==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-APR-99 1QB0 . COMPND 2 MOLECULE: PROTEIN (M-PHASE INDUCER PHOSPHATASE 2 (CDC25B)); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.D.WATENPAUGH,R.A.REYNOLDS . 177 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9811.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 12 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 22.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.3 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 2 0 0 2 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 1 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 1 374 A D 0 0 116 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.2 7.5 23.3 41.7 2 375 A H + 0 0 196 2,-0.0 2,-0.2 10,-0.0 0, 0.0 0.360 360.0 73.4 -89.3 6.8 4.6 23.1 39.2 3 376 A R S S- 0 0 66 1,-0.1 2,-0.0 10,-0.1 0, 0.0 -0.591 88.4 -89.9-112.9 179.9 5.4 19.6 37.9 4 377 A E - 0 0 112 -2,-0.2 9,-0.6 1,-0.1 -1,-0.1 -0.277 55.6 -88.5 -75.6 174.5 5.1 16.1 39.2 5 378 A L B -A 12 0A 82 7,-0.2 7,-0.2 1,-0.1 -1,-0.1 -0.317 48.8 -88.0 -76.8 165.7 8.0 14.5 41.1 6 379 A I > - 0 0 1 5,-2.9 3,-2.9 1,-0.1 125,-0.2 -0.129 58.6 -78.1 -70.1 172.0 10.9 12.6 39.6 7 380 A G T 3 S+ 0 0 6 123,-2.4 124,-0.1 1,-0.3 -1,-0.1 0.591 131.8 43.2 -51.4 -28.1 10.6 8.9 38.9 8 381 A D T 3 S- 0 0 41 3,-0.1 -1,-0.3 119,-0.1 -2,-0.1 0.225 108.2-122.8-101.9 10.7 11.3 7.7 42.5 9 382 A Y S < S+ 0 0 110 -3,-2.9 -2,-0.1 121,-0.1 3,-0.1 0.723 75.0 126.4 53.3 31.4 9.0 10.4 43.8 10 383 A S S S- 0 0 57 1,-0.2 2,-0.3 -4,-0.1 -1,-0.1 0.844 73.9 -26.1 -85.2 -36.2 11.8 11.8 46.0 11 384 A K S S- 0 0 83 -5,-0.0 -5,-2.9 -7,-0.0 -1,-0.2 -0.944 77.6 -65.7-166.2 177.1 11.8 15.4 44.9 12 385 A A B -A 5 0A 31 -2,-0.3 -7,-0.2 -7,-0.2 2,-0.1 -0.308 59.0 -90.8 -73.6 156.6 11.0 17.9 42.1 13 386 A F - 0 0 19 -9,-0.6 -1,-0.1 1,-0.1 -10,-0.1 -0.450 35.6-145.1 -63.0 140.5 12.7 17.9 38.7 14 387 A L + 0 0 41 -2,-0.1 2,-0.2 -3,-0.1 -1,-0.1 0.852 69.9 65.5 -79.2 -35.7 15.7 20.3 39.0 15 388 A L S S- 0 0 1 1,-0.1 2,-0.1 13,-0.0 -2,-0.0 -0.623 83.6-110.3 -98.8 155.8 15.8 21.8 35.5 16 389 A Q - 0 0 163 -2,-0.2 13,-0.3 13,-0.0 2,-0.3 -0.488 40.8-154.5 -69.9 142.7 13.4 24.0 33.6 17 390 A T - 0 0 43 11,-0.1 2,-0.3 -2,-0.1 11,-0.2 -0.843 8.0-149.1-122.7 162.1 11.8 22.1 30.8 18 391 A V B -B 27 0B 62 9,-2.0 9,-0.7 -2,-0.3 2,-0.1 -0.814 37.3 -82.4-124.9 161.6 10.2 23.1 27.4 19 392 A D + 0 0 122 -2,-0.3 2,-0.3 7,-0.1 4,-0.1 -0.427 52.2 174.0 -65.5 138.6 7.4 21.5 25.4 20 393 A G - 0 0 7 5,-0.2 5,-0.1 2,-0.2 84,-0.1 -0.883 45.0 -92.9-138.1 171.1 8.5 18.5 23.2 21 394 A K S S+ 0 0 109 -2,-0.3 2,-1.0 1,-0.1 3,-0.1 0.823 112.9 62.1 -57.2 -42.2 6.7 15.9 21.0 22 395 A H S > S- 0 0 46 1,-0.2 3,-1.9 2,-0.0 -2,-0.2 -0.820 76.7-161.2 -89.5 101.1 6.2 13.2 23.7 23 396 A Q T 3 S+ 0 0 163 -2,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.688 84.8 54.3 -62.2 -22.2 4.0 15.2 26.1 24 397 A D T 3 S+ 0 0 96 -3,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.345 97.1 80.2 -90.4 1.2 4.7 12.9 29.0 25 398 A L S < S- 0 0 31 -3,-1.9 2,-0.5 -5,-0.1 -5,-0.2 -0.660 80.7-118.6-108.0 162.9 8.6 13.2 28.7 26 399 A K - 0 0 27 106,-0.4 108,-2.6 -2,-0.2 2,-0.3 -0.915 29.2-169.7-107.4 121.9 10.7 16.1 30.0 27 400 A Y E -Bc 18 134B 5 -9,-0.7 -9,-2.0 -2,-0.5 2,-0.3 -0.867 4.4-158.7-110.3 147.1 12.8 18.1 27.5 28 401 A I E - c 0 135B 0 106,-2.5 108,-2.6 -2,-0.3 -11,-0.1 -0.839 17.7-120.1-118.4 159.0 15.5 20.7 28.1 29 402 A S > - 0 0 29 -13,-0.3 4,-2.0 -2,-0.3 3,-0.2 -0.457 31.2-104.3 -89.4 166.9 16.8 23.5 25.8 30 403 A P H > S+ 0 0 22 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.876 122.4 56.9 -55.6 -37.0 20.4 23.9 24.6 31 404 A E H > S+ 0 0 142 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.916 106.3 48.0 -66.1 -36.1 20.8 26.7 27.2 32 405 A T H > S+ 0 0 21 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.876 108.8 54.8 -70.2 -33.7 19.8 24.4 30.0 33 406 A M H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.914 108.4 48.9 -65.6 -40.2 22.3 21.7 28.7 34 407 A V H X S+ 0 0 21 -4,-2.3 4,-2.1 2,-0.2 6,-0.2 0.869 104.6 59.3 -66.4 -32.7 25.0 24.4 28.8 35 408 A A H <>S+ 0 0 10 -4,-1.8 5,-2.3 1,-0.2 6,-0.5 0.929 108.5 45.1 -64.2 -37.3 24.0 25.3 32.4 36 409 A L H ><5S+ 0 0 7 -4,-1.8 3,-1.5 1,-0.2 -1,-0.2 0.950 113.3 49.9 -67.2 -45.9 24.7 21.7 33.3 37 410 A L H 3<5S+ 0 0 37 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.736 110.9 50.1 -66.0 -23.2 28.0 21.7 31.4 38 411 A T T 3<5S- 0 0 85 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.388 115.4-111.7 -93.1 2.1 29.2 25.0 33.0 39 412 A G T X 5 + 0 0 31 -3,-1.5 3,-2.0 -4,-0.3 4,-0.2 0.730 65.7 147.7 78.3 19.9 28.5 23.8 36.6 40 413 A K T 3 > S+ 0 0 51 -6,-0.5 4,-3.5 1,-0.1 3,-1.7 0.033 80.8 128.5-114.4 28.7 24.0 23.5 39.4 42 415 A S T <4 + 0 0 77 -3,-2.0 -1,-0.1 1,-0.3 -2,-0.1 0.730 65.2 62.9 -61.2 -23.6 27.3 22.0 40.8 43 416 A N T 34 S+ 0 0 145 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.833 121.8 21.0 -70.4 -24.0 26.2 22.3 44.4 44 417 A I T <4 S+ 0 0 66 -3,-1.7 49,-2.7 1,-0.2 2,-0.8 0.772 111.1 70.3-110.3 -39.3 23.4 19.9 43.7 45 418 A V E < +d 93 0B 15 -4,-3.5 49,-0.2 47,-0.2 -1,-0.2 -0.762 49.5 174.3 -91.8 111.3 24.2 17.9 40.6 46 419 A D E + 0 0 42 47,-2.0 2,-0.3 -2,-0.8 48,-0.2 0.896 69.6 5.7 -80.3 -43.4 27.1 15.5 41.4 47 420 A K E -d 94 0B 73 46,-1.6 48,-1.8 38,-0.1 2,-0.4 -0.996 57.3-179.0-141.3 147.4 27.0 13.7 38.0 48 421 A F E -d 95 0B 54 -2,-0.3 2,-0.5 46,-0.2 48,-0.2 -0.991 11.9-156.7-143.1 139.4 25.2 14.0 34.7 49 422 A V E -d 96 0B 20 46,-1.9 48,-2.5 -2,-0.4 2,-0.7 -0.959 6.3-152.2-115.5 128.9 25.6 11.7 31.7 50 423 A I E -d 97 0B 2 -2,-0.5 18,-2.4 16,-0.3 2,-0.8 -0.895 14.1-159.1 -98.7 117.1 24.8 12.9 28.2 51 424 A V E -de 98 68B 0 46,-3.4 48,-1.9 -2,-0.7 2,-0.7 -0.882 2.0-162.2-100.3 105.1 23.8 9.8 26.2 52 425 A D E -de 99 69B 0 16,-2.6 18,-2.0 -2,-0.8 48,-0.2 -0.837 5.6-173.0 -87.5 111.6 24.2 10.5 22.5 53 426 A C + 0 0 3 46,-2.8 47,-0.2 -2,-0.7 -1,-0.1 0.132 44.5 114.5 -93.8 13.4 22.1 7.7 20.9 54 427 A R S S- 0 0 0 45,-0.2 -2,-0.1 1,-0.1 45,-0.0 -0.374 78.6 -84.8 -79.3 170.4 23.2 8.5 17.3 55 428 A Y >> - 0 0 18 1,-0.1 4,-1.9 16,-0.1 3,-1.0 -0.309 45.5-101.4 -74.2 154.8 25.2 6.0 15.2 56 429 A P H 3> S+ 0 0 44 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.847 119.3 54.2 -49.8 -41.2 29.0 6.1 15.6 57 430 A Y H 3> S+ 0 0 10 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.880 108.5 51.0 -65.6 -29.9 29.8 8.0 12.5 58 431 A E H <4 S+ 0 0 0 -3,-1.0 98,-0.4 2,-0.2 3,-0.3 0.953 111.5 47.0 -68.3 -46.5 27.4 10.7 13.5 59 432 A Y H >< S+ 0 0 46 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.908 111.1 51.4 -60.0 -42.3 29.1 11.0 17.0 60 433 A E H 3< S+ 0 0 121 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.812 102.1 61.7 -69.1 -23.1 32.5 11.0 15.4 61 434 A G T 3< S- 0 0 6 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.457 132.6 -39.8 -78.0 -3.3 31.5 13.9 13.1 62 435 A G < + 0 0 0 -3,-1.6 94,-0.3 89,-0.2 -1,-0.3 -0.108 67.1 173.3 140.9 116.8 30.8 16.1 16.1 63 436 A H E -G 151 0C 27 88,-1.6 88,-3.0 89,-0.2 2,-0.2 -0.859 42.5 -82.1-139.9 170.7 29.2 15.5 19.5 64 437 A I E > -G 150 0C 0 -2,-0.3 3,-2.1 86,-0.2 86,-0.3 -0.583 60.5 -92.9 -79.9 138.2 28.7 17.5 22.7 65 438 A K T 3 S+ 0 0 87 84,-2.7 -1,-0.1 1,-0.3 3,-0.1 -0.310 109.2 13.1 -54.1 135.7 31.8 17.5 25.0 66 439 A T T 3 S+ 0 0 108 1,-0.3 -16,-0.3 -3,-0.1 -1,-0.3 0.201 92.3 139.1 81.9 -10.4 31.8 14.7 27.6 67 440 A A < - 0 0 5 -3,-2.1 2,-0.4 -18,-0.1 -1,-0.3 -0.367 45.3-140.2 -68.6 151.6 28.9 12.8 25.9 68 441 A V E -e 51 0B 31 -18,-2.4 -16,-2.6 -3,-0.1 2,-0.8 -0.869 12.9-130.6-107.8 136.4 29.1 9.1 25.7 69 442 A N E +e 52 0B 35 -2,-0.4 -16,-0.2 -18,-0.2 -18,-0.1 -0.799 39.4 155.2 -94.4 112.5 27.9 7.3 22.5 70 443 A L + 0 0 11 -18,-2.0 6,-0.1 -2,-0.8 -15,-0.1 -0.612 4.0 153.2-134.7 71.2 25.4 4.4 23.3 71 444 A P + 0 0 22 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.747 57.2 71.6 -73.1 -25.8 23.3 3.8 20.2 72 445 A L S >> S- 0 0 14 1,-0.1 4,-2.4 102,-0.1 3,-0.6 -0.811 79.2-134.5 -95.6 138.4 22.5 0.1 20.9 73 446 A E H 3> S+ 0 0 27 -2,-0.4 4,-3.4 1,-0.3 5,-0.2 0.872 104.6 55.7 -52.1 -46.9 20.2 -0.8 23.8 74 447 A R H 3> S+ 0 0 126 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.847 110.7 44.4 -59.1 -34.6 22.5 -3.5 25.1 75 448 A D H <> S+ 0 0 75 -3,-0.6 4,-2.6 2,-0.2 5,-0.2 0.905 112.5 49.9 -81.3 -36.4 25.3 -1.1 25.3 76 449 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.937 113.3 49.4 -64.4 -42.9 23.3 1.7 27.0 77 450 A E H X>S+ 0 0 60 -4,-3.4 4,-3.1 -5,-0.2 5,-0.7 0.947 113.4 44.1 -60.8 -49.2 22.0 -1.0 29.5 78 451 A S H X>S+ 0 0 62 -4,-2.1 4,-1.4 -5,-0.2 5,-0.6 0.947 116.2 46.3 -60.9 -47.3 25.4 -2.3 30.3 79 452 A F H <5S+ 0 0 95 -4,-2.6 -1,-0.2 1,-0.2 4,-0.2 0.889 124.7 31.5 -62.5 -43.5 27.1 1.1 30.6 80 453 A L H <>S+ 0 0 0 -4,-2.4 5,-0.6 -5,-0.2 -2,-0.2 0.794 131.1 26.0 -85.9 -34.4 24.3 2.6 32.7 81 454 A L H <5S+ 0 0 22 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.1 0.552 97.5 76.4-113.3 -13.2 23.0 -0.4 34.7 82 455 A K T < S- 0 0 40 3,-0.0 3,-1.8 1,-0.0 -43,-0.1 -0.985 75.2-140.9-141.1 133.6 26.9 12.3 48.3 90 463 A L T 3 S+ 0 0 173 -2,-0.3 -2,-0.0 1,-0.3 -1,-0.0 0.634 104.1 63.8 -70.0 -9.9 23.2 11.4 49.2 91 464 A D T 3 S+ 0 0 146 2,-0.1 -1,-0.3 -3,-0.0 2,-0.2 0.638 98.4 73.4 -82.6 -15.3 22.4 15.1 49.2 92 465 A K S < S- 0 0 59 -3,-1.8 2,-0.3 -47,-0.1 -47,-0.2 -0.585 72.9-129.5-103.7 164.3 23.3 15.3 45.5 93 466 A R E -d 45 0B 34 -49,-2.7 -47,-2.0 -2,-0.2 -46,-1.6 -0.787 2.3-149.9-112.5 159.3 21.7 14.1 42.2 94 467 A V E -d 47 0B 12 -2,-0.3 2,-0.4 -48,-0.2 37,-0.3 -0.936 24.3-171.5-116.9 134.5 22.7 12.1 39.2 95 468 A I E -d 48 0B 0 -48,-1.8 -46,-1.9 -2,-0.4 2,-0.4 -0.991 12.4-148.7-129.4 140.5 20.7 13.2 36.0 96 469 A L E -df 49 132B 0 35,-2.0 37,-2.7 -2,-0.4 2,-0.5 -0.916 7.1-167.0-106.9 139.2 20.7 11.6 32.5 97 470 A I E -df 50 133B 0 -48,-2.5 -46,-3.4 -2,-0.4 2,-0.4 -0.993 8.7-166.4-121.0 121.5 20.2 13.6 29.3 98 471 A F E +df 51 134B 0 35,-3.1 37,-2.4 -2,-0.5 2,-0.3 -0.880 16.2 156.3-108.1 150.5 19.4 11.6 26.1 99 472 A H E -d 52 0B 0 -48,-1.9 -46,-2.8 -2,-0.4 -45,-0.2 -0.987 17.1-179.1-159.7 161.3 19.5 13.0 22.6 100 473 A C - 0 0 3 -2,-0.3 39,-2.5 35,-0.3 40,-0.3 -0.332 61.2 -59.4-135.2-138.9 19.9 11.9 19.0 101 474 A E S S+ 0 0 7 37,-0.2 39,-2.3 38,-0.2 40,-0.4 0.972 134.4 2.5 -78.6 -49.0 20.1 14.0 15.8 102 475 A F S S- 0 0 105 36,-0.2 35,-0.6 37,-0.1 36,-0.3 0.329 92.6-126.7-110.4 -2.6 16.6 15.6 16.2 103 476 A S S S+ 0 0 4 34,-0.2 34,-0.1 33,-0.1 35,-0.1 0.837 81.2 113.4 55.5 32.3 15.8 14.0 19.5 104 477 A S S S- 0 0 42 33,-0.1 -1,-0.1 32,-0.1 34,-0.0 0.853 86.4 -6.0 -97.5 -51.0 12.6 12.9 17.8 105 478 A E S > S+ 0 0 127 3,-0.1 4,-1.9 2,-0.1 5,-0.2 0.831 129.1 43.9-112.9 -58.2 12.9 9.1 17.6 106 479 A R H > S+ 0 0 45 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.930 113.8 48.1 -62.0 -50.2 16.1 7.6 18.8 107 480 A G H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.938 113.4 45.6 -57.9 -56.3 16.6 9.6 21.9 108 481 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.898 111.9 52.1 -56.8 -41.2 13.1 9.2 23.3 109 482 A R H X S+ 0 0 137 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.912 110.6 46.5 -63.8 -40.8 13.0 5.5 22.7 110 483 A M H X S+ 0 0 10 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.904 110.6 54.0 -69.8 -38.3 16.3 4.9 24.5 111 484 A C H X S+ 0 0 9 -4,-2.4 4,-2.4 -5,-0.2 5,-0.2 0.963 111.1 45.3 -59.2 -48.9 15.2 7.0 27.4 112 485 A R H X S+ 0 0 82 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.896 111.6 52.8 -61.2 -40.1 12.0 4.9 27.7 113 486 A F H X S+ 0 0 23 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.939 109.0 48.4 -62.1 -46.5 13.9 1.6 27.4 114 487 A I H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.929 110.8 51.9 -64.1 -37.4 16.4 2.6 30.2 115 488 A R H X S+ 0 0 60 -4,-2.4 4,-2.7 -5,-0.2 5,-0.2 0.927 108.6 51.7 -63.2 -39.8 13.4 3.6 32.4 116 489 A E H X S+ 0 0 122 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.944 113.2 43.2 -59.5 -46.7 11.8 0.2 31.7 117 490 A R H X S+ 0 0 79 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.898 111.8 54.4 -67.9 -35.2 15.0 -1.7 32.7 118 491 A D H < S+ 0 0 0 -4,-2.6 4,-0.5 -5,-0.2 -2,-0.2 0.942 110.6 46.4 -63.6 -43.4 15.5 0.6 35.7 119 492 A R H >< S+ 0 0 65 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.940 110.2 55.5 -62.0 -45.0 12.0 -0.3 36.9 120 493 A A H 3< S+ 0 0 64 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.871 109.7 43.8 -58.1 -38.9 12.6 -4.0 36.3 121 494 A V T 3< S+ 0 0 77 -4,-2.2 2,-0.3 -5,-0.1 -1,-0.3 0.483 109.2 62.9 -91.6 3.4 15.7 -4.2 38.4 122 495 A N S < S- 0 0 35 -3,-1.3 2,-0.6 -4,-0.5 5,-0.0 -0.824 85.7-107.3-120.2 169.5 14.4 -2.2 41.4 123 496 A D S > S- 0 0 141 -2,-0.3 3,-1.8 1,-0.0 -3,-0.1 -0.861 71.5 -69.5 -91.9 119.5 11.7 -2.6 44.1 124 497 A Y T 3 S+ 0 0 170 -2,-0.6 3,-0.1 1,-0.3 -116,-0.1 -0.222 116.1 15.3 -51.6 140.0 9.1 0.1 43.0 125 498 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.3 0, 0.0 -116,-0.0 -0.944 99.7 99.0 -99.5 17.1 9.4 3.0 43.2 126 499 A S < + 0 0 65 -3,-1.8 2,-0.3 -7,-0.1 -4,-0.1 -0.238 46.2 177.6 -59.2 148.6 13.1 3.2 43.7 127 500 A L - 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0 0 0 -3,-1.9 4,-1.7 -36,-0.3 3,-0.6 -0.093 53.8 -35.2 63.2-163.5 19.0 17.1 19.5 139 512 A Y H 3> S+ 0 0 0 -39,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.894 132.9 67.6 -64.4 -34.1 22.5 17.7 18.3 140 513 A K H 34 S+ 0 0 73 -39,-2.3 -1,-0.2 -40,-0.3 -2,-0.2 0.873 111.5 31.6 -52.8 -40.6 21.1 19.4 15.1 141 514 A E H << S+ 0 0 88 -4,-1.2 4,-0.5 -3,-0.6 -1,-0.2 0.669 117.3 57.3 -92.3 -16.2 19.7 22.3 17.2 142 515 A F H >X S+ 0 0 0 -4,-1.7 4,-2.5 -5,-0.2 3,-1.3 0.949 99.1 57.0 -79.1 -44.9 22.5 22.2 19.8 143 516 A F T 3< S+ 0 0 42 -4,-2.7 6,-0.1 1,-0.3 -1,-0.1 0.910 104.6 50.6 -52.7 -47.7 25.5 22.7 17.5 144 517 A P T 34 S+ 0 0 80 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.742 116.3 43.0 -65.6 -19.0 24.3 25.9 15.9 145 518 A Q T <4 S+ 0 0 128 -3,-1.3 -2,-0.2 -4,-0.5 -3,-0.1 0.847 131.3 15.6 -89.9 -42.3 23.7 27.4 19.4 146 519 A H >< + 0 0 40 -4,-2.5 3,-2.6 1,-0.1 -1,-0.1 -0.427 62.8 158.5-133.8 61.6 26.9 26.3 21.2 147 520 A P G > S+ 0 0 50 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.832 75.8 61.5 -59.9 -28.2 29.6 25.1 18.8 148 521 A N G 3 S+ 0 0 110 1,-0.3 -5,-0.1 -5,-0.1 5,-0.0 0.616 97.0 60.8 -76.2 -3.3 32.4 25.6 21.3 149 522 A F G < S+ 0 0 59 -3,-2.6 -84,-2.7 -6,-0.1 2,-0.3 0.278 98.2 79.2-101.0 17.1 30.6 23.0 23.6 150 523 A C E < S-G 64 0C 3 -3,-1.6 -86,-0.2 -86,-0.3 3,-0.1 -0.884 74.1-127.3-123.2 153.1 31.1 20.4 20.8 151 524 A E E S+G 63 0C 110 -88,-3.0 -88,-1.6 -2,-0.3 -89,-0.2 -0.971 95.8 18.6-148.7 124.8 34.0 18.3 19.7 152 525 A P S S- 0 0 52 0, 0.0 2,-2.3 0, 0.0 -1,-0.2 0.773 97.6-122.7 -67.5 164.7 34.9 18.2 16.9 153 526 A Q S S+ 0 0 108 -2,-0.2 2,-0.3 -91,-0.1 -91,-0.1 -0.451 77.8 81.7 -77.3 72.0 33.2 21.5 16.0 154 527 A D - 0 0 101 -2,-2.3 2,-0.4 -91,-0.1 -3,-0.1 -0.909 68.0-123.4-158.4 179.2 31.0 20.1 13.1 155 528 A Y - 0 0 57 -2,-0.3 -93,-0.1 -12,-0.0 -96,-0.1 -0.983 14.4-173.0-136.7 120.4 27.8 18.3 12.4 156 529 A R - 0 0 64 -98,-0.4 -95,-0.2 -2,-0.4 -94,-0.1 -0.919 22.4-142.0-116.4 108.4 27.4 15.0 10.4 157 530 A P > - 0 0 41 0, 0.0 3,-1.6 0, 0.0 -2,-0.0 -0.224 19.2-117.9 -65.5 157.4 23.7 14.1 9.8 158 531 A M T 3 S+ 0 0 26 1,-0.3 9,-0.1 -100,-0.0 5,-0.1 0.919 116.6 49.7 -60.2 -41.7 22.5 10.6 9.9 159 532 A N T 3 S+ 0 0 117 3,-0.0 -1,-0.3 8,-0.0 5,-0.1 0.224 79.6 152.3 -85.4 20.4 21.5 10.8 6.2 160 533 A H X - 0 0 74 -3,-1.6 3,-2.2 1,-0.1 4,-0.0 -0.257 50.2-128.0 -57.3 129.7 24.9 12.2 5.1 161 534 A E G > S+ 0 0 140 1,-0.3 3,-0.6 2,-0.2 -1,-0.1 0.711 103.0 50.8 -49.6 -37.1 25.5 11.2 1.5 162 535 A A G 3 S+ 0 0 68 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.357 105.7 56.6 -88.0 5.0 29.0 9.7 2.1 163 536 A F G <> + 0 0 32 -3,-2.2 4,-2.0 1,-0.1 -1,-0.2 0.140 61.6 116.8-126.4 27.3 27.9 7.4 5.0 164 537 A K H <> S+ 0 0 107 -3,-0.6 4,-1.6 1,-0.2 5,-0.1 0.855 81.3 48.7 -62.2 -33.7 25.1 5.3 3.5 165 538 A D H > S+ 0 0 117 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.892 109.2 52.5 -73.6 -39.1 27.1 2.1 3.9 166 539 A E H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.848 106.6 55.2 -62.0 -34.1 28.0 2.9 7.5 167 540 A L H X S+ 0 0 25 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.911 111.0 43.0 -63.9 -47.7 24.2 3.5 8.2 168 541 A K H X S+ 0 0 134 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.890 111.0 54.7 -67.2 -40.2 23.3 0.0 7.0 169 542 A T H < S+ 0 0 80 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.899 111.5 46.1 -59.5 -41.9 26.2 -1.7 8.7 170 543 A F H >< S+ 0 0 12 -4,-1.9 3,-2.2 1,-0.2 4,-0.4 0.922 107.2 56.0 -66.5 -47.3 25.1 -0.2 12.0 171 544 A R H >< S+ 0 0 102 -4,-2.0 3,-1.5 1,-0.3 -1,-0.2 0.837 98.6 62.4 -54.7 -35.2 21.4 -1.1 11.6 172 545 A L T 3< S+ 0 0 128 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.491 98.5 58.5 -72.9 0.7 22.3 -4.7 11.1 173 546 A K T < S+ 0 0 105 -3,-2.2 -1,-0.3 -4,-0.1 -2,-0.2 0.487 83.8 106.1-100.6 -7.5 23.7 -4.6 14.7 174 547 A T S < S- 0 0 39 -3,-1.5 3,-0.1 -4,-0.4 -102,-0.1 -0.286 75.5-125.0 -74.8 156.6 20.4 -3.6 16.3 175 548 A R S S+ 0 0 156 1,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.819 86.8 0.3 -71.3 -25.6 18.3 -6.0 18.4 176 549 A S 0 0 58 1,-0.1 -1,-0.2 -5,-0.1 -3,-0.0 -0.984 360.0 360.0-161.9 151.9 15.1 -5.3 16.3 177 550 A W 0 0 231 -2,-0.3 -1,-0.1 -3,-0.1 -2,-0.0 0.279 360.0 360.0-128.3 360.0 13.8 -3.4 13.3