==== 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 TRANSFERASE 26-JAN-09 3FZO . COMPND 2 MOLECULE: PROTEIN TYROSINE KINASE 2 BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.HAN . 262 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13377.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 69.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 14.5 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 0.8 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 . 12 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 34.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 1 0 1 1 1 0 0 0 0 0 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 1 420 A I 0 0 77 0, 0.0 2,-0.3 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 127.2 -2.7 -14.7 0.4 2 421 A A > - 0 0 33 1,-0.1 3,-1.9 72,-0.1 4,-0.4 -0.623 360.0-122.9 -87.1 146.4 -3.2 -18.5 0.7 3 422 A R G > S+ 0 0 57 1,-0.3 3,-1.4 -2,-0.3 -1,-0.1 0.841 111.8 59.5 -54.4 -35.0 -0.6 -20.7 2.4 4 423 A E G 3 S+ 0 0 158 1,-0.3 -1,-0.3 3,-0.1 3,-0.0 0.585 92.5 67.2 -72.5 -11.7 -0.3 -22.8 -0.7 5 424 A D G < S+ 0 0 43 -3,-1.9 21,-2.9 1,-0.1 2,-0.5 0.580 96.9 64.2 -82.9 -11.6 0.7 -19.7 -2.8 6 425 A V E < -A 25 0A 6 -3,-1.4 2,-0.5 -4,-0.4 19,-0.2 -0.966 65.4-171.5-116.2 123.7 4.0 -19.7 -0.7 7 426 A V E -A 24 0A 84 17,-2.6 17,-2.7 -2,-0.5 2,-0.4 -0.954 18.0-138.3-113.4 128.7 6.5 -22.5 -0.9 8 427 A L E +A 23 0A 58 -2,-0.5 15,-0.3 15,-0.3 3,-0.1 -0.739 21.8 177.3 -89.3 137.1 9.5 -22.5 1.5 9 428 A N E - 0 0 74 13,-3.2 2,-0.3 1,-0.4 14,-0.2 0.641 58.1 -24.0-113.6 -31.0 12.8 -23.5 -0.1 10 429 A R E S-A 22 0A 138 12,-1.5 12,-2.8 0, 0.0 -1,-0.4 -0.968 71.9 -76.1-173.6 164.2 15.3 -23.2 2.7 11 430 A I E -A 21 0A 112 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.590 29.9-176.5 -69.2 130.0 16.2 -21.6 6.0 12 431 A L E - 0 0 86 8,-2.6 2,-0.3 1,-0.4 9,-0.2 0.756 57.5 -81.0 -89.6 -43.9 17.4 -18.0 5.6 13 432 A G E -A 20 0A 27 7,-2.2 7,-2.7 2,-0.0 2,-0.5 -0.976 46.4 -68.9 168.8-170.6 18.1 -17.6 9.4 14 433 A E E -A 19 0A 137 -2,-0.3 5,-0.4 5,-0.2 2,-0.1 -0.968 44.6-171.8-110.6 123.3 16.7 -17.0 12.8 15 434 A G - 0 0 40 3,-3.0 3,-0.1 -2,-0.5 5,-0.0 -0.340 48.6 -73.7 -96.0-171.3 15.3 -13.6 13.6 16 435 A F S S+ 0 0 83 1,-0.2 3,-0.1 -2,-0.1 36,-0.0 0.822 130.6 26.3 -53.6 -39.4 14.1 -12.2 16.9 17 436 A F S S- 0 0 12 1,-0.3 24,-2.1 22,-0.1 2,-0.3 0.656 119.8 -60.2 -98.4 -20.6 10.8 -14.2 16.9 18 437 A G S S- 0 0 6 22,-0.2 -3,-3.0 -3,-0.1 -1,-0.3 -0.906 78.0 -5.4-179.6 167.9 11.5 -17.4 14.7 19 438 A E E -A 14 0A 56 -5,-0.4 20,-1.7 -2,-0.3 2,-0.4 0.014 49.5-161.4 70.8 66.9 12.4 -19.2 12.2 20 439 A V E -AB 13 38A 19 -7,-2.7 -8,-2.6 18,-0.2 -7,-2.2 -0.980 13.6-172.5-116.4 131.2 12.9 -17.1 8.9 21 440 A Y E -AB 11 37A 50 16,-2.6 16,-3.1 -2,-0.4 2,-0.5 -0.779 26.7-124.7-122.3 159.4 12.8 -18.8 5.5 22 441 A E E +AB 10 36A 52 -12,-2.8 -13,-3.2 -2,-0.3 -12,-1.5 -0.889 47.6 156.1 -99.1 130.6 13.5 -18.1 1.8 23 442 A G E -AB 8 35A 2 12,-3.1 12,-2.5 -2,-0.5 2,-0.4 -0.786 41.3-110.2-142.0 179.7 10.4 -19.0 -0.3 24 443 A V E -AB 7 34A 12 -17,-2.7 -17,-2.6 -2,-0.2 2,-0.5 -0.995 22.1-158.8-122.0 124.7 8.5 -18.4 -3.5 25 444 A Y E -AB 6 33A 23 8,-3.6 8,-3.5 -2,-0.4 2,-0.6 -0.874 9.7-147.8 -96.6 131.0 5.1 -16.6 -3.6 26 445 A T E - B 0 32A 46 -21,-2.9 6,-0.2 -2,-0.5 5,-0.1 -0.915 16.7-137.2-102.9 119.5 2.9 -17.3 -6.6 27 446 A N - 0 0 45 4,-3.2 3,-0.3 -2,-0.6 -1,-0.0 -0.041 23.0-112.2 -61.5 164.4 0.7 -14.3 -7.7 28 447 A H S S+ 0 0 163 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.721 126.0 53.4 -68.3 -22.5 -3.0 -14.5 -8.7 29 448 A K S S- 0 0 162 2,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.600 126.1-108.8 -86.1 -13.8 -1.6 -13.5 -12.1 30 449 A G + 0 0 47 1,-0.3 2,-0.2 -3,-0.3 -2,-0.1 0.362 67.8 146.8 103.1 -2.1 0.8 -16.5 -11.8 31 450 A E - 0 0 101 -5,-0.1 -4,-3.2 1,-0.1 2,-0.6 -0.488 45.0-135.2 -68.0 132.4 4.0 -14.6 -11.3 32 451 A K E -B 26 0A 155 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.829 26.1-173.0 -86.4 115.4 6.6 -16.3 -9.1 33 452 A I E -B 25 0A 49 -8,-3.5 -8,-3.6 -2,-0.6 2,-0.2 -0.946 22.6-125.2-114.1 130.2 8.1 -13.8 -6.6 34 453 A N E +B 24 0A 88 -2,-0.4 51,-1.2 -10,-0.2 2,-0.3 -0.532 40.0 177.0 -73.3 135.7 11.0 -14.6 -4.2 35 454 A V E -BC 23 84A 0 -12,-2.5 -12,-3.1 -2,-0.2 2,-0.4 -0.936 34.6-129.1-141.3 156.7 10.2 -13.9 -0.6 36 455 A A E -BC 22 83A 16 47,-2.6 47,-3.0 -2,-0.3 2,-0.6 -0.917 25.6-155.3-101.1 137.6 11.4 -14.0 3.0 37 456 A V E -BC 21 82A 0 -16,-3.1 -16,-2.6 -2,-0.4 2,-0.3 -0.943 4.5-161.6-121.3 110.0 8.9 -15.7 5.3 38 457 A K E -BC 20 81A 27 43,-2.9 43,-2.7 -2,-0.6 2,-0.3 -0.705 12.1-173.1 -91.7 138.7 9.2 -14.8 9.0 39 458 A T E - C 0 80A 15 -20,-1.7 2,-0.4 -2,-0.3 -24,-0.2 -0.846 18.3-132.1-128.9 165.5 7.6 -17.1 11.5 40 459 A C - 0 0 21 39,-0.6 -22,-0.2 -2,-0.3 39,-0.2 -0.984 34.3-102.8-123.2 130.2 6.9 -17.0 15.2 41 460 A K - 0 0 86 -24,-2.1 3,-0.3 -2,-0.4 8,-0.0 -0.300 20.8-148.3 -52.4 117.4 7.8 -19.9 17.6 42 461 A K S S+ 0 0 170 1,-0.3 2,-0.8 -2,-0.1 -1,-0.2 0.754 97.5 65.7 -60.6 -24.4 4.5 -21.7 18.3 43 462 A D S S+ 0 0 126 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.513 88.4 100.0 -91.7 56.5 6.2 -22.4 21.7 44 463 A C S S- 0 0 39 -2,-0.8 5,-0.0 -3,-0.3 -4,-0.0 -0.963 73.9 -77.4-145.9 162.9 6.3 -18.8 22.8 45 464 A T >> - 0 0 75 -2,-0.3 4,-1.9 1,-0.1 3,-0.8 -0.257 34.0-115.5 -67.3 140.3 4.4 -16.3 25.0 46 465 A L H 3> S+ 0 0 156 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.774 116.7 54.6 -9.8 -57.4 1.2 -14.5 24.4 47 466 A D H 3> S+ 0 0 75 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.846 103.9 49.7 -73.2 -42.7 3.2 -11.3 24.4 48 467 A N H <> S+ 0 0 42 -3,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.828 109.9 53.1 -62.7 -38.3 5.8 -12.2 21.7 49 468 A K H X S+ 0 0 73 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.953 109.5 49.7 -58.0 -54.9 2.9 -13.3 19.5 50 469 A E H X S+ 0 0 93 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.927 114.8 43.5 -39.4 -60.0 1.4 -9.8 20.1 51 470 A K H X S+ 0 0 33 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.817 110.0 54.7 -64.9 -38.5 4.7 -8.0 19.2 52 471 A F H X S+ 0 0 3 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.887 114.2 42.0 -64.7 -41.8 5.5 -10.2 16.2 53 472 A M H X S+ 0 0 52 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.819 108.9 59.0 -71.7 -34.1 2.1 -9.3 14.7 54 473 A S H X S+ 0 0 45 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.895 107.4 48.0 -61.1 -37.3 2.5 -5.6 15.8 55 474 A E H X S+ 0 0 15 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.900 109.9 51.8 -68.0 -40.5 5.6 -5.5 13.7 56 475 A A H X S+ 0 0 0 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.873 108.1 51.7 -62.0 -41.8 3.8 -7.1 10.8 57 476 A V H X S+ 0 0 71 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.865 110.1 48.5 -66.3 -39.2 1.0 -4.5 11.0 58 477 A I H X S+ 0 0 41 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.961 114.1 45.2 -63.9 -49.8 3.4 -1.6 10.9 59 478 A M H X S+ 0 0 8 -4,-2.2 4,-0.9 1,-0.2 11,-0.6 0.871 112.9 52.1 -65.9 -37.3 5.3 -3.0 7.9 60 479 A K H < S+ 0 0 117 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.931 116.7 38.7 -56.0 -48.3 2.1 -3.8 6.1 61 480 A N H < S+ 0 0 106 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.661 98.0 73.5 -89.4 -18.1 0.7 -0.3 6.6 62 481 A L H < + 0 0 12 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.1 0.936 62.8 172.5 -59.6 -47.7 3.9 1.9 6.1 63 482 A D < + 0 0 134 -4,-0.9 6,-0.1 1,-0.2 -3,-0.1 0.862 16.8 155.7 39.1 58.8 3.7 1.1 2.3 64 483 A H > - 0 0 36 3,-0.2 3,-2.1 4,-0.1 -1,-0.2 -0.920 52.7-127.4-116.3 137.6 6.5 3.6 1.5 65 484 A P T 3 S+ 0 0 80 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.687 111.3 44.6 -60.8 -14.0 8.7 3.4 -1.6 66 485 A H T 3 S+ 0 0 23 47,-0.1 80,-2.3 79,-0.1 2,-0.4 -0.052 98.6 81.6-123.6 30.0 11.8 3.6 0.6 67 486 A I B < S-e 146 0B 5 -3,-2.1 -3,-0.2 78,-0.3 80,-0.2 -0.996 94.4 -97.6-126.3 135.1 10.7 1.1 3.2 68 487 A V - 0 0 10 78,-2.7 2,-0.3 -2,-0.4 -5,-0.1 -0.171 48.7-115.0 -51.0 138.9 11.1 -2.6 2.6 69 488 A K - 0 0 93 -4,-0.1 15,-2.7 -6,-0.1 2,-0.5 -0.606 14.0-147.4 -91.2 134.5 7.8 -4.1 1.5 70 489 A L E -D 83 0A 18 -11,-0.6 13,-0.3 -2,-0.3 3,-0.1 -0.855 9.2-167.8 -86.6 129.6 5.5 -6.6 3.2 71 490 A I E - 0 0 31 11,-2.9 2,-0.3 -2,-0.5 12,-0.2 0.822 58.6 -41.9 -89.1 -37.6 3.7 -8.8 0.6 72 491 A G E -D 82 0A 12 10,-1.7 10,-2.8 2,-0.0 2,-0.4 -0.987 44.2-119.8-177.6 178.7 1.2 -10.4 2.9 73 492 A I E -D 81 0A 27 -2,-0.3 2,-0.7 8,-0.2 8,-0.2 -1.000 7.2-159.1-137.1 124.8 0.3 -12.0 6.3 74 493 A I E -D 80 0A 1 6,-2.7 6,-1.2 -2,-0.4 -72,-0.1 -0.950 14.8-175.1-100.8 108.3 -1.1 -15.5 6.9 75 494 A E + 0 0 118 -2,-0.7 -1,-0.2 4,-0.2 4,-0.2 0.932 43.7 108.3 -71.8 -45.2 -2.6 -15.1 10.3 76 495 A E S S- 0 0 92 1,-0.1 4,-0.2 2,-0.1 -2,-0.1 -0.025 92.6 -76.4 -56.4 154.7 -3.7 -18.7 11.0 77 496 A E S S+ 0 0 150 1,-0.2 2,-0.8 2,-0.1 -1,-0.1 0.089 127.8 56.4 -73.8 -7.4 -1.7 -20.3 13.6 78 497 A P S S- 0 0 77 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.830 96.2-153.4 -89.3 87.4 1.5 -21.3 12.0 79 498 A T - 0 0 24 -2,-0.8 -39,-0.6 -39,-0.2 2,-0.5 -0.448 15.6-166.1 -69.0 123.3 1.7 -17.5 11.2 80 499 A W E -CD 39 74A 38 -6,-1.2 -6,-2.7 -2,-0.3 2,-0.6 -0.945 9.8-161.3-110.2 121.5 3.8 -16.4 8.1 81 500 A I E -CD 38 73A 3 -43,-2.7 -43,-2.9 -2,-0.5 2,-0.7 -0.937 18.1-152.2 -95.4 118.7 4.9 -12.8 7.5 82 501 A I E -CD 37 72A 0 -10,-2.8 -11,-2.9 -2,-0.6 -10,-1.7 -0.830 16.4-176.7-101.5 112.1 5.8 -12.6 3.8 83 502 A M E -CD 36 70A 14 -47,-3.0 -47,-2.6 -2,-0.7 -13,-0.2 -0.815 30.3-105.8-110.0 146.2 8.3 -10.0 3.0 84 503 A E E -C 35 0A 59 -15,-2.7 2,-0.4 -2,-0.3 -49,-0.2 -0.421 33.5-139.2 -68.2 142.8 9.7 -8.9 -0.4 85 504 A L - 0 0 47 -51,-1.2 -51,-0.1 -2,-0.1 -1,-0.0 -0.819 5.5-151.2-111.0 142.9 13.2 -10.1 -1.1 86 505 A Y > - 0 0 19 -2,-0.4 3,-1.9 1,-0.1 52,-0.2 -0.910 4.4-166.1-123.1 97.8 15.8 -7.9 -2.8 87 506 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 52,-0.1 0.629 88.3 67.6 -61.2 -20.4 18.5 -9.9 -4.8 88 507 A Y T 3 S- 0 0 104 50,-0.6 51,-0.1 1,-0.2 2,-0.1 0.773 96.3-165.4 -65.0 -22.9 20.8 -6.7 -5.0 89 508 A G < + 0 0 23 -3,-1.9 49,-2.7 49,-0.3 -1,-0.2 -0.345 34.4 4.2 77.7-154.7 21.1 -7.3 -1.2 90 509 A E B > -F 137 0B 63 47,-0.2 4,-2.2 1,-0.1 47,-0.3 -0.348 58.9-129.7 -72.3 143.3 22.4 -4.8 1.4 91 510 A L H > S+ 0 0 0 45,-3.0 4,-2.7 42,-0.8 5,-0.2 0.888 105.3 56.4 -55.9 -44.8 23.4 -1.2 0.6 92 511 A G H > S+ 0 0 5 41,-1.0 4,-2.2 44,-0.3 -1,-0.2 0.936 112.9 39.9 -58.0 -50.8 26.8 -1.6 2.4 93 512 A H H > S+ 0 0 90 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.850 114.3 54.8 -63.2 -36.5 27.9 -4.6 0.3 94 513 A Y H X S+ 0 0 15 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.892 110.0 45.7 -63.4 -39.5 26.4 -3.0 -2.8 95 514 A L H X S+ 0 0 0 -4,-2.7 4,-0.9 2,-0.2 -2,-0.2 0.888 111.9 52.3 -70.6 -42.8 28.5 0.2 -2.2 96 515 A E H >< S+ 0 0 92 -4,-2.2 3,-1.0 -5,-0.2 4,-0.3 0.966 112.0 45.4 -51.4 -57.1 31.6 -1.9 -1.6 97 516 A R H 3< S+ 0 0 146 -4,-2.5 -1,-0.2 1,-0.2 3,-0.2 0.764 122.3 37.2 -58.8 -30.4 31.1 -3.8 -4.9 98 517 A N H >X S+ 0 0 44 -4,-1.2 3,-2.0 -5,-0.2 4,-1.6 0.338 76.2 115.5-113.6 5.3 30.4 -0.7 -6.9 99 518 A K T << S+ 0 0 109 -3,-1.0 3,-0.2 -4,-0.9 -1,-0.1 0.828 76.2 55.7 -43.9 -43.1 32.8 1.9 -5.4 100 519 A N T 34 S+ 0 0 143 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.703 117.6 32.1 -70.3 -19.3 34.7 2.3 -8.6 101 520 A S T <4 S+ 0 0 84 -3,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.531 92.6 102.4-114.7 -10.5 31.7 3.2 -10.7 102 521 A L < - 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0 0 10 -3,-0.8 15,-0.1 -4,-0.6 14,-0.0 -0.445 69.4-117.5 -92.8 147.6 23.9 5.6 18.4 165 593 A S > - 0 0 1 13,-0.2 4,-2.2 -2,-0.2 5,-0.2 -0.265 35.2-107.7 -66.2 160.7 23.3 9.0 19.9 166 594 A P H > S+ 0 0 1 0, 0.0 4,-3.4 0, 0.0 5,-0.3 0.897 120.7 51.4 -55.2 -42.6 24.9 9.8 23.4 167 595 A E H > S+ 0 0 14 2,-0.2 6,-2.3 1,-0.2 4,-1.6 0.766 109.0 51.2 -72.6 -26.4 21.5 9.7 25.1 168 596 A S H > S+ 0 0 6 4,-0.3 4,-1.4 3,-0.2 -1,-0.2 0.964 116.4 39.7 -68.0 -56.4 20.7 6.3 23.5 169 597 A I H < S+ 0 0 40 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.957 127.8 33.3 -55.6 -54.2 24.1 4.8 24.7 170 598 A N H < S+ 0 0 67 -4,-3.4 -3,-0.2 -5,-0.2 -1,-0.2 0.845 136.4 15.6 -74.5 -39.4 24.0 6.6 28.2 171 599 A F H < S- 0 0 154 -4,-1.6 -3,-0.2 -5,-0.3 -1,-0.2 0.184 94.2-114.3-128.7 13.6 20.3 6.7 29.1 172 600 A R < + 0 0 150 -4,-1.4 2,-0.4 1,-0.2 -4,-0.3 0.767 61.2 159.1 48.2 28.7 18.5 4.2 26.7 173 601 A R + 0 0 128 -6,-2.3 2,-0.4 -7,-0.1 -1,-0.2 -0.696 17.4 178.6 -83.2 129.4 16.7 7.3 25.2 174 602 A F + 0 0 41 -2,-0.4 2,-0.2 -3,-0.1 -47,-0.1 -0.931 15.4 146.4-138.5 105.9 15.3 6.7 21.6 175 603 A T > - 0 0 44 -2,-0.4 4,-2.2 -49,-0.1 5,-0.2 -0.753 66.5 -93.9-130.0 174.6 13.5 9.5 20.0 176 604 A T H > S+ 0 0 17 -2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.897 128.9 57.3 -59.9 -35.8 13.1 10.8 16.4 177 605 A A H > S+ 0 0 21 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.843 104.6 48.2 -61.1 -39.5 16.0 13.1 17.4 178 606 A S H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.836 108.3 55.6 -71.0 -31.3 18.2 10.1 18.3 179 607 A D H X S+ 0 0 3 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.829 104.0 55.3 -61.1 -35.8 17.1 8.6 14.9 180 608 A V H X S+ 0 0 1 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.934 107.0 49.0 -63.8 -47.8 18.5 11.8 13.3 181 609 A W H X S+ 0 0 5 -4,-1.7 4,-1.3 1,-0.2 3,-0.3 0.959 115.3 44.9 -50.5 -50.2 21.9 11.3 14.9 182 610 A M H X S+ 0 0 6 -4,-2.1 4,-2.0 1,-0.2 3,-0.3 0.891 107.2 57.7 -71.2 -38.1 21.8 7.7 13.6 183 611 A F H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.878 104.3 52.9 -52.7 -40.9 20.6 8.7 10.2 184 612 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 -3,-0.3 -1,-0.2 0.814 105.8 53.5 -69.7 -33.0 23.7 11.0 9.8 185 613 A V H X S+ 0 0 1 -4,-1.3 4,-2.4 -3,-0.3 -1,-0.2 0.895 108.2 50.6 -61.4 -44.6 26.0 8.0 10.7 186 614 A C H X S+ 0 0 0 -4,-2.0 4,-2.3 -55,-0.3 -2,-0.2 0.861 109.8 49.8 -62.4 -39.7 24.2 6.1 7.9 187 615 A M H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -1,-0.2 0.888 108.2 53.7 -62.7 -43.8 24.9 9.0 5.5 188 616 A W H X S+ 0 0 6 -4,-2.2 4,-0.7 1,-0.2 -2,-0.2 0.930 109.8 47.9 -53.4 -47.8 28.5 8.9 6.6 189 617 A E H ><>S+ 0 0 7 -4,-2.4 5,-3.0 2,-0.2 3,-0.7 0.908 112.5 48.9 -59.3 -43.4 28.5 5.2 5.7 190 618 A I H ><5S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.939 111.3 47.6 -65.7 -47.4 26.9 5.9 2.3 191 619 A L H 3<5S+ 0 0 1 -4,-2.9 30,-0.4 1,-0.3 -1,-0.2 0.584 112.0 52.6 -67.0 -9.2 29.3 8.7 1.4 192 620 A S T <<5S- 0 0 15 -4,-0.7 3,-0.5 -3,-0.7 -1,-0.3 0.107 117.9-111.4-110.0 11.2 32.2 6.4 2.5 193 621 A F T < 5S- 0 0 37 -3,-1.5 -3,-0.2 1,-0.2 -94,-0.1 0.799 81.8 -38.8 60.2 35.3 31.0 3.5 0.3 194 622 A G S - 0 0 85 1,-0.1 3,-0.9 -4,-0.1 -1,-0.1 -0.656 31.7-112.5 -79.5 134.3 32.0 1.1 9.2 197 625 A P T 3 S+ 0 0 0 0, 0.0 4,-0.1 0, 0.0 -35,-0.1 -0.399 97.0 4.0 -64.7 144.1 31.7 4.1 11.6 198 626 A F T > S+ 0 0 7 1,-0.1 3,-1.9 2,-0.1 8,-0.1 0.845 78.6 163.4 49.9 42.8 34.4 4.3 14.3 199 627 A F T < S+ 0 0 110 -3,-0.9 -1,-0.1 1,-0.3 -37,-0.0 0.664 70.0 57.2 -67.2 -15.8 36.1 1.2 12.7 200 628 A W T 3 S+ 0 0 125 2,-0.1 -1,-0.3 0, 0.0 2,-0.3 0.363 101.3 71.5 -96.2 3.9 39.3 2.1 14.7 201 629 A L S < S- 0 0 28 -3,-1.9 2,-0.3 -4,-0.1 -39,-0.1 -0.779 75.4-125.0-118.2 160.0 37.5 2.0 18.1 202 630 A E >> - 0 0 119 -2,-0.3 3,-2.3 1,-0.1 4,-0.8 -0.737 39.5-106.4 -94.7 153.6 36.1 -0.6 20.4 203 631 A N H >> S+ 0 0 83 -2,-0.3 3,-1.1 1,-0.3 4,-0.5 0.866 120.8 54.7 -51.2 -41.0 32.4 -0.1 21.4 204 632 A K H 34 S+ 0 0 163 1,-0.2 4,-0.4 2,-0.1 -1,-0.3 0.688 102.5 58.1 -66.5 -18.2 33.5 1.0 25.0 205 633 A D H <> S+ 0 0 57 -3,-2.3 4,-1.7 1,-0.1 3,-0.3 0.783 88.8 78.9 -78.0 -23.0 35.8 3.7 23.5 206 634 A V H S+ 0 0 28 -4,-0.4 4,-1.4 -3,-0.3 -1,-0.2 0.923 107.6 49.4 -59.8 -48.7 34.5 8.9 25.5 209 637 A V H <>S+ 0 0 23 -4,-1.7 5,-1.8 1,-0.2 -1,-0.2 0.890 112.7 48.3 -59.5 -39.4 35.6 10.1 22.0 210 638 A L H ><5S+ 0 0 3 -4,-1.9 3,-2.0 1,-0.2 -1,-0.2 0.868 105.2 56.5 -71.2 -40.0 32.2 11.8 21.6 211 639 A E H 3<5S+ 0 0 126 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.805 102.6 57.9 -59.9 -33.8 32.2 13.6 25.0 212 640 A K T 3<5S- 0 0 145 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.341 124.5-107.3 -76.2 2.9 35.5 15.1 23.9 213 641 A G T < 5S+ 0 0 50 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.402 72.0 144.5 86.8 -2.1 33.7 16.6 20.9 214 642 A D < + 0 0 79 -5,-1.8 -1,-0.3 -6,-0.2 2,-0.3 -0.421 23.4 178.4 -69.0 148.3 35.4 14.2 18.4 215 643 A R - 0 0 58 -2,-0.1 16,-0.0 1,-0.0 -1,-0.0 -0.895 39.8 -71.4-143.1 166.4 33.2 13.0 15.4 216 644 A L - 0 0 2 -2,-0.3 2,-0.0 1,-0.1 -28,-0.0 -0.370 60.9-113.5 -58.5 140.1 33.5 10.8 12.3 217 645 A P - 0 0 68 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.318 37.1 -82.1 -77.2 160.1 35.7 12.6 9.7 218 646 A K - 0 0 92 1,-0.1 -30,-0.0 2,-0.1 9,-0.0 -0.469 49.0-119.0 -55.7 120.3 34.5 14.0 6.3 219 647 A P > - 0 0 9 0, 0.0 3,-1.0 0, 0.0 -27,-0.1 -0.357 27.0-113.4 -55.6 151.2 34.4 11.1 3.8 220 648 A D T 3 S+ 0 0 143 1,-0.3 -28,-0.1 -3,-0.1 -2,-0.1 0.941 114.2 37.2 -60.6 -46.5 36.8 11.9 1.0 221 649 A L T 3 S+ 0 0 91 -30,-0.4 -1,-0.3 2,-0.1 -29,-0.1 0.452 90.1 124.4 -89.9 8.8 34.1 12.3 -1.7 222 650 A C < - 0 0 3 -3,-1.0 5,-0.1 -31,-0.1 -34,-0.0 -0.483 67.0-119.9 -72.0 122.0 31.6 14.0 0.6 223 651 A P >> - 0 0 11 0, 0.0 4,-1.4 0, 0.0 3,-1.3 -0.459 24.3-127.5 -53.7 124.3 30.2 17.4 -0.4 224 652 A P H 3> S+ 0 0 90 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.860 110.2 60.6 -42.1 -46.1 31.2 19.9 2.4 225 653 A V H 3> S+ 0 0 62 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.892 104.3 49.6 -51.3 -43.0 27.6 20.9 2.7 226 654 A L H <> S+ 0 0 0 -3,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.859 109.0 51.9 -64.7 -38.3 26.7 17.3 3.6 227 655 A Y H X S+ 0 0 55 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.930 109.5 47.3 -67.3 -47.1 29.4 17.1 6.2 228 656 A T H X S+ 0 0 79 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.910 111.2 53.6 -62.7 -34.3 28.3 20.2 8.1 229 657 A L H X S+ 0 0 12 -4,-1.8 4,-1.5 -5,-0.3 -2,-0.2 0.919 109.4 47.8 -58.2 -44.5 24.8 18.8 7.8 230 658 A M H X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.916 108.6 55.0 -61.1 -42.4 26.1 15.5 9.5 231 659 A T H < S+ 0 0 53 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.863 105.1 52.3 -66.9 -32.3 27.9 17.6 12.2 232 660 A R H >< S+ 0 0 117 -4,-2.0 3,-1.0 1,-0.2 -1,-0.2 0.858 106.6 53.7 -64.7 -39.2 24.5 19.3 13.1 233 661 A C H 3< S+ 0 0 0 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.732 103.2 60.1 -61.0 -28.1 22.9 15.8 13.4 234 662 A W T 3< S+ 0 0 5 -4,-1.3 2,-0.4 -3,-0.2 -1,-0.2 -0.014 72.7 133.2 -94.9 27.1 25.7 15.0 15.9 235 663 A D < - 0 0 58 -3,-1.0 6,-0.1 2,-0.2 -54,-0.1 -0.658 60.5-134.7 -73.4 132.0 24.9 17.7 18.4 236 664 A Y S S+ 0 0 86 -2,-0.4 -69,-0.2 1,-0.1 -1,-0.1 0.772 94.4 75.6 -51.5 -34.5 24.9 16.4 21.9 237 665 A D S > S- 0 0 68 1,-0.2 3,-1.7 2,-0.0 4,-0.5 -0.799 71.6-158.9 -86.6 108.8 21.7 18.4 22.4 238 666 A P G > S+ 0 0 22 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.801 92.1 59.4 -53.2 -34.5 18.8 16.5 20.6 239 667 A S G 3 S+ 0 0 97 1,-0.3 -3,-0.0 -3,-0.1 -2,-0.0 0.714 101.2 54.1 -76.4 -18.2 16.8 19.7 20.4 240 668 A D G < S+ 0 0 87 -3,-1.7 -1,-0.3 -5,-0.1 -4,-0.1 0.522 90.6 99.5 -85.6 -7.5 19.6 21.4 18.4 241 669 A R S < S- 0 0 13 -3,-1.1 -8,-0.2 -4,-0.5 -63,-0.0 -0.517 82.8-103.2 -80.4 148.7 19.5 18.6 15.8 242 670 A P - 0 0 3 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.334 31.7-121.2 -66.8 146.8 17.7 19.1 12.5 243 671 A R >> - 0 0 117 1,-0.1 4,-2.1 -63,-0.0 3,-0.7 -0.591 26.7-110.8 -78.2 155.5 14.3 17.4 12.1 244 672 A F H 3> S+ 0 0 2 1,-0.2 4,-2.0 -2,-0.2 -125,-0.2 0.789 117.2 61.3 -57.8 -31.1 14.0 14.9 9.2 245 673 A T H 3> S+ 0 0 75 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.885 108.4 42.5 -60.6 -41.7 11.6 17.4 7.4 246 674 A E H <> S+ 0 0 84 -3,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.826 111.5 55.8 -71.0 -39.5 14.4 20.0 7.2 247 675 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.872 103.9 54.4 -57.8 -39.9 16.9 17.2 6.3 248 676 A V H X S+ 0 0 27 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.897 109.9 47.1 -65.8 -38.1 14.7 16.4 3.4 249 677 A C H X S+ 0 0 75 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.866 114.3 45.6 -69.5 -41.1 14.8 20.0 2.1 250 678 A S H X S+ 0 0 39 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.928 113.7 48.8 -66.7 -47.2 18.6 20.3 2.5 251 679 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.877 110.7 50.3 -59.0 -41.0 19.3 17.0 0.9 252 680 A S H X S+ 0 0 37 -4,-1.9 4,-2.8 -5,-0.2 -1,-0.2 0.909 110.1 51.3 -64.5 -41.8 17.0 17.8 -2.1 253 681 A D H X S+ 0 0 115 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.906 112.7 45.2 -57.1 -44.2 18.8 21.1 -2.4 254 682 A V H X S+ 0 0 2 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.873 111.2 54.0 -71.2 -34.5 22.2 19.3 -2.5 255 683 A Y H X S+ 0 0 48 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.961 110.3 44.9 -63.3 -51.9 20.8 16.7 -4.9 256 684 A Q H X S+ 0 0 104 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.912 115.1 50.0 -58.5 -44.8 19.7 19.4 -7.4 257 685 A M H X S+ 0 0 91 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.938 114.2 43.1 -55.2 -54.8 23.1 21.2 -7.0 258 686 A E H X S+ 0 0 37 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.814 109.2 59.0 -57.5 -37.4 25.1 18.0 -7.5 259 687 A K H < S+ 0 0 83 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.895 108.3 44.7 -62.3 -42.3 22.8 17.0 -10.4 260 688 A D H >< S+ 0 0 113 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.927 109.4 56.5 -67.1 -47.6 23.7 20.2 -12.3 261 689 A I H 3< S+ 0 0 124 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.865 109.4 46.5 -47.5 -41.6 27.4 19.8 -11.5 262 690 A A T 3< 0 0 68 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.489 360.0 360.0 -87.5 -2.6 27.4 16.3 -13.1 263 691 A M < 0 0 176 -3,-1.4 -3,-0.1 -4,-0.4 -4,-0.0 0.033 360.0 360.0-143.5 360.0 25.5 17.3 -16.4