-0.1 88,-0.1 -0.402 28.7 158.0 -62.6 121.0 6.1 21.8 1.7 119 669 A D + 0 0 114 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.430 56.1 12.6-125.3 -4.2 6.2 20.2 5.2 120 670 A S S > S- 0 0 42 86,-0.1 4,-1.1 1,-0.1 -1,-0.2 -0.980 76.8 -96.6-163.4 169.6 8.5 17.1 4.8 121 671 A A H > S+ 0 0 8 -2,-0.3 4,-3.1 1,-0.2 3,-0.4 0.876 122.3 59.2 -62.4 -38.5 10.9 15.2 2.6 122 672 A D H > S+ 0 0 77 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.885 100.0 57.1 -56.6 -39.8 8.0 13.1 1.4 123 673 A D H 4 S+ 0 0 36 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.857 112.9 40.0 -60.9 -35.3 6.5 16.3 0.1 124 674 A L H >< S+ 0 0 0 -4,-1.1 3,-1.7 -3,-0.4 -2,-0.2 0.879 109.6 59.9 -76.4 -40.9 9.6 17.0 -1.9 125 675 A A H 3< S+ 0 0 4 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.791 99.7 56.8 -60.0 -30.2 10.0 13.4 -3.0 126 676 A K T 3< S+ 0 0 141 -4,-1.5 -1,-0.3 -5,-0.2 2,-0.3 0.258 108.6 43.8 -94.0 13.0 6.7 13.2 -4.7 127 677 A Q < - 0 0 43 -3,-1.7 -3,-0.0 3,-0.1 0, 0.0 -0.860 52.6-157.8-143.1-179.9 7.2 16.2 -7.1 128 678 A T S S+ 0 0 89 -2,-0.3 -1,-0.1 3,-0.1 4,-0.1 0.377 74.4 87.4-140.6 -5.8 9.8 17.7 -9.5 129 679 A K S S+ 0 0 173 1,-0.1 2,-0.7 2,-0.1 53,-0.1 0.942 89.9 53.1 -63.8 -50.2 8.8 21.4 -9.7 130 680 A I S S- 0 0 15 -6,-0.1 53,-0.2 53,-0.1 2,-0.2 -0.807 89.0-145.9 -85.5 116.6 10.8 22.3 -6.7 131 681 A E E -l 183 0F 59 51,-1.9 53,-2.5 -2,-0.7 2,-0.3 -0.511 18.0-171.2 -79.4 154.3 14.3 21.0 -7.2 132 682 A Y E +l 184 0F 1 51,-0.2 2,-0.3 -2,-0.2 53,-0.2 -0.978 13.0 147.2-144.9 157.9 16.3 19.7 -4.3 133 683 A G E -l 185 0F 0 51,-1.4 53,-3.3 -2,-0.3 2,-0.3 -0.886 25.0-134.8-167.5-165.7 19.9 18.6 -3.6 134 684 A A - 0 0 0 32,-0.3 34,-2.2 -2,-0.3 2,-0.3 -0.907 47.7 -61.3-157.6 171.7 22.8 18.4 -1.2 135 685 A V B > -m 168 0G 8 51,-0.5 3,-1.3 -2,-0.3 6,-0.5 -0.533 65.5-107.1 -64.9 129.0 26.5 19.0 -1.0 136 686 A E T 3 S- 0 0 62 32,-3.4 -1,-0.1 -2,-0.3 3,-0.1 -0.399 94.3 -1.8 -60.1 129.3 28.2 16.6 -3.4 137 687 A D T 3 S+ 0 0 75 1,-0.2 -78,-0.3 -2,-0.1 -1,-0.2 0.717 100.6 126.4 65.2 25.1 30.0 13.7 -1.8 138 688 A G S <> S- 0 0 2 -3,-1.3 4,-2.3 -80,-0.1 -1,-0.2 -0.448 79.6 -90.9 -99.8-178.1 29.3 14.7 1.8 139 689 A A H > S+ 0 0 7 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.853 125.6 55.0 -62.5 -35.0 27.7 12.8 4.7 140 690 A T H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.964 109.2 44.8 -64.8 -51.3 24.3 14.1 3.7 141 691 A M H > S+ 0 0 8 -6,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.893 111.2 55.0 -59.4 -38.6 24.5 12.9 0.1 142 692 A T H X S+ 0 0 38 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.877 100.9 58.9 -64.6 -37.6 25.9 9.5 1.3 143 693 A F H X S+ 0 0 28 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.933 110.4 42.3 -53.5 -48.6 22.9 9.0 3.6 144 694 A F H < S+ 0 0 0 -4,-1.5 12,-0.2 1,-0.2 -2,-0.2 0.881 111.1 54.8 -68.9 -38.1 20.6 9.3 0.6 145 695 A K H < S+ 0 0 100 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.852 116.4 38.1 -62.7 -34.3 22.8 7.1 -1.7 146 696 A K H < S+ 0 0 94 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.604 89.2 118.2 -92.5 -15.8 22.7 4.3 0.9 147 697 A S < - 0 0 19 -4,-1.1 9,-0.1 -5,-0.2 340,-0.1 -0.262 43.3-168.2 -65.9 137.6 19.2 4.5 2.2 148 698 A K + 0 0 199 339,-0.1 2,-0.4 4,-0.0 -1,-0.1 0.377 56.3 113.8 -98.9 2.0 16.7 1.6 1.7 149 699 A I S > S- 0 0 89 1,-0.1 4,-3.1 -5,-0.0 5,-0.3 -0.604 71.4-132.2 -74.9 129.9 13.8 3.8 2.7 150 700 A S H > S+ 0 0 102 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.888 103.9 48.0 -49.7 -51.3 11.4 4.3 -0.2 151 701 A T H > S+ 0 0 28 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.925 115.8 43.5 -57.1 -48.7 11.2 8.1 0.2 152 702 A Y H > S+ 0 0 44 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.862 111.7 52.7 -71.9 -34.9 14.9 8.6 0.5 153 703 A D H X S+ 0 0 87 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.891 108.9 51.4 -64.7 -37.5 15.8 6.2 -2.4 154 704 A K H X S+ 0 0 111 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.903 109.8 49.6 -65.7 -39.4 13.4 8.2 -4.6 155 705 A M H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.896 109.7 51.2 -65.7 -38.8 15.1 11.4 -3.6 156 706 A W H X S+ 0 0 44 -4,-2.3 4,-3.0 -12,-0.2 5,-0.4 0.909 106.4 54.2 -63.3 -41.8 18.5 9.8 -4.4 157 707 A A H X S+ 0 0 53 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.927 112.3 45.5 -56.0 -43.8 17.2 8.8 -7.8 158 708 A F H X S+ 0 0 13 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.937 116.3 43.3 -64.5 -49.2 16.2 12.4 -8.4 159 709 A M H < S+ 0 0 0 -4,-2.7 7,-0.3 1,-0.2 8,-0.2 0.896 113.9 48.8 -69.1 -42.2 19.5 14.0 -7.1 160 710 A S H >< S+ 0 0 37 -4,-3.0 3,-1.5 1,-0.2 -1,-0.2 0.901 109.7 51.4 -67.7 -39.4 21.8 11.6 -8.8 161 711 A S H 3< S+ 0 0 82 -4,-1.7 -1,-0.2 -5,-0.4 -2,-0.2 0.768 119.2 38.4 -69.0 -22.6 20.2 11.9 -12.2 162 712 A R T >X>S+ 0 0 80 -4,-1.1 4,-2.7 -3,-0.2 3,-2.0 -0.008 78.2 132.3-111.0 26.4 20.4 15.7 -11.8 163 713 A R H <>5 + 0 0 125 -3,-1.5 4,-1.0 1,-0.3 -1,-0.1 0.818 66.5 58.7 -51.4 -38.3 23.9 15.6 -10.2 164 714 A Q H 345S+ 0 0 170 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.785 121.2 24.2 -62.2 -28.2 25.3 18.3 -12.5 165 715 A S H <45S+ 0 0 50 -3,-2.0 -2,-0.2 -6,-0.2 -1,-0.2 0.794 126.9 36.1-110.9 -38.3 22.6 20.8 -11.4 166 716 A V H <5S+ 0 0 0 -4,-2.7 2,-0.5 -7,-0.3 -32,-0.3 0.689 97.4 78.6 -99.4 -20.3 21.3 20.0 -8.0 167 717 A L S < S- 0 0 39 1,-0.1 4,-2.1 -36,-0.1 5,-0.2 -0.984 72.4 -99.7-160.3 164.3 29.4 23.6 -0.6 171 721 A N H > S+ 0 0 1 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.877 121.4 58.5 -55.7 -40.1 26.8 24.7 1.9 172 722 A E H > S+ 0 0 129 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.937 106.6 46.3 -57.4 -46.2 27.4 28.2 0.6 173 723 A E H > S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.885 111.6 51.9 -66.2 -38.8 26.5 27.2 -2.9 174 724 A G H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.904 112.4 44.9 -62.2 -43.5 23.4 25.3 -1.7 175 725 A I H X S+ 0 0 28 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.949 111.1 53.6 -64.1 -48.3 22.2 28.3 0.2 176 726 A Q H < S+ 0 0 100 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.815 109.9 49.8 -54.7 -32.7 23.0 30.6 -2.7 177 727 A R H >X S+ 0 0 54 -4,-1.7 4,-1.7 2,-0.2 3,-0.9 0.874 106.4 53.0 -75.9 -39.0 20.8 28.3 -4.8 178 728 A V H 3< S+ 0 0 4 -4,-2.0 5,-0.4 1,-0.2 -2,-0.2 0.870 111.4 49.0 -60.6 -34.5 17.9 28.3 -2.4 179 729 A L T 3< S+ 0 0 78 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.521 118.1 37.1 -84.9 -6.9 18.0 32.1 -2.6 180 730 A T T <4 S+ 0 0 119 -3,-0.9 2,-0.3 -4,-0.3 -2,-0.2 0.534 120.6 19.0-124.2 -10.9 18.1 32.4 -6.4 181 731 A S S < S- 0 0 43 -4,-1.7 2,-1.7 2,-0.1 -1,-0.2 -0.916 93.5 -77.3-148.7 175.4 15.8 29.6 -7.7 182 732 A D S S+ 0 0 60 -2,-0.3 -51,-1.9 -53,-0.1 2,-0.4 -0.595 80.6 134.9 -80.0 86.9 13.0 27.3 -6.6 183 733 A Y E - l 0 131F 0 -2,-1.7 2,-0.4 -5,-0.4 -51,-0.2 -0.996 44.6-155.4-145.1 134.2 15.3 24.9 -4.7 184 734 A A E - l 0 132F 0 -53,-2.5 -51,-1.4 -2,-0.4 2,-0.5 -0.947 19.3-143.7-114.5 138.9 15.3 23.2 -1.4 185 735 A F E -Jl 111 133F 0 -74,-2.6 -74,-3.0 -2,-0.4 2,-0.6 -0.878 3.8-146.4-114.8 122.0 18.6 22.1 0.2 186 736 A L E +J 110 0F 0 -53,-3.3 -51,-0.5 -2,-0.5 2,-0.3 -0.763 45.6 139.2 -82.8 120.5 19.2 19.0 2.2 187 737 A M E -J 109 0F 0 -78,-2.4 -78,-2.9 -2,-0.6 2,-0.2 -0.940 55.1 -64.3-158.0 173.9 21.8 19.9 4.8 188 738 A E E > -J 108 0F 2 -2,-0.3 4,-2.3 -80,-0.2 3,-0.5 -0.466 39.5-132.1 -77.8 139.1 22.8 19.6 8.5 189 739 A S H > S+ 0 0 15 -82,-2.9 4,-2.4 1,-0.3 -1,-0.1 0.782 103.4 56.7 -62.1 -35.3 20.5 21.0 11.1 190 740 A T H > S+ 0 0 2 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.912 111.3 44.4 -61.0 -43.3 23.1 22.9 13.1 191 741 A T H > S+ 0 0 3 -3,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.897 110.3 54.6 -71.6 -38.1 24.1 24.7 9.9 192 742 A I H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.926 104.2 56.2 -56.5 -44.4 20.5 25.4 9.0 193 743 A E H X S+ 0 0 66 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.866 108.6 46.2 -58.5 -39.8 20.0 26.9 12.4 194 744 A F H < S+ 0 0 24 -4,-1.3 4,-0.4 2,-0.2 -1,-0.2 0.917 113.7 49.4 -66.6 -44.4 22.8 29.4 11.8 195 745 A V H >X S+ 0 0 5 -4,-2.3 4,-1.2 1,-0.2 3,-1.0 0.890 110.0 49.5 -60.9 -43.2 21.4 30.2 8.3 196 746 A T H 3< S+ 0 0 37 -4,-2.9 -1,-0.2 1,-0.3 6,-0.2 0.743 103.1 59.5 -76.2 -22.8 17.9 30.8 9.4 197 747 A Q T 3< S+ 0 0 97 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.630 116.2 36.3 -76.0 -11.4 18.8 33.1 12.2 198 748 A R T <4 S+ 0 0 115 -3,-1.0 2,-0.4 -4,-0.4 -2,-0.2 0.516 117.8 50.4-117.9 -12.7 20.4 35.3 9.6 199 749 A N >< - 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0 0 41 -3,-1.4 0, 0.0 3,-0.1 0, 0.0 -0.857 53.4-160.4-141.9 175.8 12.7 26.4 48.4 377 678 B T S S+ 0 0 89 -2,-0.3 4,-0.1 3,-0.1 -1,-0.1 0.339 72.7 87.4-141.7 1.2 12.7 23.4 50.7 378 679 B K S S+ 0 0 179 1,-0.1 2,-0.7 2,-0.1 53,-0.1 0.924 87.4 56.7 -69.5 -46.1 9.1 22.3 51.1 379 680 B I S S- 0 0 14 -6,-0.1 53,-0.2 53,-0.0 -1,-0.1 -0.802 88.7-141.4 -88.2 116.1 9.2 20.1 48.0 380 681 B E E -y 432 0M 63 51,-1.4 53,-2.4 -2,-0.7 2,-0.3 -0.440 23.0-179.1 -75.3 152.0 12.0 17.6 48.4 381 682 B Y E +y 433 0M 2 51,-0.2 2,-0.3 -2,-0.1 53,-0.2 -0.988 9.9 143.7-148.7 156.6 14.2 16.6 45.5 382 683 B G E -y 434 0M 0 51,-1.5 53,-3.0 -2,-0.3 2,-0.3 -0.873 27.0-129.2-167.1-161.2 17.1 14.3 44.8 383 684 B A - 0 0 0 -2,-0.3 34,-2.0 32,-0.2 2,-0.3 -0.900 46.1 -61.5-157.4 173.2 18.8 11.9 42.4 384 685 B V B > -z 417 0N 6 51,-0.5 3,-1.3 -2,-0.3 6,-0.5 -0.556 64.2-107.9 -66.8 128.1 20.2 8.4 42.2 385 686 B E T 3 S- 0 0 72 32,-3.2 -1,-0.1 -2,-0.3 3,-0.1 -0.398 92.6 -2.9 -60.8 128.2 23.1 8.1 44.6 386 687 B D T 3 S+ 0 0 68 1,-0.2 -78,-0.3 -2,-0.1 -1,-0.2 0.630 100.7 122.3 70.3 18.7 26.5 8.0 43.0 387 688 B G S <> S- 0 0 2 -3,-1.3 4,-2.2 -80,-0.1 -1,-0.2 -0.419 82.0 -87.4 -98.5-178.2 25.4 8.1 39.4 388 689 B A H > S+ 0 0 9 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.805 125.0 55.2 -60.1 -31.5 26.3 10.6 36.7 389 690 B T H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.961 108.8 45.3 -69.4 -49.8 23.4 12.9 37.7 390 691 B M H > S+ 0 0 3 -6,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.917 111.4 54.8 -58.2 -42.6 24.5 13.2 41.3 391 692 B T H X S+ 0 0 48 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.878 101.5 58.2 -60.3 -40.5 28.1 13.8 40.1 392 693 B F H X S+ 0 0 37 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.933 110.5 43.2 -51.3 -48.0 26.9 16.7 37.9 393 694 B F H >< S+ 0 0 0 -4,-1.6 3,-0.5 1,-0.2 12,-0.3 0.890 110.4 55.3 -70.3 -38.8 25.5 18.4 41.0 394 695 B K H 3< S+ 0 0 80 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.828 116.1 36.4 -60.0 -36.0 28.5 17.6 43.1 395 696 B K H 3< S+ 0 0 146 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.453 89.5 119.5-100.6 -2.5 31.0 19.2 40.7 396 697 B S << - 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