==== 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 TRANSFERASE 20-MAY-07 2V0W . COMPND 2 MOLECULE: NPH1-1; . SOURCE 2 ORGANISM_SCIENTIFIC: AVENA SATIVA; . AUTHOR A.S.HALAVATY,K.MOFFAT . 146 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8609.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 97 66.4 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 . 31 21.2 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 . 2 1.4 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 . 7 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 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 . 0 0 1 1 0 0 0 1 0 1 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 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 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 1 401 A G 0 0 110 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-152.0 6.5 -13.3 21.3 2 402 A E + 0 0 125 1,-0.2 41,-0.4 2,-0.1 40,-0.2 -0.366 360.0 24.8 -79.4 152.0 6.9 -9.7 22.1 3 403 A F S S- 0 0 107 39,-0.1 -1,-0.2 1,-0.1 39,-0.1 0.998 80.6-144.5 55.7 71.2 5.6 -6.8 20.0 4 404 A L - 0 0 147 1,-0.1 -1,-0.1 -3,-0.1 -2,-0.1 -0.373 32.7 -90.1 -55.9 139.6 2.8 -8.6 18.2 5 405 A A - 0 0 30 4,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.258 37.2-135.8 -58.3 129.8 2.5 -7.3 14.7 6 406 A T > - 0 0 56 -3,-0.1 4,-0.8 1,-0.1 -1,-0.1 -0.393 33.6-100.0 -71.9 168.5 0.2 -4.3 14.2 7 407 A T T >4 S+ 0 0 115 1,-0.2 3,-1.0 2,-0.2 4,-0.5 0.906 126.5 55.8 -59.1 -38.9 -2.1 -4.5 11.2 8 408 A L G >4 S+ 0 0 16 1,-0.2 3,-1.6 2,-0.2 -1,-0.2 0.933 104.8 51.6 -53.0 -47.0 0.3 -2.2 9.4 9 409 A E G 34 S+ 0 0 6 1,-0.3 23,-2.6 22,-0.1 24,-0.3 0.583 101.8 61.0 -72.4 -12.9 3.2 -4.6 10.0 10 410 A R G << S+ 0 0 163 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.500 71.3 121.8 -91.6 -6.5 1.1 -7.5 8.5 11 411 A I S < S- 0 0 58 -3,-1.6 2,-2.4 -4,-0.5 22,-0.4 -0.367 78.6-116.9 -51.0 128.7 0.9 -5.7 5.1 12 412 A E S S+ 0 0 182 20,-0.1 2,-0.3 19,-0.1 -1,-0.1 -0.296 82.7 93.9 -81.5 57.2 2.6 -8.3 2.9 13 413 A K S S- 0 0 70 -2,-2.4 2,-0.8 -4,-0.1 20,-0.5 -0.969 80.1-110.2-142.6 153.7 5.5 -6.2 1.9 14 414 A N + 0 0 18 -2,-0.3 99,-1.5 99,-0.2 2,-0.3 -0.812 62.4 125.3 -91.2 108.0 9.0 -5.7 3.2 15 415 A F E -A 112 0A 0 -2,-0.8 16,-2.6 97,-0.2 2,-0.3 -0.979 38.6-156.8-152.8 164.1 9.4 -2.3 4.9 16 416 A V E -AB 111 30A 5 95,-2.1 95,-2.6 -2,-0.3 2,-0.4 -0.921 10.7-147.6-135.1 158.8 10.3 -0.5 8.1 17 417 A I E -AB 110 29A 0 12,-2.4 11,-3.0 -2,-0.3 12,-1.7 -0.997 14.6-165.4-124.3 136.9 9.3 2.9 9.4 18 418 A T E -AB 109 27A 13 91,-2.4 91,-1.9 -2,-0.4 9,-0.2 -0.835 16.9-137.0-118.9 159.6 11.7 5.0 11.5 19 419 A D > - 0 0 33 7,-1.7 3,-1.8 -2,-0.3 6,-0.2 -0.928 8.6-165.0-116.6 102.7 11.0 8.1 13.6 20 420 A P T 3 S+ 0 0 45 0, 0.0 5,-0.3 0, 0.0 4,-0.2 0.590 85.9 67.8 -68.4 -7.3 13.7 10.7 13.1 21 421 A R T 3 S+ 0 0 219 86,-0.4 87,-0.1 5,-0.1 3,-0.1 0.664 86.0 80.0 -77.6 -25.0 12.6 12.5 16.3 22 422 A L S X S- 0 0 87 -3,-1.8 3,-1.4 4,-0.1 2,-0.2 -0.432 107.0 -84.9 -81.7 120.0 13.8 9.6 18.3 23 423 A P T 3 S+ 0 0 128 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.587 116.1 7.8 -9.6 109.2 18.0 9.5 19.1 24 424 A D T 3 S- 0 0 91 -2,-0.2 -3,-0.1 1,-0.2 -2,-0.0 0.620 114.4 -90.8 78.5 23.9 19.6 7.9 16.0 25 425 A N < - 0 0 22 -3,-1.4 25,-0.4 -5,-0.3 -1,-0.2 0.895 63.5-163.6 48.4 59.5 16.4 7.6 13.7 26 426 A P - 0 0 5 0, 0.0 -7,-1.7 0, 0.0 23,-0.3 -0.265 23.1 -97.1 -81.6 157.9 15.4 4.1 15.0 27 427 A I E +B 18 0A 0 21,-2.7 20,-3.1 18,-0.4 -9,-0.3 -0.501 40.5 168.0 -65.6 131.3 13.0 1.6 13.5 28 428 A I E + 0 0 42 -11,-3.0 2,-0.4 1,-0.4 -10,-0.2 0.557 69.6 32.5-118.3 -22.9 9.6 1.8 15.2 29 429 A F E +B 17 0A 39 -12,-1.7 -12,-2.4 16,-0.1 -1,-0.4 -0.998 63.4 176.4-133.0 137.1 7.6 -0.4 12.8 30 430 A A E -B 16 0A 0 -2,-0.4 -14,-0.2 -14,-0.2 -21,-0.1 -0.970 27.7-124.0-141.3 126.5 9.0 -3.4 10.9 31 431 A S > - 0 0 0 -16,-2.6 4,-1.9 -2,-0.4 3,-0.3 -0.257 23.0-113.5 -70.8 156.9 6.9 -5.7 8.7 32 432 A D H > S+ 0 0 61 -23,-2.6 4,-2.4 1,-0.2 5,-0.1 0.848 119.1 54.9 -54.9 -38.6 6.6 -9.5 9.2 33 433 A S H > S+ 0 0 28 -20,-0.5 4,-2.5 -22,-0.4 -1,-0.2 0.873 103.9 52.9 -66.8 -39.6 8.4 -9.9 5.9 34 434 A F H > S+ 0 0 0 -21,-0.4 4,-2.7 -3,-0.3 6,-0.3 0.923 110.0 49.6 -55.1 -45.6 11.3 -7.8 7.1 35 435 A L H X S+ 0 0 26 -4,-1.9 4,-2.0 1,-0.2 5,-0.3 0.916 111.5 49.3 -56.2 -48.1 11.5 -10.0 10.2 36 436 A Q H < S+ 0 0 156 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.904 113.6 44.3 -62.9 -43.7 11.5 -13.1 8.0 37 437 A L H < S+ 0 0 22 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.944 120.3 39.3 -64.2 -48.2 14.2 -11.9 5.7 38 438 A T H < S- 0 0 0 -4,-2.7 47,-2.9 -5,-0.2 48,-0.2 0.672 96.7-133.9 -83.7 -17.3 16.5 -10.6 8.4 39 439 A E < + 0 0 71 -4,-2.0 2,-0.2 1,-0.3 -3,-0.1 0.442 64.1 124.0 74.0 5.0 16.0 -13.4 10.9 40 440 A Y - 0 0 36 -5,-0.3 -1,-0.3 -6,-0.3 2,-0.2 -0.640 61.6-123.4 -88.5 151.1 15.5 -10.9 13.8 41 441 A S - 0 0 53 -2,-0.2 4,-0.4 -3,-0.1 3,-0.4 -0.482 30.5-107.4 -80.3 164.2 12.5 -10.9 16.0 42 442 A R S >> S+ 0 0 16 1,-0.2 4,-2.3 -40,-0.2 3,-1.5 0.904 120.6 56.6 -62.9 -39.3 10.6 -7.6 16.3 43 443 A E T 34 S+ 0 0 111 -41,-0.4 -1,-0.2 1,-0.3 -40,-0.1 0.831 105.1 53.7 -60.7 -31.6 11.8 -7.0 19.9 44 444 A E T 34 S+ 0 0 65 -3,-0.4 -1,-0.3 1,-0.1 -2,-0.2 0.535 115.0 39.2 -74.6 -12.8 15.4 -7.3 18.5 45 445 A I T X4 S+ 0 0 0 -3,-1.5 3,-1.9 -4,-0.4 -18,-0.4 0.725 87.8 100.2-108.0 -43.3 14.9 -4.6 15.8 46 446 A L T 3< S+ 0 0 40 -4,-2.3 -18,-0.2 1,-0.3 3,-0.1 -0.235 90.5 16.1 -60.1 138.1 12.7 -2.0 17.5 47 447 A G T 3 S+ 0 0 58 -20,-3.1 2,-0.4 1,-0.3 -1,-0.3 0.496 103.2 111.7 78.0 3.4 14.5 1.1 18.7 48 448 A R S < S- 0 0 102 -3,-1.9 -21,-2.7 -21,-0.3 -1,-0.3 -0.865 73.7-114.4-105.6 143.4 17.6 0.3 16.6 49 449 A N > - 0 0 28 -2,-0.4 3,-1.4 -23,-0.3 -24,-0.1 -0.555 32.3-119.0 -65.3 141.8 19.0 2.2 13.6 50 450 A C G > S+ 0 0 31 -25,-0.4 3,-2.3 1,-0.3 4,-0.2 0.602 96.5 93.4 -64.6 -12.2 18.7 -0.1 10.5 51 451 A R G > + 0 0 106 1,-0.3 3,-2.1 2,-0.2 -1,-0.3 0.666 61.0 84.3 -60.4 -14.0 22.5 0.0 10.0 52 452 A F G < S+ 0 0 33 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.1 0.705 79.6 67.7 -60.9 -14.6 22.8 -3.2 12.0 53 453 A L G < S+ 0 0 2 -3,-2.3 30,-2.8 29,-0.1 -1,-0.3 0.617 85.3 93.1 -78.2 -8.8 22.0 -5.0 8.7 54 454 A Q < + 0 0 44 -3,-2.1 28,-0.1 28,-0.2 26,-0.0 -0.434 50.2 160.7 -88.0 157.6 25.4 -3.8 7.3 55 455 A G > - 0 0 21 26,-0.4 3,-1.5 -2,-0.1 26,-0.1 -0.801 52.8 -50.9-157.7-168.6 28.6 -5.9 7.4 56 456 A P T 3 S+ 0 0 123 0, 0.0 -2,-0.0 0, 0.0 25,-0.0 0.816 128.2 42.9 -49.5 -41.4 32.1 -6.3 5.9 57 457 A E T 3 S+ 0 0 104 2,-0.1 24,-0.3 3,-0.0 2,-0.2 0.477 83.9 119.1 -90.7 -1.3 31.1 -6.5 2.2 58 458 A T S < S- 0 0 7 -3,-1.5 2,-0.6 22,-0.1 24,-0.1 -0.467 71.8-121.3 -66.6 126.5 28.7 -3.6 2.5 59 459 A D >> - 0 0 90 -2,-0.2 4,-1.4 1,-0.2 3,-0.6 -0.617 19.0-158.9 -74.7 115.0 29.9 -0.8 0.2 60 460 A R H 3> S+ 0 0 142 -2,-0.6 4,-2.1 1,-0.3 -1,-0.2 0.751 89.5 63.1 -71.3 -24.6 30.3 2.2 2.5 61 461 A A H 3> S+ 0 0 50 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.882 104.6 48.3 -62.3 -39.3 30.1 4.6 -0.4 62 462 A T H <> S+ 0 0 15 -3,-0.6 4,-1.4 2,-0.2 -2,-0.2 0.862 107.4 54.9 -69.5 -37.6 26.5 3.4 -0.9 63 463 A V H X S+ 0 0 20 -4,-1.4 4,-2.5 1,-0.2 3,-0.2 0.906 104.7 54.8 -62.8 -39.8 25.8 3.8 2.8 64 464 A R H X S+ 0 0 165 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.841 101.3 58.0 -65.4 -34.7 26.9 7.4 2.5 65 465 A K H X S+ 0 0 124 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.913 108.9 46.0 -57.3 -39.9 24.4 8.0 -0.3 66 466 A I H X S+ 0 0 21 -4,-1.4 4,-2.7 -3,-0.2 5,-0.3 0.938 111.0 52.4 -67.3 -44.4 21.6 6.9 2.2 67 467 A R H X S+ 0 0 91 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.948 110.4 48.0 -57.1 -48.0 23.0 9.1 4.9 68 468 A D H X S+ 0 0 68 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.881 109.2 52.8 -63.3 -40.0 23.0 12.1 2.6 69 469 A A H <>S+ 0 0 6 -4,-1.8 5,-2.4 2,-0.2 4,-0.4 0.934 112.2 45.7 -58.7 -49.0 19.4 11.4 1.4 70 470 A I H ><5S+ 0 0 26 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.943 112.3 51.3 -61.1 -46.9 18.2 11.3 5.1 71 471 A D H 3<5S+ 0 0 94 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.843 115.6 40.9 -58.4 -37.7 20.2 14.4 5.9 72 472 A N T 3<5S- 0 0 123 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.363 110.1-124.4 -94.3 9.5 18.6 16.2 2.9 73 473 A Q T < 5 + 0 0 91 -3,-1.5 2,-0.3 -4,-0.4 -3,-0.2 0.919 68.4 124.7 48.0 54.3 15.2 14.7 3.7 74 474 A T < - 0 0 73 -5,-2.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.859 63.1 -94.8-135.8 165.6 14.9 13.3 0.1 75 475 A E - 0 0 92 -2,-0.3 2,-0.3 22,-0.1 22,-0.2 -0.417 36.6-178.3 -79.5 159.8 14.3 9.9 -1.4 76 476 A V E -C 96 0A 29 20,-1.6 20,-2.8 -2,-0.1 2,-0.4 -0.969 15.9-159.0-150.8 150.1 17.1 7.6 -2.6 77 477 A T E +C 95 0A 54 -2,-0.3 2,-0.3 18,-0.2 18,-0.2 -0.982 29.7 149.5-131.0 123.3 17.2 4.2 -4.3 78 478 A V E -C 94 0A 15 16,-2.2 16,-2.9 -2,-0.4 2,-0.4 -0.845 38.9-126.6-141.2 168.8 20.4 2.2 -4.0 79 479 A Q E +C 93 0A 26 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.999 36.3 158.6-121.9 130.8 21.6 -1.4 -3.9 80 480 A L E -C 92 0A 5 12,-1.9 12,-2.2 -2,-0.4 2,-0.3 -0.990 42.2-101.2-148.0 157.7 23.8 -2.7 -1.1 81 481 A I E -C 91 0A 21 -2,-0.3 -26,-0.4 -24,-0.3 2,-0.3 -0.606 41.2-179.2 -80.8 131.6 24.8 -5.9 0.6 82 482 A N E -C 90 0A 5 8,-3.0 8,-2.6 -2,-0.3 2,-0.4 -0.800 16.1-134.2-125.6 168.0 23.1 -6.6 3.9 83 483 A Y E -C 89 0A 33 -30,-2.8 6,-0.2 -2,-0.3 2,-0.1 -0.972 9.2-134.4-129.0 137.6 23.4 -9.4 6.5 84 484 A T > - 0 0 3 4,-2.3 3,-2.3 -2,-0.4 -45,-0.2 -0.343 43.3 -91.7 -78.7 174.3 20.8 -11.5 8.3 85 485 A K T 3 S+ 0 0 104 -47,-2.9 -46,-0.1 1,-0.3 -1,-0.1 0.836 131.2 47.6 -51.8 -41.5 21.1 -12.2 12.1 86 486 A S T 3 S- 0 0 90 -48,-0.2 -1,-0.3 2,-0.1 -47,-0.1 0.315 124.7-104.5 -87.6 3.7 23.0 -15.5 11.3 87 487 A G < + 0 0 42 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.561 65.9 152.3 88.8 12.7 25.3 -13.6 8.8 88 488 A K - 0 0 117 -50,-0.1 -4,-2.3 1,-0.1 -1,-0.3 -0.625 41.4-127.6 -72.0 132.3 23.9 -14.7 5.5 89 489 A K E +C 83 0A 101 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.517 31.7 171.0 -81.9 146.1 24.4 -12.1 2.8 90 490 A F E -C 82 0A 14 -8,-2.6 -8,-3.0 -2,-0.2 2,-0.4 -0.992 33.8-117.3-145.5 151.4 21.8 -10.7 0.6 91 491 A W E -CD 81 116A 68 25,-2.4 25,-2.5 -2,-0.3 2,-0.5 -0.713 28.4-155.2 -81.8 144.6 21.6 -7.9 -1.9 92 492 A N E -CD 80 115A 2 -12,-2.2 -12,-1.9 -2,-0.4 2,-0.9 -0.949 11.2-160.3-126.4 105.5 19.1 -5.2 -0.9 93 493 A L E -CD 79 114A 10 21,-2.7 21,-2.2 -2,-0.5 2,-0.4 -0.828 33.8-168.2 -80.7 109.0 17.5 -3.0 -3.5 94 494 A F E -CD 78 113A 22 -16,-2.9 -16,-2.2 -2,-0.9 2,-0.4 -0.866 22.4-169.7-119.2 129.7 16.5 -0.4 -1.1 95 495 A H E -CD 77 112A 2 17,-2.7 17,-2.6 -2,-0.4 2,-0.4 -0.987 7.1-172.3-118.7 128.4 14.2 2.6 -1.4 96 496 A L E +CD 76 111A 6 -20,-2.8 -20,-1.6 -2,-0.4 15,-0.2 -0.913 10.8 162.2-112.3 138.5 14.0 5.4 1.2 97 497 A Q E - D 0 110A 20 13,-2.3 13,-2.7 -2,-0.4 -22,-0.1 -0.953 34.5-116.4-152.7 145.1 11.5 8.2 1.3 98 498 A P E - D 0 109A 18 0, 0.0 2,-0.5 0, 0.0 11,-0.3 -0.433 20.4-139.2 -69.2 154.3 10.3 10.7 3.9 99 499 A M E - D 0 108A 0 9,-3.0 8,-2.8 -2,-0.1 9,-1.4 -0.966 22.6-154.9-110.1 122.5 6.7 10.7 5.0 100 500 A R E - D 0 106A 114 -2,-0.5 6,-0.2 6,-0.2 5,-0.1 -0.744 3.4-137.5-103.3 148.1 5.3 14.2 5.4 101 501 A D > - 0 0 50 4,-2.3 3,-1.9 -2,-0.3 -1,-0.1 -0.096 46.2 -75.9 -84.5-170.4 2.5 15.4 7.6 102 502 A Q T 3 S+ 0 0 186 1,-0.3 -2,-0.0 2,-0.1 -1,-0.0 0.508 133.3 49.3 -74.0 -7.9 -0.2 17.9 6.7 103 503 A K T 3 S- 0 0 172 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.331 120.1-107.9-106.4 7.0 2.2 20.8 7.1 104 504 A G S < S+ 0 0 31 -3,-1.9 2,-0.2 1,-0.3 -2,-0.1 0.414 72.7 141.4 76.5 10.7 4.8 19.2 4.9 105 505 A D - 0 0 95 1,-0.1 -4,-2.3 -5,-0.1 2,-0.4 -0.528 61.8-106.2 -81.4 141.8 7.2 18.4 7.8 106 506 A V E + D 0 100A 20 -6,-0.2 -6,-0.2 -2,-0.2 3,-0.1 -0.549 44.4 167.7 -69.4 119.4 9.0 15.0 7.8 107 507 A Q E - 0 0 49 -8,-2.8 -86,-0.4 1,-0.4 2,-0.3 0.770 63.2 -4.4 -98.8 -45.9 7.3 12.8 10.4 108 508 A Y E - D 0 99A 21 -9,-1.4 -9,-3.0 -89,-0.2 2,-0.4 -0.918 62.3-123.7-139.3 167.9 8.8 9.4 9.6 109 509 A F E -AD 18 98A 5 -91,-1.9 -91,-2.4 -2,-0.3 2,-0.4 -0.962 22.0-151.5-113.9 139.6 11.1 7.8 7.0 110 510 A I E -AD 17 97A 0 -13,-2.7 -13,-2.3 -2,-0.4 2,-0.4 -0.930 11.3-170.0-108.9 130.4 9.7 4.8 5.1 111 511 A G E -AD 16 96A 4 -95,-2.6 -95,-2.1 -2,-0.4 2,-0.5 -0.991 4.1-167.4-125.7 130.4 12.2 2.2 3.8 112 512 A V E -AD 15 95A 4 -17,-2.6 -17,-2.7 -2,-0.4 2,-0.5 -0.978 7.1-163.0-120.3 129.1 11.3 -0.6 1.4 113 513 A Q E - D 0 94A 4 -99,-1.5 2,-0.6 -2,-0.5 -99,-0.2 -0.948 10.0-169.2-118.4 125.9 13.8 -3.5 0.9 114 514 A L E - D 0 93A 53 -21,-2.2 -21,-2.7 -2,-0.5 2,-0.2 -0.953 20.5-149.5-112.8 111.2 13.7 -6.0 -2.0 115 515 A D E + D 0 92A 75 -2,-0.6 2,-0.3 -23,-0.2 -23,-0.2 -0.540 24.7 163.3 -85.8 141.2 16.1 -8.8 -1.2 116 516 A G E - D 0 91A 30 -25,-2.5 -25,-2.4 -2,-0.2 3,-0.1 -0.879 46.8-117.8-147.2 176.4 17.9 -10.5 -4.0 117 517 A T S S+ 0 0 136 -2,-0.3 2,-0.3 -27,-0.2 -25,-0.1 0.581 91.9 20.2 -96.2 -12.7 20.8 -12.8 -4.6 118 518 A E S S- 0 0 117 -27,-0.1 2,-0.3 -28,-0.0 -1,-0.1 -0.953 88.6 -83.3-151.3 161.2 22.7 -10.4 -6.8 119 519 A H - 0 0 104 -2,-0.3 2,-0.2 -3,-0.1 6,-0.1 -0.600 54.7-144.9 -62.7 129.0 23.2 -6.8 -7.9 120 520 A V + 0 0 29 -2,-0.3 2,-0.3 4,-0.1 -1,-0.0 -0.680 22.6 174.5-105.4 155.9 20.5 -6.2 -10.6 121 521 A R >> + 0 0 177 -2,-0.2 4,-1.5 4,-0.0 3,-0.9 -0.887 49.4 0.5-142.8 170.6 20.6 -4.1 -13.7 122 522 A D H 3> S+ 0 0 109 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 -0.105 127.6 6.0 52.7-128.7 18.4 -3.4 -16.7 123 523 A A H 3> S+ 0 0 68 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.910 135.0 47.1 -59.9 -43.8 15.0 -5.2 -16.7 124 524 A A H <> S+ 0 0 55 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.905 114.1 48.4 -68.7 -39.4 15.3 -6.8 -13.1 125 525 A E H X S+ 0 0 69 -4,-1.5 4,-2.8 2,-0.2 5,-0.2 0.941 112.9 48.4 -61.0 -48.5 16.5 -3.4 -11.7 126 526 A R H X S+ 0 0 159 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.926 113.9 44.7 -60.1 -48.6 13.5 -1.6 -13.4 127 527 A E H X S+ 0 0 134 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.903 113.8 51.6 -68.1 -34.9 10.9 -4.1 -12.2 128 528 A G H X S+ 0 0 6 -4,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.912 111.6 45.5 -60.5 -47.1 12.4 -4.1 -8.7 129 529 A V H X S+ 0 0 35 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.903 110.0 55.8 -68.7 -35.5 12.4 -0.3 -8.5 130 530 A M H X S+ 0 0 116 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.943 111.8 44.8 -55.9 -46.0 8.8 -0.3 -9.9 131 531 A L H X S+ 0 0 74 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.941 114.5 44.7 -66.4 -49.6 7.8 -2.6 -7.1 132 532 A I H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.843 113.9 50.2 -71.3 -31.2 9.5 -0.9 -4.2 133 533 A K H X S+ 0 0 63 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.933 111.5 47.5 -70.4 -44.9 8.4 2.6 -5.3 134 534 A K H X S+ 0 0 135 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.923 113.2 50.4 -58.9 -43.1 4.7 1.4 -5.6 135 535 A T H X S+ 0 0 4 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.943 108.0 52.2 -60.3 -45.6 5.2 -0.2 -2.1 136 536 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.864 108.9 50.1 -59.1 -37.8 6.6 3.0 -0.7 137 537 A E H X S+ 0 0 101 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.885 110.1 50.8 -66.4 -41.9 3.5 4.9 -2.0 138 538 A N H X S+ 0 0 78 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.875 112.3 47.1 -58.6 -42.6 1.2 2.3 -0.4 139 539 A I H X S+ 0 0 0 -4,-2.5 4,-3.2 2,-0.2 5,-0.3 0.861 104.0 59.7 -74.3 -34.4 3.0 2.7 2.9 140 540 A D H X S+ 0 0 34 -4,-2.2 4,-0.8 -5,-0.2 -1,-0.2 0.928 111.9 42.6 -58.0 -41.4 2.9 6.5 2.7 141 541 A E H < S+ 0 0 148 -4,-1.7 3,-0.5 2,-0.2 4,-0.4 0.934 115.9 47.9 -62.2 -49.6 -0.9 6.0 2.6 142 542 A A H < S+ 0 0 41 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.850 116.6 42.4 -61.9 -34.9 -0.8 3.4 5.3 143 543 A A H >< S+ 0 0 0 -4,-3.2 3,-2.1 1,-0.2 -1,-0.2 0.612 85.4 96.7 -91.1 -12.1 1.4 5.4 7.7 144 544 A K T 3< S+ 0 0 65 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.1 0.765 92.7 31.9 -55.8 -36.7 -0.2 8.7 7.2 145 545 A E T 3 0 0 161 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.1 0.128 360.0 360.0-112.6 21.6 -2.4 8.6 10.3 146 546 A L < 0 0 102 -3,-2.1 -3,-0.1 0, 0.0 -4,-0.0 -0.093 360.0 360.0 -67.5 360.0 -0.3 6.5 12.7