==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 24-MAY-12 4FCD . COMPND 2 MOLECULE: CAMP AND CAMP-INHIBITED CGMP 3',5'-CYCLIC PHOSPHO . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.D.PARRIS . 632 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28018.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 472 74.7 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 . 0 0.0 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 . 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 . 20 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 347 54.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.1 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 1 2 0 1 1 0 4 2 4 2 0 2 6 2 0 0 0 0 0 1 1 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 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 . 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 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 1 438 A M 0 0 108 0, 0.0 2,-0.4 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 126.4 -2.7 -0.1 -28.0 2 439 A S - 0 0 49 65,-0.2 2,-0.3 66,-0.1 68,-0.1 -0.805 360.0-156.1-107.0 136.0 -3.1 -2.8 -25.3 3 440 A I - 0 0 99 -2,-0.4 2,-0.1 67,-0.1 64,-0.0 -0.835 15.7-121.9-113.2 143.6 -3.7 -2.1 -21.5 4 441 A C - 0 0 15 -2,-0.3 2,-0.2 59,-0.3 63,-0.1 -0.380 30.5-114.9 -75.9 159.8 -3.0 -4.3 -18.5 5 442 A T > - 0 0 71 -2,-0.1 4,-1.6 61,-0.1 3,-0.4 -0.526 23.0-108.8 -92.5 163.8 -5.8 -5.2 -16.0 6 443 A S H > S+ 0 0 63 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.906 118.5 53.7 -53.7 -48.4 -6.2 -4.3 -12.3 7 444 A E H > S+ 0 0 75 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.809 106.5 54.5 -58.4 -34.4 -5.3 -7.8 -11.2 8 445 A E H > S+ 0 0 45 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.957 113.3 35.1 -68.4 -55.7 -2.1 -7.8 -13.2 9 446 A W H X S+ 0 0 26 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.846 118.9 50.7 -73.5 -34.5 -0.3 -4.7 -11.9 10 447 A Q H X S+ 0 0 90 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.874 109.9 52.0 -66.7 -39.1 -1.6 -5.1 -8.3 11 448 A G H X S+ 0 0 40 -4,-1.5 4,-0.7 -5,-0.3 -2,-0.2 0.899 110.3 48.2 -59.0 -43.4 -0.4 -8.7 -8.5 12 449 A L H >< S+ 0 0 14 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.869 107.8 55.0 -65.1 -39.1 3.0 -7.3 -9.6 13 450 A M H 3< S+ 0 0 71 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.874 106.9 51.8 -57.7 -39.9 2.8 -4.7 -6.7 14 451 A Q H 3< S+ 0 0 161 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.694 90.0 111.9 -67.6 -23.0 2.4 -7.6 -4.3 15 452 A F << - 0 0 66 -4,-0.7 2,-0.4 -3,-0.6 -3,-0.0 -0.227 43.3-173.8 -67.4 139.2 5.4 -9.5 -5.7 16 453 A T - 0 0 118 29,-0.0 25,-0.1 0, 0.0 -2,-0.0 -0.977 24.9-121.1-125.3 144.3 8.7 -10.1 -3.7 17 454 A L - 0 0 25 -2,-0.4 2,-0.1 24,-0.1 5,-0.0 -0.619 31.5-105.3 -83.4 140.5 11.8 -11.6 -5.2 18 455 A P >> - 0 0 46 0, 0.0 4,-0.8 0, 0.0 3,-0.7 -0.400 27.6-123.2 -61.8 142.4 13.3 -14.8 -3.7 19 456 A V H >> S+ 0 0 130 1,-0.2 3,-1.1 2,-0.2 4,-0.6 0.894 106.2 58.3 -53.5 -50.7 16.5 -14.2 -1.7 20 457 A R H 3> S+ 0 0 79 1,-0.3 4,-1.0 2,-0.2 3,-0.5 0.801 100.9 57.0 -53.5 -36.2 18.7 -16.6 -3.7 21 458 A L H <> S+ 0 0 1 -3,-0.7 4,-3.5 1,-0.2 5,-0.3 0.818 89.1 74.5 -67.2 -33.4 18.1 -14.7 -6.9 22 459 A C H << S+ 0 0 38 -3,-1.1 4,-0.4 -4,-0.8 -1,-0.2 0.857 101.2 41.7 -50.2 -44.7 19.3 -11.3 -5.6 23 460 A K H >< S+ 0 0 173 -4,-0.6 3,-0.6 -3,-0.5 -1,-0.2 0.900 118.1 47.0 -68.0 -41.7 23.0 -12.5 -5.8 24 461 A E H >< S+ 0 0 34 -4,-1.0 3,-2.0 1,-0.2 6,-0.3 0.876 101.2 62.4 -72.3 -40.0 22.5 -14.1 -9.2 25 462 A I T 3< S+ 0 0 0 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.1 0.675 96.1 64.8 -59.3 -18.6 20.6 -11.3 -10.9 26 463 A E T < S+ 0 0 39 -3,-0.6 -1,-0.3 -4,-0.4 2,-0.2 0.670 87.4 88.6 -75.7 -20.3 23.8 -9.2 -10.3 27 464 A L S X S- 0 0 77 -3,-2.0 3,-1.1 -4,-0.2 65,-0.1 -0.541 76.8-132.6 -91.1 148.3 25.9 -11.3 -12.6 28 465 A F T 3 S+ 0 0 18 1,-0.2 -1,-0.1 -2,-0.2 64,-0.1 0.877 104.9 55.2 -60.2 -41.4 26.3 -10.9 -16.4 29 466 A H T 3 S+ 0 0 62 2,-0.1 205,-0.3 204,-0.1 -1,-0.2 0.477 76.2 133.8 -76.5 -3.8 25.7 -14.6 -17.1 30 467 A F < - 0 0 7 -3,-1.1 2,-0.6 -6,-0.3 -5,-0.0 -0.220 43.8-152.8 -53.8 129.1 22.3 -14.7 -15.3 31 468 A D - 0 0 9 1,-0.1 -1,-0.1 202,-0.0 -2,-0.1 -0.941 11.4-164.8-108.4 118.5 19.6 -16.4 -17.4 32 469 A I > + 0 0 2 -2,-0.6 3,-2.2 1,-0.2 6,-0.1 0.613 64.4 103.5 -72.9 -13.9 16.0 -15.3 -16.7 33 470 A G G > S+ 0 0 23 1,-0.3 3,-0.6 2,-0.1 -1,-0.2 0.786 73.8 50.4 -37.5 -56.5 14.7 -18.5 -18.5 34 471 A P G 3 S+ 0 0 2 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.382 107.1 56.9 -71.0 4.7 13.6 -20.6 -15.5 35 472 A F G X + 0 0 10 -3,-2.2 3,-1.5 1,-0.1 4,-0.4 -0.211 54.7 150.3-133.7 44.4 11.6 -17.8 -13.9 36 473 A E G X S+ 0 0 97 -3,-0.6 3,-1.8 1,-0.3 -1,-0.1 0.857 75.9 51.5 -48.6 -49.9 8.9 -16.6 -16.4 37 474 A N G 3 S+ 0 0 98 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.775 108.8 54.1 -58.6 -28.4 6.3 -15.6 -13.7 38 475 A M G <> S+ 0 0 19 -3,-1.5 4,-2.2 1,-0.2 -1,-0.3 0.372 79.8 96.2 -88.5 1.5 9.0 -13.5 -12.0 39 476 A W H <> S+ 0 0 9 -3,-1.8 4,-1.9 -4,-0.4 3,-0.3 0.955 83.6 47.3 -62.1 -52.9 10.0 -11.5 -15.0 40 477 A P H > S+ 0 0 11 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.888 116.6 47.8 -52.0 -38.9 7.9 -8.4 -14.3 41 478 A G H > S+ 0 0 5 -4,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.796 104.5 57.9 -73.4 -33.5 9.2 -8.5 -10.7 42 479 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 -3,-0.3 -1,-0.2 0.878 106.7 49.9 -62.9 -40.3 12.8 -8.9 -11.8 43 480 A F H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.928 109.6 50.5 -63.7 -46.5 12.5 -5.6 -13.7 44 481 A V H X S+ 0 0 16 -4,-1.6 4,-2.7 1,-0.2 -2,-0.2 0.934 111.8 48.7 -54.7 -49.8 11.0 -3.8 -10.7 45 482 A Y H X S+ 0 0 40 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.914 111.3 49.0 -55.5 -49.2 13.9 -5.2 -8.5 46 483 A M H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 5,-0.3 0.903 113.0 47.4 -59.7 -43.9 16.5 -4.0 -11.0 47 484 A V H X>S+ 0 0 1 -4,-2.8 4,-2.6 2,-0.2 5,-1.1 0.892 113.7 48.3 -63.5 -41.8 14.9 -0.5 -11.2 48 485 A H H <5S+ 0 0 46 -4,-2.7 4,-0.3 3,-0.2 -2,-0.2 0.882 114.3 45.1 -66.7 -40.8 14.7 -0.3 -7.4 49 486 A R H <5S+ 0 0 132 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.807 122.5 36.0 -74.8 -31.4 18.3 -1.4 -6.9 50 487 A S H <5S+ 0 0 5 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.880 135.7 16.4 -87.3 -43.4 19.7 0.9 -9.6 51 488 A C T <5S- 0 0 30 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.1 0.787 110.6 -98.4-104.9 -36.3 17.5 3.9 -9.3 52 489 A G > < - 0 0 26 -5,-1.1 3,-0.9 -4,-0.3 4,-0.4 -0.317 25.0 -93.3 124.8 152.6 15.8 3.7 -5.9 53 490 A T T 3 S+ 0 0 98 1,-0.2 3,-0.3 -5,-0.2 5,-0.2 0.752 124.9 44.0 -67.6 -26.0 12.5 2.6 -4.5 54 491 A S T 3 S+ 0 0 113 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.362 83.7 98.0-102.5 2.6 11.1 6.1 -4.6 55 492 A C S < S+ 0 0 20 -3,-0.9 2,-0.3 1,-0.1 -1,-0.2 0.866 94.7 23.6 -56.3 -40.2 12.4 6.9 -8.2 56 493 A F S S- 0 0 11 -4,-0.4 2,-0.6 -3,-0.3 -1,-0.1 -0.943 92.7-101.5-126.7 150.0 9.0 6.0 -9.6 57 494 A E >> - 0 0 92 -2,-0.3 4,-2.4 106,-0.2 3,-0.7 -0.628 38.8-137.6 -66.0 113.6 5.4 6.0 -8.2 58 495 A L H 3> S+ 0 0 64 -2,-0.6 4,-2.2 1,-0.3 5,-0.2 0.811 99.0 52.2 -48.4 -45.0 5.1 2.2 -7.6 59 496 A E H 3> S+ 0 0 79 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.918 112.5 45.8 -55.5 -48.1 1.6 2.0 -8.9 60 497 A K H <> S+ 0 0 43 -3,-0.7 4,-2.6 1,-0.2 -2,-0.2 0.901 110.0 53.3 -66.3 -44.5 2.5 3.7 -12.1 61 498 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.893 111.4 46.8 -55.2 -43.7 5.7 1.6 -12.6 62 499 A C H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 5,-0.2 0.896 111.4 49.6 -69.5 -42.5 3.6 -1.6 -12.3 63 500 A R H X S+ 0 0 44 -4,-2.3 4,-1.7 97,-0.3 -59,-0.3 0.902 113.8 48.9 -57.5 -43.3 0.9 -0.3 -14.7 64 501 A F H X S+ 0 0 0 -4,-2.6 4,-2.6 96,-0.2 -2,-0.2 0.967 112.0 45.7 -61.5 -58.0 3.7 0.6 -17.1 65 502 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.900 114.7 46.6 -53.7 -49.9 5.6 -2.8 -16.9 66 503 A M H X S+ 0 0 14 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.839 113.8 47.9 -67.4 -33.9 2.4 -5.0 -17.3 67 504 A S H X S+ 0 0 0 -4,-1.7 4,-0.5 -5,-0.2 -1,-0.2 0.863 108.8 54.0 -73.2 -36.8 1.1 -2.9 -20.2 68 505 A V H >< S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.931 105.4 55.2 -58.0 -45.0 4.5 -3.0 -21.9 69 506 A K H >< S+ 0 0 74 -4,-2.2 3,-1.4 1,-0.3 -1,-0.2 0.895 104.5 53.8 -52.0 -44.2 4.3 -6.8 -21.5 70 507 A K H 3< S+ 0 0 79 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.534 102.6 56.8 -74.8 -9.7 0.9 -6.8 -23.4 71 508 A N T << S+ 0 0 12 -3,-1.5 48,-2.1 -4,-0.5 2,-0.4 0.207 84.9 93.6-109.5 12.0 2.3 -4.9 -26.4 72 509 A Y S < S- 0 0 16 -3,-1.4 2,-0.2 46,-0.2 7,-0.1 -0.900 79.5-125.2 -93.9 135.6 5.0 -7.5 -27.1 73 510 A R - 0 0 109 -2,-0.4 2,-2.7 5,-0.4 7,-0.2 -0.500 17.4-106.6 -89.8 152.4 3.7 -10.0 -29.6 74 511 A R S S+ 0 0 223 -2,-0.2 -1,-0.1 5,-0.1 5,-0.1 -0.384 71.0 138.9 -73.7 65.7 3.6 -13.8 -29.3 75 512 A V - 0 0 27 -2,-2.7 47,-0.1 3,-0.1 169,-0.0 -0.689 64.8-107.3-110.7 162.8 6.5 -14.3 -31.7 76 513 A P S S- 0 0 57 0, 0.0 169,-0.2 0, 0.0 3,-0.1 0.864 101.5 -5.7 -58.9 -45.5 9.5 -16.8 -31.6 77 514 A Y S S+ 0 0 27 167,-0.3 2,-2.7 168,-0.1 5,-0.4 0.767 118.1 66.9-119.0 -52.2 12.3 -14.3 -30.7 78 515 A H S S+ 0 0 35 166,-0.2 -5,-0.4 4,-0.1 42,-0.2 -0.371 85.7 113.0 -78.7 66.4 11.4 -10.6 -30.6 79 516 A N S > S- 0 0 32 -2,-2.7 4,-2.1 -3,-0.1 3,-0.2 -0.474 85.6 -72.6-126.4-168.9 9.1 -11.0 -27.6 80 517 A W H > S+ 0 0 20 -7,-0.2 4,-1.9 1,-0.2 5,-0.2 0.828 125.3 54.9 -61.5 -36.4 8.6 -10.2 -23.9 81 518 A K H > S+ 0 0 64 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.885 107.8 49.1 -64.0 -44.1 11.4 -12.6 -22.8 82 519 A H H > S+ 0 0 9 -5,-0.4 4,-2.8 2,-0.2 5,-0.2 0.915 107.9 55.9 -58.7 -45.6 13.9 -10.9 -25.1 83 520 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.917 111.8 41.4 -54.1 -48.5 12.8 -7.5 -23.7 84 521 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.879 112.6 55.0 -70.4 -38.2 13.5 -8.6 -20.1 85 522 A T H X S+ 0 0 15 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.932 109.7 46.6 -58.4 -48.0 16.8 -10.4 -21.1 86 523 A V H X S+ 0 0 2 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.914 111.5 52.0 -59.3 -46.2 18.1 -7.2 -22.8 87 524 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.882 107.3 52.1 -60.2 -42.1 17.1 -5.1 -19.7 88 525 A H H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.869 106.7 53.1 -62.4 -40.5 18.9 -7.4 -17.3 89 526 A C H X S+ 0 0 1 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.939 108.8 49.7 -59.5 -46.1 22.1 -7.1 -19.4 90 527 A M H X S+ 0 0 0 -4,-2.0 4,-3.3 2,-0.2 -2,-0.2 0.915 108.9 52.9 -56.4 -46.5 21.8 -3.3 -19.2 91 528 A Y H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.932 108.8 49.8 -53.5 -49.8 21.3 -3.6 -15.4 92 529 A A H X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.891 113.6 45.2 -58.7 -43.6 24.5 -5.7 -15.2 93 530 A I H < S+ 0 0 0 -4,-2.4 4,-0.4 2,-0.2 -2,-0.2 0.910 115.3 47.7 -65.7 -43.0 26.5 -3.1 -17.3 94 531 A L H >< S+ 0 0 0 -4,-3.3 3,-2.1 2,-0.2 -2,-0.2 0.969 109.8 50.7 -64.5 -53.8 25.0 -0.2 -15.2 95 532 A Q H >< S+ 0 0 46 -4,-3.0 3,-0.7 1,-0.3 -1,-0.2 0.848 113.5 47.3 -50.4 -40.3 25.7 -1.7 -11.8 96 533 A N T 3< S+ 0 0 75 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.501 126.8 28.2 -80.4 -7.3 29.3 -2.4 -12.9 97 534 A N T X S+ 0 0 12 -3,-2.1 3,-1.5 -4,-0.4 4,-0.5 -0.070 81.0 147.0-139.6 34.3 29.7 1.2 -14.3 98 535 A H G X + 0 0 64 -3,-0.7 3,-1.0 1,-0.3 8,-0.1 0.769 67.8 43.1 -52.9 -46.5 27.2 3.0 -12.0 99 536 A T G 3 S+ 0 0 139 1,-0.3 -1,-0.3 -4,-0.1 -4,-0.1 0.561 97.1 74.1 -84.5 -10.8 28.8 6.4 -11.6 100 537 A L G < S+ 0 0 70 -3,-1.5 2,-0.4 -6,-0.2 -1,-0.3 0.703 99.1 57.7 -65.8 -17.5 29.7 6.8 -15.2 101 538 A F S < S- 0 0 6 -3,-1.0 -1,-0.1 -4,-0.5 -4,-0.0 -0.943 84.1-124.0-127.6 133.8 26.0 7.4 -15.8 102 539 A T > - 0 0 72 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.191 33.0-106.9 -66.7 161.8 23.6 9.9 -14.3 103 540 A D H > S+ 0 0 98 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.858 122.3 53.0 -56.4 -39.0 20.4 8.9 -12.5 104 541 A L H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.877 108.2 48.9 -65.4 -41.8 18.4 10.0 -15.5 105 542 A E H > S+ 0 0 9 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.931 111.3 49.6 -64.9 -44.8 20.5 7.9 -17.9 106 543 A R H X S+ 0 0 11 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.917 114.3 44.8 -62.2 -44.2 20.1 4.8 -15.7 107 544 A K H X S+ 0 0 32 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.911 116.8 47.3 -60.6 -46.3 16.3 5.3 -15.5 108 545 A G H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.931 111.4 47.7 -65.0 -49.6 16.1 6.0 -19.2 109 546 A L H X S+ 0 0 0 -4,-3.3 4,-3.1 2,-0.2 -1,-0.2 0.831 110.0 51.7 -64.7 -38.1 18.2 3.1 -20.4 110 547 A L H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.918 115.6 42.1 -65.8 -42.4 16.5 0.4 -18.3 111 548 A I H X S+ 0 0 0 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.901 114.5 51.8 -68.9 -40.8 13.1 1.6 -19.6 112 549 A A H >X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 3,-0.6 0.963 108.9 50.7 -59.9 -53.6 14.5 1.9 -23.1 113 550 A C H 3< S+ 0 0 0 -4,-3.1 3,-0.3 1,-0.2 -26,-0.2 0.873 110.9 48.0 -49.9 -45.5 15.9 -1.7 -23.0 114 551 A L H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 3,-0.2 0.813 122.1 36.1 -67.7 -28.1 12.5 -3.1 -21.8 115 552 A C H X< S+ 0 0 0 -4,-1.7 3,-2.3 -3,-0.6 -2,-0.2 0.530 84.3 105.5 -99.6 -9.4 10.7 -1.2 -24.5 116 553 A H T 3< S+ 0 0 0 -4,-1.6 32,-0.2 -3,-0.3 -1,-0.2 0.529 89.9 31.9 -61.3 -14.2 13.2 -1.4 -27.4 117 554 A D T > S+ 0 0 5 -3,-0.2 3,-1.6 -4,-0.2 -1,-0.3 0.115 82.3 160.7-126.0 19.3 11.3 -4.0 -29.5 118 555 A L T < S+ 0 0 0 -3,-2.3 -46,-0.2 1,-0.3 33,-0.2 -0.111 70.7 4.0 -49.5 134.2 7.7 -3.1 -28.6 119 556 A D T 3 S+ 0 0 15 -48,-2.1 -1,-0.3 1,-0.2 -47,-0.2 0.712 86.9 174.0 60.4 26.1 5.1 -4.4 -31.1 120 557 A H < - 0 0 12 -3,-1.6 -47,-0.4 -42,-0.2 -1,-0.2 -0.348 21.5-164.1 -63.4 141.4 7.7 -6.3 -33.1 121 558 A R - 0 0 78 2,-0.3 -1,-0.1 -49,-0.1 3,-0.1 0.560 44.5-105.8-104.6 -13.1 6.2 -8.4 -35.9 122 559 A G S S+ 0 0 10 1,-0.4 2,-0.3 -47,-0.1 130,-0.2 0.479 84.2 116.8 97.2 6.5 9.2 -10.6 -36.6 123 560 A F - 0 0 53 128,-0.1 -1,-0.4 129,-0.1 -2,-0.3 -0.836 61.1-122.3-110.1 146.9 10.0 -8.8 -39.9 124 561 A S > - 0 0 32 -2,-0.3 4,-1.6 -3,-0.1 5,-0.1 -0.268 21.8-114.9 -80.6 166.9 13.1 -6.8 -40.8 125 562 A N H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.884 117.3 60.3 -65.3 -40.4 13.3 -3.1 -41.9 126 563 A S H > S+ 0 0 72 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.845 105.0 50.2 -52.2 -39.9 14.6 -4.4 -45.3 127 564 A Y H > S+ 0 0 28 2,-0.2 4,-1.4 1,-0.2 3,-0.4 0.937 111.3 44.9 -66.4 -50.2 11.3 -6.3 -45.7 128 565 A L H < S+ 0 0 7 -4,-1.6 8,-0.3 1,-0.2 -2,-0.2 0.812 111.1 54.8 -67.6 -31.5 9.0 -3.3 -44.9 129 566 A Q H < S+ 0 0 79 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.750 110.9 45.3 -71.6 -27.5 11.0 -1.0 -47.1 130 567 A K H < S+ 0 0 148 -4,-1.0 -2,-0.2 -3,-0.4 -1,-0.2 0.740 122.0 35.4 -85.7 -24.8 10.6 -3.3 -50.1 131 568 A F S < S- 0 0 63 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 -0.096 95.8-137.6-125.4 34.4 6.9 -4.0 -49.6 132 569 A D + 0 0 99 -3,-0.3 -3,-0.1 1,-0.1 -4,-0.0 -0.043 35.3 161.2 -37.3 121.0 5.4 -0.7 -48.3 133 570 A H >> - 0 0 73 -5,-0.1 3,-0.9 0, 0.0 4,-0.6 -0.138 59.6 -88.3 71.7 110.1 3.4 -1.1 -46.1 134 571 A P H >> S+ 0 0 98 0, 0.0 4,-2.8 0, 0.0 3,-0.7 0.741 116.3 68.7 -61.8 -33.8 2.7 2.1 -44.0 135 572 A L H 3> S+ 0 0 18 1,-0.3 4,-2.2 2,-0.2 -6,-0.1 0.817 102.5 45.7 -61.6 -34.0 5.5 1.7 -41.4 136 573 A A H <4 S+ 0 0 6 -3,-0.9 -1,-0.3 -8,-0.3 -7,-0.1 0.666 111.9 53.9 -80.1 -19.0 8.2 2.3 -44.0 137 574 A A H << S+ 0 0 74 -3,-0.7 3,-0.4 -4,-0.6 -2,-0.2 0.935 115.0 38.0 -75.3 -51.2 6.2 5.3 -45.3 138 575 A L H < S+ 0 0 123 -4,-2.8 2,-0.7 1,-0.3 -2,-0.2 0.945 130.6 32.2 -61.6 -51.6 6.0 6.9 -41.9 139 576 A Y < - 0 0 28 -4,-2.2 -1,-0.3 -5,-0.3 4,-0.2 -0.816 69.7-179.9-114.1 89.8 9.5 5.9 -40.9 140 577 A S S S+ 0 0 83 -2,-0.7 2,-0.4 -3,-0.4 -1,-0.2 0.887 72.3 31.6 -58.1 -44.0 11.6 5.9 -44.1 141 578 A T S S+ 0 0 92 1,-0.1 -1,-0.1 -3,-0.1 5,-0.1 -0.948 124.1 6.5-117.3 136.4 14.7 4.8 -42.3 142 579 A S S > S+ 0 0 12 -2,-0.4 4,-0.5 3,-0.1 -1,-0.1 0.840 81.0 174.9 72.3 52.5 15.2 2.7 -39.3 143 580 A T H > + 0 0 0 2,-0.3 4,-1.0 1,-0.3 -2,-0.1 0.456 55.4 43.7-147.2 -54.2 11.9 2.0 -39.2 144 581 A M H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.1 -1,-0.3 0.830 113.5 57.8 -69.5 -37.8 10.7 -0.6 -36.7 145 582 A E H > S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 -2,-0.3 0.884 104.2 49.9 -64.1 -39.6 12.9 1.2 -34.1 146 583 A Q H X S+ 0 0 67 -4,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.895 112.1 50.3 -60.3 -39.8 11.1 4.5 -34.8 147 584 A H H X S+ 0 0 14 -4,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.877 105.5 54.9 -66.4 -39.9 7.9 2.5 -34.3 148 585 A H H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.904 109.6 47.2 -61.6 -42.9 9.1 1.0 -31.0 149 586 A F H X S+ 0 0 39 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.935 109.3 53.0 -64.1 -48.2 9.7 4.5 -29.5 150 587 A S H X S+ 0 0 43 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.902 110.0 49.9 -51.1 -43.7 6.4 5.7 -30.7 151 588 A Q H X S+ 0 0 25 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.870 107.2 54.4 -63.0 -39.7 4.9 2.7 -28.9 152 589 A T H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.944 110.3 45.3 -58.5 -50.3 6.9 3.6 -25.7 153 590 A V H X S+ 0 0 28 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.891 109.8 55.4 -62.9 -41.9 5.4 7.1 -25.7 154 591 A S H < S+ 0 0 33 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.869 108.3 48.3 -57.6 -40.9 1.9 5.8 -26.3 155 592 A I H >< S+ 0 0 0 -4,-2.0 3,-1.8 1,-0.2 -2,-0.2 0.929 109.3 52.8 -65.4 -45.0 2.2 3.5 -23.3 156 593 A L H 3< S+ 0 0 1 -4,-2.2 5,-0.3 1,-0.3 -1,-0.2 0.758 102.9 60.4 -60.3 -25.5 3.4 6.4 -21.2 157 594 A Q T 3< S+ 0 0 140 -4,-1.4 -1,-0.3 -5,-0.2 2,-0.2 0.431 82.8 103.6 -86.4 0.4 0.4 8.4 -22.3 158 595 A L S X S- 0 0 38 -3,-1.8 3,-2.0 -4,-0.1 4,-0.5 -0.560 91.4 -81.1 -78.1 149.0 -2.1 5.9 -20.8 159 596 A E T 3 S+ 0 0 188 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 -0.254 113.6 0.6 -54.6 125.0 -3.8 6.9 -17.5 160 597 A G T 3 S+ 0 0 29 -4,-0.1 -1,-0.3 -3,-0.1 -97,-0.3 0.669 108.4 100.1 70.1 19.4 -1.5 6.2 -14.5 161 598 A H < + 0 0 5 -3,-2.0 2,-1.6 -5,-0.3 -2,-0.2 0.596 43.5 105.8-106.4 -18.4 1.3 5.0 -16.7 162 599 A N > + 0 0 32 -4,-0.5 3,-1.1 1,-0.2 4,-0.2 -0.479 36.2 170.1 -76.0 88.9 3.5 8.1 -16.9 163 600 A I T 3 S+ 0 0 5 -2,-1.6 3,-0.3 1,-0.2 -1,-0.2 0.612 76.0 55.0 -71.0 -14.7 6.5 7.1 -14.7 164 601 A F T > S+ 0 0 0 1,-0.2 3,-2.0 2,-0.1 -1,-0.2 0.459 76.2 100.2 -99.1 -2.2 8.4 10.2 -15.8 165 602 A S T < S+ 0 0 67 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.780 74.5 59.9 -56.0 -34.1 5.8 12.8 -14.9 166 603 A T T 3 S+ 0 0 110 -3,-0.3 -1,-0.3 -4,-0.2 2,-0.1 0.560 87.1 97.9 -77.4 -6.2 7.4 13.9 -11.6 167 604 A L S < S- 0 0 24 -3,-2.0 -3,-0.0 1,-0.1 2,-0.0 -0.444 89.1 -95.1 -74.0 154.0 10.5 14.9 -13.5 168 605 A S > - 0 0 59 1,-0.1 4,-3.6 -2,-0.1 5,-0.2 -0.359 37.9-107.6 -63.7 150.9 11.1 18.6 -14.4 169 606 A S H > S+ 0 0 101 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.829 124.4 50.7 -50.8 -35.2 10.0 19.5 -17.9 170 607 A S H > S+ 0 0 55 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.923 113.2 42.7 -65.6 -49.2 13.7 19.7 -18.8 171 608 A E H > S+ 0 0 81 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.862 111.3 57.2 -68.8 -35.2 14.5 16.3 -17.3 172 609 A Y H X S+ 0 0 59 -4,-3.6 4,-2.0 2,-0.2 -1,-0.2 0.919 110.1 42.4 -59.9 -48.4 11.3 14.8 -18.9 173 610 A E H X S+ 0 0 126 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.907 113.9 53.7 -67.6 -39.7 12.4 15.9 -22.4 174 611 A Q H X S+ 0 0 91 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.922 109.5 46.4 -55.7 -49.8 16.0 14.8 -21.7 175 612 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.908 110.9 52.4 -67.1 -41.6 15.0 11.2 -20.6 176 613 A L H X S+ 0 0 34 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.900 111.9 47.4 -54.3 -44.5 12.7 10.9 -23.6 177 614 A E H X S+ 0 0 78 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.841 109.4 52.2 -66.9 -38.5 15.6 11.9 -25.8 178 615 A I H X S+ 0 0 29 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.938 114.5 44.6 -57.5 -45.8 17.9 9.4 -24.0 179 616 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.874 111.7 51.2 -68.5 -43.2 15.3 6.8 -24.7 180 617 A R H X S+ 0 0 86 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.964 113.2 44.3 -59.1 -54.1 14.7 7.8 -28.3 181 618 A K H X S+ 0 0 70 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.864 113.5 52.3 -59.3 -38.3 18.4 7.6 -29.2 182 619 A A H X S+ 0 0 1 -4,-1.9 4,-0.5 -5,-0.2 -1,-0.2 0.917 112.0 44.1 -66.1 -46.3 18.8 4.3 -27.3 183 620 A I H >< S+ 0 0 0 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.929 112.4 51.7 -65.1 -47.7 16.0 2.6 -29.1 184 621 A I H >< S+ 0 0 32 -4,-2.6 3,-1.9 1,-0.3 6,-0.2 0.865 101.9 63.3 -54.9 -37.9 17.1 3.9 -32.5 185 622 A A H 3< S+ 0 0 17 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.714 85.9 72.4 -61.9 -22.7 20.6 2.6 -31.8 186 623 A T T << + 0 0 8 -3,-1.5 2,-1.0 -4,-0.5 -1,-0.3 0.474 68.2 106.0 -76.8 -1.6 19.2 -1.0 -31.7 187 624 A D X> - 0 0 19 -3,-1.9 3,-1.8 1,-0.2 4,-0.8 -0.745 69.2-151.2 -70.3 106.3 18.9 -0.7 -35.5 188 625 A L H 3> S+ 0 0 52 -2,-1.0 4,-0.9 1,-0.3 3,-0.3 0.755 89.6 72.4 -59.1 -27.5 21.9 -2.9 -36.3 189 626 A A H 3> S+ 0 0 69 1,-0.2 4,-0.5 2,-0.2 3,-0.3 0.898 101.1 44.6 -47.3 -43.1 22.3 -1.0 -39.5 190 627 A L H <> S+ 0 0 84 -3,-1.8 4,-2.0 -6,-0.2 -1,-0.2 0.736 97.5 74.9 -80.1 -24.2 23.6 1.9 -37.4 191 628 A Y H X S+ 0 0 2 -4,-0.8 4,-3.0 -3,-0.3 5,-0.3 0.878 88.4 58.5 -53.1 -45.6 25.9 -0.3 -35.1 192 629 A F H X S+ 0 0 90 -4,-0.9 4,-1.3 -3,-0.3 -1,-0.2 0.892 110.5 40.1 -61.3 -45.1 28.6 -0.8 -37.8 193 630 A G H X S+ 0 0 44 -4,-0.5 4,-2.0 -3,-0.2 -1,-0.2 0.904 115.3 54.7 -64.8 -43.6 29.4 2.9 -38.3 194 631 A N H X S+ 0 0 19 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.923 107.2 47.2 -57.7 -51.6 29.0 3.5 -34.5 195 632 A R H X S+ 0 0 39 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.866 110.8 53.5 -61.0 -37.5 31.6 0.8 -33.4 196 633 A K H X S+ 0 0 128 -4,-1.3 4,-2.3 -5,-0.3 -1,-0.2 0.887 109.4 48.0 -64.2 -41.7 34.1 2.1 -36.0 197 634 A Q H X S+ 0 0 89 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.938 113.8 46.4 -62.1 -48.5 33.8 5.7 -34.7 198 635 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.858 111.1 52.3 -65.3 -37.5 34.3 4.5 -31.1 199 636 A E H X S+ 0 0 44 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.938 112.3 46.4 -60.4 -48.7 37.2 2.3 -32.1 200 637 A E H X S+ 0 0 114 -4,-2.3 4,-3.0 1,-0.2 6,-0.3 0.947 113.5 48.6 -55.2 -52.5 38.8 5.3 -33.8 201 638 A M H X>S+ 0 0 20 -4,-3.1 6,-1.9 1,-0.2 5,-1.6 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2,-0.2 -2,-0.2 0.969 115.4 36.3 -59.6 -58.3 6.3 -29.0 -17.1 603 728 B Y H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 14,-0.3 0.796 114.7 58.4 -69.7 -29.1 6.5 -28.1 -13.4 604 729 B T H X S+ 0 0 19 -4,-2.8 4,-1.5 -5,-0.3 -1,-0.2 0.967 110.5 41.3 -60.9 -53.8 5.7 -24.5 -14.2 605 730 B T H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.831 113.8 54.0 -65.4 -33.8 2.4 -25.3 -15.8 606 731 B L H X S+ 0 0 0 -4,-2.0 4,-3.8 -5,-0.2 7,-0.2 0.932 106.3 51.2 -66.0 -46.4 1.6 -28.0 -13.2 607 732 B T H < S+ 0 0 21 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.850 107.8 54.5 -57.8 -37.4 2.1 -25.5 -10.3 608 733 B Q H < S+ 0 0 45 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.915 117.1 34.8 -63.1 -45.3 -0.3 -23.1 -12.1 609 734 B I H < S+ 0 0 23 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.886 135.4 25.9 -76.3 -41.1 -3.1 -25.7 -12.3 610 735 B L >< - 0 0 2 -4,-3.8 3,-2.2 -5,-0.2 -1,-0.3 -0.791 69.9-172.0-126.9 87.6 -2.2 -27.3 -8.9 611 736 B P G > S+ 0 0 86 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.745 81.7 63.4 -52.4 -32.6 -0.5 -24.7 -6.7 612 737 B P G 3 S+ 0 0 51 0, 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-4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.903 110.4 46.3 -58.5 -43.9 17.5 -25.8 -7.6 623 748 B N H X S+ 0 0 3 -4,-2.3 4,-2.2 -80,-0.3 -2,-0.2 0.857 107.0 57.9 -71.1 -34.9 19.0 -28.7 -9.7 624 749 B L H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.921 105.6 50.7 -55.7 -46.8 19.1 -26.5 -12.8 625 750 B S H X S+ 0 0 7 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.892 107.3 54.4 -57.6 -42.3 21.4 -24.1 -10.9 626 751 B Q H X S+ 0 0 69 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.917 108.0 47.9 -60.0 -45.7 23.6 -27.0 -9.9 627 752 B W H X S+ 0 0 13 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.906 109.0 54.5 -61.9 -42.6 24.0 -28.0 -13.5 628 753 B E H X S+ 0 0 23 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.923 107.5 51.3 -53.2 -47.2 24.9 -24.4 -14.4 629 754 B K H <>S+ 0 0 67 -4,-2.4 5,-3.0 2,-0.2 -1,-0.2 0.858 109.1 49.7 -58.3 -41.6 27.5 -24.5 -11.7 630 755 B V H ><5S+ 0 0 65 -4,-1.8 3,-1.4 4,-0.2 -2,-0.2 0.941 112.4 47.8 -62.5 -48.8 29.0 -27.7 -13.2 631 756 B I H 3<5S+ 0 0 40 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.888 110.9 50.5 -58.7 -43.7 29.1 -26.1 -16.7 632 757 B R T 3<5S- 0 0 77 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.352 119.5-111.8 -82.0 7.2 30.7 -22.9 -15.4 633 758 B G T < 5 0 0 69 -3,-1.4 -3,-0.2 -5,-0.2 -2,-0.1 0.650 360.0 360.0 76.4 19.4 33.4 -25.0 -13.6 634 759 B E < 0 0 143 -5,-3.0 -4,-0.2 -6,-0.2 -5,-0.1 0.367 360.0 360.0 -88.1 360.0 32.3 -24.3 -10.1