==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 23-DEC-11 3V8T . COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE ITK/TSK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.R.MCLEAN,Y.ZHANG . 482 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21250.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 326 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 1 0.2 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 . 27 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 32.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.5 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 2 0 0 3 2 0 1 1 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 2 2 2 1 3 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 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 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 1 355 A G 0 0 47 0, 0.0 67,-0.2 0, 0.0 356,-0.0 0.000 360.0 360.0 360.0-107.5 -45.0 -12.6 5.8 2 356 A S - 0 0 16 1,-0.2 66,-2.4 65,-0.1 2,-0.3 0.875 360.0-171.1 55.2 47.2 -43.1 -12.3 9.2 3 357 A V B -a 68 0A 86 64,-0.2 2,-0.4 66,-0.1 66,-0.2 -0.540 5.9-160.3 -73.2 126.2 -41.8 -16.0 9.0 4 358 A I - 0 0 3 64,-3.5 66,-0.4 -2,-0.3 67,-0.3 -0.944 16.8-126.4-110.0 129.6 -40.0 -17.2 12.2 5 359 A D > - 0 0 62 -2,-0.4 3,-1.8 64,-0.1 4,-0.3 -0.494 21.3-123.0 -71.0 140.9 -37.7 -20.2 12.2 6 360 A P G > S+ 0 0 45 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.818 108.9 64.6 -56.3 -32.9 -38.6 -22.9 14.8 7 361 A S G 3 S+ 0 0 103 1,-0.3 -2,-0.0 3,-0.0 -3,-0.0 0.640 93.4 62.8 -63.4 -18.9 -35.1 -22.7 16.4 8 362 A E G < S+ 0 0 28 -3,-1.8 19,-2.8 19,-0.1 20,-0.5 0.577 92.3 81.0 -81.8 -14.6 -35.8 -19.1 17.5 9 363 A L E < -B 26 0A 15 -3,-1.6 2,-0.5 -4,-0.3 17,-0.2 -0.820 59.8-164.4-101.3 135.6 -38.7 -20.2 19.7 10 364 A T E -B 25 0A 56 15,-2.5 15,-2.0 -2,-0.4 2,-0.6 -0.985 13.8-147.2-116.3 117.5 -38.3 -21.6 23.2 11 365 A F E +B 24 0A 97 -2,-0.5 13,-0.2 13,-0.2 3,-0.1 -0.810 26.1 165.9 -89.7 118.3 -41.4 -23.5 24.6 12 366 A V E - 0 0 74 11,-2.4 2,-0.3 -2,-0.6 12,-0.2 0.888 56.5 -10.3 -97.4 -57.5 -41.7 -23.0 28.4 13 367 A Q E -B 23 0A 115 10,-1.7 10,-3.4 0, 0.0 2,-0.4 -0.982 57.9-115.9-153.8 139.1 -45.2 -24.1 29.5 14 368 A E E +B 22 0A 91 -2,-0.3 8,-0.3 8,-0.3 3,-0.1 -0.610 37.5 167.0 -73.2 123.4 -48.7 -25.0 28.1 15 369 A I E + 0 0 87 6,-2.9 2,-0.3 -2,-0.4 7,-0.2 0.459 58.6 20.2-118.0 -9.6 -51.1 -22.3 29.4 16 370 A G E B 21 0A 25 5,-1.7 5,-2.9 69,-0.0 -1,-0.3 -0.985 360.0 360.0-160.5 155.0 -54.2 -23.0 27.2 17 371 A S 0 0 129 -2,-0.3 3,-0.2 3,-0.3 5,-0.0 -0.996 360.0 360.0-140.2 360.0 -55.9 -25.6 25.1 18 ! 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 19 375 A G 0 0 44 0, 0.0 2,-0.3 0, 0.0 18,-0.2 0.000 360.0 360.0 360.0-135.6 -55.4 -25.3 19.3 20 376 A L E - C 0 36A 68 16,-1.4 16,-2.2 -3,-0.2 2,-0.5 -0.681 360.0-149.1 -93.2 145.8 -52.8 -25.2 22.2 21 377 A V E -BC 16 35A 44 -5,-2.9 -6,-2.9 -2,-0.3 -5,-1.7 -0.967 16.0-171.0-116.7 125.1 -51.3 -22.0 23.7 22 378 A H E -BC 14 34A 37 12,-2.7 12,-3.2 -2,-0.5 2,-0.4 -0.954 23.8-130.3-118.9 138.8 -47.8 -22.1 25.2 23 379 A L E +BC 13 33A 37 -10,-3.4 -11,-2.4 -2,-0.4 -10,-1.7 -0.690 52.8 143.8 -79.2 132.1 -45.9 -19.5 27.2 24 380 A G E -BC 11 32A 0 8,-2.7 8,-3.0 -2,-0.4 2,-0.4 -0.887 45.4-105.8-155.0-172.6 -42.5 -19.1 25.5 25 381 A Y E -BC 10 31A 84 -15,-2.0 -15,-2.5 -2,-0.3 2,-0.5 -0.983 15.7-149.0-130.8 140.1 -39.6 -16.9 24.4 26 382 A W E >> S-BC 9 30A 9 4,-2.1 4,-1.6 -2,-0.4 3,-1.6 -0.959 88.7 -8.1-110.2 124.9 -38.6 -15.6 20.9 27 383 A L T 34 S- 0 0 20 -19,-2.8 -1,-0.2 -2,-0.5 -18,-0.1 0.741 119.1 -75.4 60.4 29.2 -34.9 -15.1 20.3 28 384 A N T 34 S+ 0 0 116 -20,-0.5 -1,-0.3 2,-0.1 3,-0.1 0.744 129.2 72.4 54.4 30.2 -34.4 -15.9 24.1 29 385 A K T <4 S+ 0 0 66 -3,-1.6 2,-0.4 1,-0.3 -2,-0.2 0.613 74.9 61.7-131.4 -68.7 -35.7 -12.3 24.8 30 386 A D E < S-C 26 0A 10 -4,-1.6 -4,-2.1 1,-0.1 -1,-0.3 -0.620 72.7-127.9 -80.4 131.0 -39.4 -11.6 24.3 31 387 A K E -C 25 0A 89 -2,-0.4 50,-1.0 -6,-0.2 2,-0.3 -0.561 41.6-179.4 -71.4 126.2 -42.0 -13.4 26.3 32 388 A V E -CD 24 80A 0 -8,-3.0 -8,-2.7 -2,-0.3 2,-0.6 -0.930 35.2-132.5-132.0 159.0 -44.5 -14.8 23.8 33 389 A A E -CD 23 79A 13 46,-2.2 46,-2.6 -2,-0.3 2,-0.6 -0.969 28.1-157.2-110.8 108.3 -47.8 -16.8 23.6 34 390 A I E -CD 22 78A 0 -12,-3.2 -12,-2.7 -2,-0.6 2,-0.8 -0.848 1.9-158.9 -93.7 116.5 -47.2 -19.5 21.0 35 391 A K E -CD 21 77A 27 42,-2.7 42,-2.0 -2,-0.6 2,-0.3 -0.857 7.8-161.9-100.3 102.5 -50.5 -20.8 19.5 36 392 A T E -CD 20 76A 13 -16,-2.2 -16,-1.4 -2,-0.8 40,-0.2 -0.697 25.6-109.1 -85.7 133.8 -49.9 -24.3 17.9 37 393 A I - 0 0 20 38,-2.5 2,-0.6 -2,-0.3 -17,-0.1 -0.235 23.4-119.9 -61.1 145.3 -52.6 -25.5 15.4 38 394 A R - 0 0 42 3,-0.4 -1,-0.1 1,-0.1 0, 0.0 -0.841 20.6-138.3 -88.4 117.7 -55.0 -28.3 16.3 39 395 A E S S+ 0 0 109 -2,-0.6 -1,-0.1 1,-0.2 5,-0.1 0.750 96.6 41.8 -46.8 -35.8 -54.4 -31.1 13.7 40 396 A G S S+ 0 0 77 1,-0.1 2,-0.2 3,-0.0 -1,-0.2 0.982 104.8 59.3 -77.8 -69.1 -58.1 -31.8 13.3 41 397 A A S S- 0 0 74 2,-0.0 -3,-0.4 0, 0.0 -1,-0.1 -0.494 102.4 -0.4 -74.2 134.7 -60.0 -28.4 13.3 42 398 A M S S- 0 0 74 -2,-0.2 2,-0.1 -5,-0.1 -4,-0.0 0.596 80.0 -90.1 64.2 146.3 -59.1 -25.8 10.5 43 399 A S > - 0 0 45 1,-0.1 4,-1.5 -6,-0.0 5,-0.1 -0.424 28.2-118.7 -81.0 158.9 -56.6 -25.9 7.6 44 400 A E H > S+ 0 0 92 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.832 114.1 55.2 -63.0 -36.5 -53.0 -24.7 7.8 45 401 A E H > S+ 0 0 140 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.858 107.4 46.6 -65.8 -44.0 -53.7 -22.1 5.1 46 402 A D H > S+ 0 0 112 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.837 109.2 56.4 -68.3 -35.7 -56.7 -20.4 6.9 47 403 A F H X S+ 0 0 12 -4,-1.5 4,-1.0 2,-0.2 -2,-0.2 0.872 112.4 41.3 -62.0 -42.6 -54.6 -20.4 10.2 48 404 A I H X S+ 0 0 30 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.863 111.6 54.8 -75.3 -39.6 -51.8 -18.3 8.4 49 405 A E H X S+ 0 0 114 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.846 104.5 56.0 -62.2 -36.4 -54.3 -16.1 6.5 50 406 A E H X S+ 0 0 12 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.886 109.4 46.2 -60.8 -43.5 -55.9 -15.1 9.9 51 407 A A H X S+ 0 0 0 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.856 108.7 55.1 -68.7 -38.9 -52.4 -14.0 11.1 52 408 A E H < S+ 0 0 44 -4,-2.0 4,-0.3 2,-0.2 -2,-0.2 0.846 109.8 47.3 -62.5 -38.0 -51.7 -12.0 7.9 53 409 A V H >< S+ 0 0 43 -4,-1.7 3,-1.1 1,-0.2 -2,-0.2 0.922 113.0 48.5 -68.0 -47.3 -55.0 -10.1 8.4 54 410 A M H >< S+ 0 0 1 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.813 103.2 61.0 -64.1 -35.4 -54.2 -9.4 12.1 55 411 A M T 3< S+ 0 0 7 -4,-2.1 244,-1.9 1,-0.3 -1,-0.2 0.623 105.3 48.9 -70.2 -12.4 -50.6 -8.2 11.3 56 412 A K T < S+ 0 0 126 -3,-1.1 2,-0.6 -4,-0.3 -1,-0.3 0.236 94.7 83.2-108.2 9.4 -52.1 -5.3 9.1 57 413 A L < - 0 0 15 -3,-1.4 2,-0.7 242,-0.1 240,-0.2 -0.921 60.2-175.1-118.5 99.5 -54.6 -4.2 11.8 58 414 A S + 0 0 1 238,-1.9 248,-0.3 -2,-0.6 240,-0.1 -0.864 22.8 133.6-105.7 105.3 -52.9 -1.8 14.3 59 415 A H > - 0 0 5 -2,-0.7 3,-2.0 3,-0.3 248,-0.1 -0.991 58.6-123.2-144.9 140.6 -55.0 -0.6 17.3 60 416 A P T 3 S+ 0 0 9 0, 0.0 247,-0.1 0, 0.0 4,-0.1 0.668 113.4 51.6 -59.8 -14.3 -54.0 -0.4 21.1 61 417 A K T 3 S+ 0 0 3 80,-0.1 81,-2.9 2,-0.1 2,-0.4 0.093 95.8 81.1-110.2 21.0 -57.1 -2.7 21.9 62 418 A L B < S-f 142 0B 0 -3,-2.0 -3,-0.3 79,-0.3 81,-0.2 -0.997 86.8-107.9-127.8 130.4 -56.3 -5.5 19.4 63 419 A V - 0 0 0 79,-2.4 2,-0.3 -2,-0.4 82,-0.1 -0.168 34.8-140.6 -56.4 144.6 -53.7 -8.3 20.1 64 420 A Q - 0 0 2 -4,-0.1 16,-2.4 -6,-0.1 2,-0.3 -0.811 5.9-144.4-112.3 154.5 -50.4 -8.1 18.2 65 421 A L E - E 0 79A 1 -2,-0.3 14,-0.3 234,-0.3 3,-0.1 -0.880 13.7-159.4-117.8 148.1 -48.2 -10.8 16.6 66 422 A Y E - 0 0 20 12,-3.2 2,-0.3 1,-0.3 13,-0.2 0.750 68.3 -78.3 -89.8 -32.3 -44.4 -11.1 16.3 67 423 A G E - E 0 78A 0 11,-1.4 11,-3.0 -63,-0.0 -1,-0.3 -0.991 46.8 -69.1 163.9-163.6 -44.8 -13.5 13.4 68 424 A V E -aE 3 77A 2 -66,-2.4 -64,-3.5 -2,-0.3 2,-0.7 -0.957 21.6-142.3-127.6 143.7 -45.6 -17.1 12.1 69 425 A C E + E 0 76A 9 7,-3.2 7,-1.7 -2,-0.3 -64,-0.1 -0.926 34.0 157.2-109.4 104.0 -43.7 -20.4 12.3 70 426 A L + 0 0 80 -2,-0.7 -1,-0.1 -66,-0.4 -65,-0.1 0.746 44.5 88.5 -95.7 -38.5 -44.3 -22.2 8.9 71 427 A E S S+ 0 0 141 -67,-0.3 2,-0.3 1,-0.1 4,-0.1 0.770 93.2 16.6 -34.7 -59.7 -41.4 -24.7 8.6 72 428 A Q S S- 0 0 60 2,-0.2 -1,-0.1 0, 0.0 -3,-0.0 -0.935 89.7 -72.7-130.4 152.3 -42.8 -27.8 10.3 73 429 A A S S+ 0 0 82 -2,-0.3 2,-0.1 1,-0.1 -3,-0.0 -0.600 108.5 50.3 -79.5 135.7 -46.1 -29.3 11.4 74 430 A P S S- 0 0 83 0, 0.0 -2,-0.2 0, 0.0 -1,-0.1 0.389 88.2-154.5 -80.1 131.0 -47.8 -28.3 13.8 75 431 A I - 0 0 5 -39,-0.1 -38,-2.5 -5,-0.1 2,-0.3 -0.336 12.6-157.9 -69.2 152.1 -47.5 -24.7 12.6 76 432 A C E -DE 36 69A 5 -7,-1.7 -7,-3.2 -40,-0.2 2,-0.4 -0.973 19.0-135.2-140.4 154.1 -47.8 -21.8 15.1 77 433 A L E -DE 35 68A 0 -42,-2.0 -42,-2.7 -2,-0.3 2,-0.8 -0.866 21.7-141.7-103.2 135.7 -48.6 -18.1 15.5 78 434 A V E -DE 34 67A 0 -11,-3.0 -12,-3.2 -2,-0.4 -11,-1.4 -0.880 27.8-179.6-104.9 101.4 -46.3 -16.1 17.7 79 435 A F E -DE 33 65A 12 -46,-2.6 -46,-2.2 -2,-0.8 -14,-0.3 -0.634 35.7 -97.1 -97.4 160.2 -48.4 -13.6 19.7 80 436 A E E -D 32 0A 30 -16,-2.4 2,-0.5 -2,-0.2 -48,-0.2 -0.415 51.2-105.4 -67.2 147.0 -47.3 -10.9 22.2 81 437 A F - 0 0 49 -50,-1.0 2,-0.6 -49,-0.1 -1,-0.1 -0.719 26.8-154.6 -84.5 126.9 -47.8 -12.3 25.8 82 438 A M > - 0 0 17 -2,-0.5 3,-1.6 1,-0.1 52,-0.2 -0.917 10.8-145.2-102.9 111.4 -50.8 -10.9 27.7 83 439 A E T 3 S+ 0 0 85 -2,-0.6 52,-0.2 1,-0.2 -1,-0.1 0.696 91.7 40.6 -47.6 -36.8 -50.0 -11.2 31.5 84 440 A H T 3 S- 0 0 78 50,-2.7 -1,-0.2 1,-0.3 51,-0.2 0.280 97.2-141.7-105.5 13.8 -53.5 -12.0 32.7 85 441 A G < - 0 0 31 -3,-1.6 49,-2.8 49,-0.4 -1,-0.3 -0.140 55.1 -1.4 63.8-157.9 -54.8 -14.5 30.0 86 442 A C B > -G 133 0B 28 47,-0.2 4,-2.2 1,-0.1 47,-0.3 -0.374 63.7-127.7 -71.2 142.6 -58.3 -14.6 28.6 87 443 A L H > S+ 0 0 0 45,-2.6 4,-2.5 42,-0.7 43,-0.2 0.852 105.5 59.7 -55.6 -42.6 -60.9 -12.3 29.9 88 444 A S H > S+ 0 0 24 41,-1.0 4,-1.3 44,-0.3 -1,-0.2 0.914 111.9 39.6 -54.8 -48.4 -63.5 -15.1 30.7 89 445 A D H > S+ 0 0 104 -3,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.899 114.4 53.6 -68.4 -43.8 -61.0 -16.8 33.1 90 446 A Y H X S+ 0 0 21 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.837 106.8 51.9 -60.1 -39.6 -59.8 -13.5 34.6 91 447 A L H < S+ 0 0 0 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.885 113.3 44.4 -64.7 -41.4 -63.3 -12.3 35.5 92 448 A R H >< S+ 0 0 47 -4,-1.3 3,-0.8 -5,-0.2 -2,-0.2 0.872 114.3 47.9 -71.1 -42.4 -64.1 -15.6 37.3 93 449 A T H 3< S+ 0 0 98 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.840 119.0 39.5 -68.5 -36.8 -60.7 -15.8 39.2 94 450 A Q T >< S+ 0 0 75 -4,-1.9 3,-1.8 -5,-0.2 4,-0.3 0.103 85.8 147.7-100.4 20.4 -61.0 -12.1 40.4 95 451 A R T < + 0 0 101 -3,-0.8 -3,-0.1 1,-0.2 87,-0.0 -0.332 66.9 21.4 -60.2 130.9 -64.8 -12.3 41.0 96 452 A G T 3 S+ 0 0 61 2,-0.1 -1,-0.2 -2,-0.1 -4,-0.1 0.233 108.3 80.7 93.4 -9.5 -65.9 -10.1 43.9 97 453 A L S < S+ 0 0 135 -3,-1.8 2,-0.3 2,-0.1 -2,-0.2 0.413 70.8 100.0-104.0 -4.0 -62.8 -7.9 43.7 98 454 A F - 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0 0 87 -3,-0.8 6,-0.2 1,-0.1 5,-0.1 -0.520 59.7-127.8 -72.9 136.8 -20.3 0.2 5.3 467 597 B E S S+ 0 0 67 -2,-0.2 -69,-0.3 4,-0.1 -1,-0.1 0.866 94.4 59.9 -52.2 -45.9 -19.9 2.7 2.4 468 598 B R S >> S- 0 0 172 1,-0.1 3,-1.1 -71,-0.1 4,-0.6 -0.733 77.9-142.6 -88.4 132.2 -21.9 0.6 -0.1 469 599 B P G >4 S+ 0 0 46 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.837 101.5 60.4 -62.7 -30.2 -25.6 -0.1 0.9 470 600 B E G 34 S+ 0 0 84 1,-0.2 -3,-0.0 -3,-0.0 -2,-0.0 0.701 100.9 55.0 -67.3 -23.4 -25.3 -3.6 -0.7 471 601 B D G <4 S+ 0 0 77 -3,-1.1 -1,-0.2 2,-0.1 -4,-0.1 0.648 90.5 91.0 -83.5 -20.1 -22.5 -4.4 1.8 472 602 B R S << S- 0 0 4 -3,-0.8 -8,-0.2 -4,-0.6 2,-0.1 -0.493 85.0-112.3 -74.4 143.8 -24.7 -3.5 4.9 473 603 B P - 0 0 14 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.490 30.2-110.9 -77.8 151.9 -26.7 -6.4 6.4 474 604 B A >> - 0 0 25 -2,-0.1 4,-2.6 1,-0.1 3,-0.6 -0.407 28.3-110.8 -73.9 156.5 -30.5 -6.4 6.2 475 605 B F H 3> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -119,-0.2 0.850 119.9 58.2 -56.2 -37.3 -32.6 -5.8 9.4 476 606 B S H 3> S+ 0 0 56 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.851 112.1 40.7 -60.4 -37.4 -33.8 -9.5 9.2 477 607 B R H <> S+ 0 0 158 -3,-0.6 4,-1.8 2,-0.2 3,-0.4 0.908 112.8 53.9 -75.9 -46.8 -30.1 -10.6 9.3 478 608 B L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.837 102.1 60.3 -55.3 -40.6 -29.1 -7.9 12.0 479 609 B L H X S+ 0 0 2 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.906 109.4 40.6 -55.0 -48.2 -31.8 -9.2 14.3 480 610 B R H X S+ 0 0 78 -4,-0.8 4,-1.9 -3,-0.4 -1,-0.2 0.821 114.0 53.8 -72.7 -32.6 -30.3 -12.7 14.5 481 611 B Q H X S+ 0 0 41 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.903 112.1 43.9 -67.3 -43.3 -26.7 -11.3 14.7 482 612 B L H X S+ 0 0 0 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.860 112.7 52.7 -68.6 -38.1 -27.7 -9.1 17.7 483 613 B A H X S+ 0 0 11 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.854 105.7 54.8 -64.8 -37.6 -29.7 -12.0 19.3 484 614 B E H X S+ 0 0 57 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.832 107.7 49.3 -64.9 -36.0 -26.6 -14.3 19.0 485 615 B I H X S+ 0 0 24 -4,-1.2 4,-0.8 2,-0.2 -1,-0.2 0.856 112.0 48.8 -70.9 -38.5 -24.4 -11.7 20.9 486 616 B A H < S+ 0 0 56 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.874 108.9 52.9 -68.1 -41.3 -27.1 -11.5 23.7 487 617 B E H < S+ 0 0 68 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.827 119.3 33.0 -64.4 -38.5 -27.4 -15.3 24.1 488 618 B S H < 0 0 98 -4,-1.3 -2,-0.1 -5,-0.1 -3,-0.1 0.948 360.0 360.0 -82.1 -82.6 -23.6 -15.8 24.5 489 619 B G < 0 0 89 -4,-0.8 -1,-0.1 -5,-0.2 -2,-0.1 -0.768 360.0 360.0 177.9 360.0 -22.0 -12.8 26.4