==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-FEB-12 4AKS . COMPND 2 MOLECULE: THIAZOLINE OXIDASE/SUBTILISIN-LIKE PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PROCHLORON DIDEMNI; . AUTHOR J.KOEHNKE,A.BENT,J.H.NAISMITH . 620 9 2 1 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26572.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 414 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 65 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 3.1 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 0.3 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 . 2 0.3 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 . 33 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 198 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 1 0 0 2 0 2 0 4 4 2 0 0 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 5 3 2 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 PARALLEL BRIDGES PER LADDER . 4 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 0 0 0 2 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 1 514 A K 0 0 263 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -55.4 -30.6 4.0 20.1 2 515 A V - 0 0 93 3,-0.0 2,-0.9 4,-0.0 3,-0.1 -0.903 360.0-170.1-113.0 102.3 -32.7 7.1 20.8 3 516 A A - 0 0 33 -2,-0.7 15,-0.1 1,-0.2 14,-0.1 -0.853 6.3-164.9 -82.1 106.9 -34.0 7.6 24.4 4 517 A L S S+ 0 0 106 -2,-0.9 -1,-0.2 1,-0.3 14,-0.1 0.796 89.4 31.2 -64.6 -26.4 -36.4 10.6 23.8 5 518 A H S S- 0 0 49 12,-0.2 -1,-0.3 -3,-0.1 15,-0.1 -0.676 90.5-149.1-131.4 76.7 -36.3 11.0 27.6 6 519 A P - 0 0 89 0, 0.0 2,-0.3 0, 0.0 -4,-0.0 -0.212 18.7-170.6 -55.0 131.5 -32.9 9.9 28.9 7 520 A H > - 0 0 22 1,-0.1 3,-2.1 110,-0.1 4,-0.3 -0.940 33.1-119.5-130.0 146.2 -33.2 8.5 32.4 8 521 A D T 3 S+ 0 0 64 -2,-0.3 3,-0.3 1,-0.3 4,-0.2 0.737 113.1 46.8 -53.8 -31.6 -30.5 7.5 34.9 9 522 A L T 3> S+ 0 0 4 1,-0.2 4,-1.8 2,-0.1 -1,-0.3 0.309 77.8 106.4 -99.1 6.9 -31.6 3.8 35.0 10 523 A D T <4 S+ 0 0 32 -3,-2.1 6,-0.3 1,-0.2 7,-0.3 0.879 83.8 44.5 -51.6 -45.7 -31.9 3.4 31.2 11 524 A E T 4 S+ 0 0 183 -3,-0.3 -1,-0.2 -4,-0.3 -2,-0.1 0.820 115.9 46.6 -69.4 -36.2 -28.7 1.2 31.1 12 525 A R T 4 S+ 0 0 46 1,-0.2 -1,-0.2 -4,-0.2 -2,-0.2 0.687 113.9 49.5 -82.1 -18.6 -29.6 -0.9 34.2 13 526 A I S >< S- 0 0 0 -4,-1.8 3,-2.1 -3,-0.1 4,-0.4 -0.842 81.0-144.7-126.4 92.5 -33.2 -1.5 33.0 14 527 A P T 3 S+ 0 0 78 0, 0.0 276,-0.6 0, 0.0 -3,-0.1 -0.266 86.1 22.3 -52.5 138.5 -33.6 -2.8 29.5 15 528 A G T 3> S+ 0 0 23 275,-0.2 4,-2.3 -5,-0.1 5,-0.2 0.265 89.5 108.1 86.9 -10.4 -36.7 -1.5 27.8 16 529 A L H <> S+ 0 0 0 -3,-2.1 4,-2.8 -6,-0.3 5,-0.2 0.927 80.5 48.4 -64.8 -44.3 -37.1 1.6 30.1 17 530 A A H > S+ 0 0 27 -4,-0.4 4,-2.1 -7,-0.3 -13,-0.3 0.948 113.4 47.4 -59.3 -48.8 -36.1 4.0 27.4 18 531 A D H > S+ 0 0 76 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.892 112.4 49.3 -60.7 -39.9 -38.5 2.4 24.9 19 532 A L H >X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-1.2 0.923 110.2 51.2 -67.8 -42.5 -41.3 2.4 27.5 20 533 A H H 3< S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.837 101.4 62.0 -60.4 -34.4 -40.6 6.1 28.2 21 534 A N H 3< S+ 0 0 56 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.770 111.9 38.8 -59.4 -24.3 -40.8 6.7 24.5 22 535 A Q H << S- 0 0 57 -3,-1.2 2,-0.3 -4,-0.7 -2,-0.2 0.788 130.6 -2.3 -99.3 -35.5 -44.4 5.6 24.7 23 536 A T < - 0 0 6 -4,-2.3 -1,-0.3 1,-0.1 3,-0.1 -0.980 32.8-167.4-155.1 146.2 -45.5 7.1 28.0 24 537 A L S S- 0 0 39 1,-0.6 103,-2.5 -2,-0.3 104,-0.4 0.156 78.4 -73.7-106.9 14.4 -44.3 9.2 30.9 25 538 A G - 0 0 3 102,-0.2 -1,-0.6 101,-0.2 230,-0.1 -0.401 43.1-107.5 116.5 166.7 -47.5 8.3 32.8 26 539 A D > - 0 0 23 228,-0.2 3,-2.2 -2,-0.2 103,-0.6 -0.999 15.9-134.5-132.2 132.9 -51.1 9.2 32.7 27 540 A P T 3 S+ 0 0 51 0, 0.0 101,-0.1 0, 0.0 -1,-0.1 0.633 103.0 72.0 -64.5 -12.6 -52.9 11.4 35.3 28 541 A Q T 3 S+ 0 0 131 230,-0.1 2,-0.7 2,-0.0 100,-0.1 0.643 84.9 80.3 -69.4 -17.5 -55.8 8.9 35.3 29 542 A I S < S- 0 0 0 -3,-2.2 100,-2.4 98,-0.2 2,-0.5 -0.853 72.0-161.7 -92.2 119.0 -53.3 6.5 37.2 30 543 A T E -a 129 0A 7 -2,-0.7 131,-2.8 129,-0.3 132,-1.9 -0.883 6.3-165.9-104.2 129.0 -53.1 7.4 40.9 31 544 A I E -ab 130 162A 0 98,-3.0 100,-2.9 -2,-0.5 2,-0.6 -0.958 4.9-159.8-111.5 122.5 -50.3 6.3 43.1 32 545 A V E -ab 131 163A 0 130,-2.7 132,-3.1 -2,-0.5 2,-0.7 -0.926 7.0-155.8-104.3 122.5 -50.7 6.6 46.9 33 546 A I E -ab 132 164A 0 98,-2.9 100,-2.8 -2,-0.6 2,-0.8 -0.876 4.4-163.6-103.2 111.6 -47.4 6.6 48.7 34 547 A I E +ab 133 165A 0 130,-3.1 132,-1.8 -2,-0.7 133,-0.2 -0.861 53.7 92.4 -93.6 106.2 -47.7 5.4 52.4 35 548 A D E S-a 134 0A 0 98,-0.8 100,-1.8 -2,-0.8 101,-0.2 -0.732 79.5 -46.5-165.1-157.7 -44.4 6.7 53.8 36 549 A G S S- 0 0 0 66,-0.9 -1,-0.3 98,-0.3 67,-0.2 0.085 72.7 -69.9 -79.4-159.9 -43.1 9.8 55.7 37 550 A D - 0 0 36 62,-0.2 70,-0.2 97,-0.1 -1,-0.1 -0.869 50.5-151.2-106.2 109.9 -43.7 13.4 54.8 38 551 A P - 0 0 3 0, 0.0 2,-0.9 0, 0.0 66,-0.1 -0.371 20.5-109.4 -80.2 163.3 -41.9 14.6 51.7 39 552 A D > - 0 0 23 64,-0.2 3,-1.3 1,-0.1 6,-0.2 -0.784 29.4-177.4 -96.3 99.5 -40.6 18.1 50.9 40 553 A Y T 3 S+ 0 0 58 -2,-0.9 -1,-0.1 1,-0.2 5,-0.1 0.534 73.2 78.0 -75.8 -6.7 -42.8 19.5 48.1 41 554 A T T 3 S+ 0 0 116 3,-0.0 -1,-0.2 5,-0.0 2,-0.1 0.634 71.0 108.8 -72.8 -12.7 -40.7 22.8 48.0 42 555 A L S X S- 0 0 8 -3,-1.3 3,-1.8 1,-0.1 4,-0.2 -0.405 77.6-128.6 -68.9 141.6 -38.0 20.8 46.0 43 556 A S G > S+ 0 0 38 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.728 104.0 71.4 -67.1 -22.5 -37.8 21.8 42.3 44 557 A C G 3 S+ 0 0 4 1,-0.2 72,-2.5 71,-0.1 -1,-0.3 0.735 100.0 48.1 -63.8 -21.8 -38.1 18.1 41.3 45 558 A F G X S+ 0 0 8 -3,-1.8 3,-1.5 70,-0.2 2,-0.5 0.368 82.8 118.2 -96.3 5.0 -41.8 18.3 42.4 46 559 A E T < S+ 0 0 112 -3,-1.4 3,-0.1 1,-0.3 70,-0.1 -0.592 87.5 9.0 -77.9 123.2 -42.5 21.5 40.5 47 560 A G T 3 S+ 0 0 71 -2,-0.5 -1,-0.3 1,-0.3 2,-0.2 0.371 100.8 130.0 87.5 -4.2 -45.2 20.9 37.9 48 561 A A < - 0 0 17 -3,-1.5 2,-1.8 1,-0.1 -1,-0.3 -0.567 69.1-120.1 -81.8 146.0 -45.8 17.4 39.3 49 562 A E + 0 0 95 79,-0.5 81,-2.9 77,-0.4 2,-0.4 -0.590 63.8 143.6 -83.7 78.4 -49.4 16.3 40.1 50 563 A V E +c 130 0A 29 -2,-1.8 2,-0.3 -5,-0.2 81,-0.2 -0.923 20.9 164.5-121.9 142.7 -48.6 15.8 43.8 51 564 A S E -c 131 0A 51 79,-1.5 81,-2.8 -2,-0.4 2,-0.4 -0.987 27.8-127.3-153.1 155.9 -50.6 16.3 47.0 52 565 A K E -c 132 0A 67 -2,-0.3 2,-0.5 79,-0.2 81,-0.2 -0.867 13.9-172.1-102.7 135.3 -50.5 15.3 50.6 53 566 A V - 0 0 44 79,-3.0 -2,-0.0 -2,-0.4 78,-0.0 -0.951 13.0-157.3-121.0 109.5 -53.4 13.7 52.5 54 567 A F - 0 0 109 -2,-0.5 81,-0.1 79,-0.2 2,-0.1 -0.735 32.8-104.9 -81.9 126.4 -52.6 13.5 56.2 55 568 A P > - 0 0 3 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.359 24.9-136.0 -52.8 128.2 -54.7 10.8 57.9 56 569 A Y T 3 S+ 0 0 186 1,-0.3 -2,-0.0 -2,-0.1 0, 0.0 0.704 99.1 62.8 -63.6 -22.5 -57.4 12.6 59.8 57 570 A W T 3 S+ 0 0 47 2,-0.1 2,-0.4 0, 0.0 -1,-0.3 0.385 85.7 94.0 -88.2 4.4 -56.9 10.3 62.9 58 571 A H S < S- 0 0 28 -3,-1.9 80,-0.1 3,-0.0 3,-0.0 -0.781 78.3-123.8 -94.6 144.4 -53.3 11.4 63.4 59 572 A E - 0 0 141 -2,-0.4 -2,-0.1 78,-0.1 -3,-0.0 -0.727 42.4-110.5 -73.8 124.2 -52.2 14.1 65.8 60 573 A P - 0 0 113 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.282 32.3-132.3 -60.6 144.3 -50.2 16.5 63.6 61 574 A A - 0 0 32 1,-0.1 76,-0.1 -3,-0.0 3,-0.1 -0.689 23.5 -99.0 -97.9 152.4 -46.5 16.5 64.4 62 575 A E - 0 0 155 -2,-0.3 -1,-0.1 1,-0.1 0, 0.0 -0.486 49.1-100.9 -67.5 137.0 -44.4 19.6 64.9 63 576 A P - 0 0 116 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.207 34.8-120.9 -58.3 150.0 -42.4 20.5 61.7 64 577 A I - 0 0 19 -3,-0.1 -3,-0.0 1,-0.1 5,-0.0 -0.784 28.5-114.3 -96.0 137.9 -38.7 19.5 61.7 65 578 A T > - 0 0 65 -2,-0.4 4,-1.8 1,-0.1 3,-0.4 -0.355 16.1-121.4 -70.4 149.5 -36.2 22.3 61.3 66 579 A P H > S+ 0 0 76 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.864 114.4 60.1 -51.9 -37.2 -33.9 22.5 58.2 67 580 A E H > S+ 0 0 133 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.889 101.9 50.8 -62.6 -39.5 -31.0 22.3 60.6 68 581 A D H > S+ 0 0 38 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.918 111.1 48.6 -64.1 -43.1 -32.1 18.9 61.9 69 582 A Y H X S+ 0 0 21 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.924 111.5 50.0 -59.9 -44.6 -32.4 17.7 58.3 70 583 A A H X S+ 0 0 53 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.847 107.1 54.8 -64.9 -35.0 -28.9 19.0 57.5 71 584 A A H X S+ 0 0 21 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.923 109.1 47.6 -62.3 -44.6 -27.5 17.3 60.6 72 585 A F H X S+ 0 0 19 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.904 113.3 48.1 -63.1 -41.8 -28.9 14.0 59.4 73 586 A Q H X S+ 0 0 18 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.839 108.2 53.7 -70.8 -33.7 -27.5 14.5 55.9 74 587 A S H X S+ 0 0 59 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.926 108.9 50.0 -63.9 -42.7 -24.0 15.5 57.1 75 588 A I H <>S+ 0 0 12 -4,-1.9 5,-1.5 1,-0.2 4,-0.4 0.861 112.9 46.3 -65.7 -37.8 -23.9 12.3 59.1 76 589 A R H ><5S+ 0 0 53 -4,-1.8 3,-1.4 1,-0.2 -1,-0.2 0.931 110.8 52.4 -64.3 -48.2 -24.9 10.3 56.1 77 590 A D H 3<5S+ 0 0 111 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.723 103.6 56.7 -66.1 -25.7 -22.3 12.1 53.8 78 591 A Q T 3<5S- 0 0 115 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.649 108.9-130.1 -74.0 -17.5 -19.5 11.4 56.2 79 592 A G T < 5 + 0 0 35 -3,-1.4 -3,-0.2 -4,-0.4 2,-0.1 0.835 39.8 175.7 71.9 32.6 -20.4 7.7 55.8 80 593 A L < - 0 0 33 -5,-1.5 2,-0.3 4,-0.1 -1,-0.2 -0.482 9.2-168.6 -67.3 142.2 -20.5 7.0 59.5 81 594 A K >> - 0 0 160 -2,-0.1 4,-1.1 4,-0.0 3,-1.0 -0.879 34.5 -12.8-131.3 161.8 -21.6 3.4 60.2 82 595 A G H 3> S- 0 0 54 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 -0.170 122.2 -0.9 61.1-130.5 -22.7 1.2 63.1 83 596 A K H 3> S+ 0 0 171 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.848 134.1 52.7 -66.8 -35.5 -22.3 2.3 66.7 84 597 A E H <> S+ 0 0 124 -3,-1.0 4,-1.9 2,-0.2 -2,-0.2 0.880 106.8 51.9 -71.4 -39.0 -20.6 5.6 65.7 85 598 A K H X S+ 0 0 80 -4,-1.1 4,-2.3 2,-0.2 -1,-0.2 0.937 112.2 47.2 -56.0 -46.9 -23.5 6.6 63.3 86 599 A E H X S+ 0 0 96 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.874 110.7 50.6 -69.1 -35.9 -26.0 6.0 66.1 87 600 A E H X S+ 0 0 127 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.831 111.3 49.8 -69.6 -33.0 -23.9 8.0 68.7 88 601 A A H X S+ 0 0 24 -4,-1.9 4,-1.4 2,-0.2 5,-0.3 0.902 112.3 45.9 -71.5 -43.1 -23.7 10.9 66.3 89 602 A L H X S+ 0 0 6 -4,-2.3 4,-2.6 1,-0.2 3,-0.3 0.935 114.7 48.4 -64.2 -45.7 -27.5 11.0 65.5 90 603 A E H < S+ 0 0 103 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.834 107.8 56.4 -63.4 -34.0 -28.2 10.7 69.2 91 604 A A H < S+ 0 0 87 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.859 125.5 15.3 -67.2 -34.4 -25.8 13.5 70.1 92 605 A V H < S+ 0 0 79 -4,-1.4 -2,-0.2 -3,-0.3 -3,-0.2 0.763 136.7 24.7-115.6 -37.1 -27.4 16.1 67.8 93 606 A I X + 0 0 1 -4,-2.6 4,-1.9 -5,-0.3 -2,-0.1 -0.391 66.9 143.4-129.1 58.2 -31.0 15.0 66.7 94 607 A P T 4 S+ 0 0 51 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.833 76.3 43.0 -66.9 -33.8 -32.2 12.6 69.4 95 608 A D T 4 S+ 0 0 158 -3,-0.1 4,-0.2 1,-0.1 -2,-0.1 0.729 125.1 31.9 -84.5 -22.0 -35.8 13.7 69.4 96 609 A T T > S+ 0 0 21 -3,-0.1 4,-2.4 2,-0.1 5,-0.2 0.540 86.1 96.0-117.5 -9.3 -36.2 13.9 65.6 97 610 A K H X S+ 0 0 32 -4,-1.9 4,-2.3 1,-0.2 5,-0.1 0.836 86.4 50.5 -55.1 -40.7 -33.9 11.2 64.0 98 611 A D H > S+ 0 0 93 -4,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.933 113.4 44.7 -68.5 -43.7 -36.7 8.5 63.6 99 612 A R H > S+ 0 0 35 1,-0.2 4,-2.7 2,-0.2 -62,-0.2 0.908 111.6 54.5 -62.7 -39.8 -39.1 10.9 61.9 100 613 A I H X S+ 0 0 0 -4,-2.4 4,-3.2 2,-0.2 5,-0.4 0.906 102.4 55.9 -63.1 -43.1 -36.3 12.2 59.7 101 614 A V H X S+ 0 0 70 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.938 113.5 42.8 -51.0 -47.4 -35.4 8.7 58.5 102 615 A L H X S+ 0 0 22 -4,-1.6 4,-2.2 2,-0.2 -66,-0.9 0.899 116.5 45.6 -67.3 -43.9 -39.0 8.4 57.4 103 616 A N H X S+ 0 0 1 -4,-2.7 4,-1.9 2,-0.2 -64,-0.2 0.874 113.6 48.6 -69.1 -39.9 -39.3 11.9 55.8 104 617 A D H X S+ 0 0 6 -4,-3.2 4,-2.1 2,-0.2 -2,-0.2 0.930 111.1 51.5 -63.6 -47.3 -36.0 11.6 54.0 105 618 A H H X S+ 0 0 32 -4,-2.2 4,-3.0 -5,-0.4 5,-0.2 0.925 108.6 52.3 -52.7 -45.9 -37.1 8.2 52.7 106 619 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.862 107.3 51.0 -61.9 -41.2 -40.3 9.7 51.5 107 620 A C H X S+ 0 0 0 -4,-1.9 4,-2.3 -70,-0.2 122,-0.5 0.939 114.7 44.1 -58.6 -48.4 -38.5 12.5 49.6 108 621 A H H X S+ 0 0 0 -4,-2.1 4,-2.1 120,-0.2 121,-0.3 0.942 116.5 44.6 -63.8 -51.5 -36.3 10.0 47.9 109 622 A V H X S+ 0 0 0 -4,-3.0 4,-1.4 2,-0.2 -2,-0.2 0.916 115.1 47.3 -60.5 -47.4 -39.1 7.5 47.0 110 623 A T H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.2 5,-0.3 0.922 112.5 50.5 -63.4 -41.5 -41.5 10.2 45.8 111 624 A S H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.878 107.4 54.5 -63.9 -37.0 -38.8 11.8 43.7 112 625 A T H < S+ 0 0 7 -4,-2.1 12,-2.5 1,-0.2 -1,-0.2 0.822 116.7 37.3 -63.0 -34.1 -37.9 8.4 42.2 113 626 A I H < S+ 0 0 0 -4,-1.4 12,-3.0 10,-0.3 -2,-0.2 0.900 136.3 10.9 -84.3 -46.1 -41.5 7.9 41.1 114 627 A V H < S+ 0 0 0 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.286 77.0 141.9-127.3 7.4 -42.7 11.3 40.0 115 628 A G < - 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0 0 81 -5,-2.9 -1,-0.3 -6,-0.3 -2,-0.1 -0.646 61.7 -98.8 -88.6 149.8 -35.9 66.7 15.8 583 806 B P - 0 0 111 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.365 43.8-100.9 -62.5 146.5 -38.5 64.2 16.9 584 807 B V - 0 0 34 -7,-0.1 2,-0.3 1,-0.1 -10,-0.1 -0.542 43.9-175.2 -65.4 127.5 -37.4 60.6 16.9 585 808 B D > + 0 0 66 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.759 14.8 176.4-134.6 92.6 -38.8 59.1 13.7 586 809 B A H > S+ 0 0 3 -101,-0.4 4,-2.7 -2,-0.3 5,-0.2 0.868 84.5 50.2 -60.7 -46.2 -38.1 55.3 13.3 587 810 B E H > S+ 0 0 70 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.867 109.6 51.9 -65.3 -35.9 -40.1 54.9 10.1 588 811 B A H > S+ 0 0 27 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.934 112.2 46.6 -64.2 -42.7 -38.2 57.9 8.6 589 812 B V H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.933 114.4 47.0 -65.0 -46.3 -34.9 56.2 9.5 590 813 B R H X S+ 0 0 17 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.913 115.3 44.5 -60.6 -47.2 -36.0 52.8 8.2 591 814 B T H X S+ 0 0 38 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.885 111.0 54.1 -71.6 -36.3 -37.3 54.2 4.9 592 815 B A H X S+ 0 0 2 -4,-2.5 4,-1.3 -5,-0.2 -2,-0.2 0.915 111.4 46.4 -58.2 -45.3 -34.2 56.5 4.4 593 816 B L H X S+ 0 0 0 -4,-2.1 4,-0.8 -5,-0.2 24,-0.3 0.920 116.8 43.3 -64.3 -43.5 -32.0 53.4 4.8 594 817 B L H >< S+ 0 0 7 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.918 113.3 49.6 -72.7 -41.5 -34.0 51.2 2.4 595 818 B K H 3< S+ 0 0 158 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.733 116.4 42.6 -73.8 -20.0 -34.6 53.9 -0.3 596 819 B T H 3< S+ 0 0 25 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.503 82.0 124.5-102.4 -4.2 -30.8 54.8 -0.4 597 820 B A << - 0 0 10 -4,-0.8 19,-0.2 -3,-0.5 -3,-0.0 -0.278 64.8-119.4 -56.9 141.2 -29.3 51.3 -0.3 598 821 B I B -S 615 0C 92 17,-2.3 17,-2.7 13,-0.0 -1,-0.1 -0.739 20.8-137.9 -92.3 110.1 -27.0 50.6 -3.2 599 822 B P - 0 0 98 0, 0.0 15,-0.1 0, 0.0 2,-0.1 -0.320 29.5-106.0 -58.7 148.6 -28.1 47.6 -5.5 600 823 B b - 0 0 27 8,-0.3 11,-0.1 1,-0.1 -80,-0.0 -0.365 37.3 -92.5 -76.2 158.9 -25.3 45.3 -6.5 601 824 B D >> - 0 0 81 1,-0.1 4,-2.5 -2,-0.1 3,-2.4 -0.576 26.5-142.5 -72.4 119.7 -23.8 45.3 -10.0 602 825 B P T 34 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.602 102.3 56.0 -61.8 -11.4 -25.6 42.6 -12.2 603 826 B E T 34 S+ 0 0 177 1,-0.0 3,-0.1 0, 0.0 -2,-0.1 0.288 114.5 38.4 -97.2 4.9 -22.3 41.8 -13.9 604 827 B V T <4 S+ 0 0 102 -3,-2.4 2,-0.5 1,-0.3 -1,-0.0 0.654 119.1 42.4-116.1 -43.1 -20.6 41.1 -10.5 605 828 B V S < S- 0 0 15 -4,-2.5 -1,-0.3 1,-0.1 6,-0.1 -0.948 70.9-150.0-109.8 122.6 -23.4 39.3 -8.6 606 829 B E S S+ 0 0 184 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.878 92.6 33.5 -59.3 -42.6 -25.4 36.7 -10.6 607 830 B E > - 0 0 72 1,-0.1 3,-2.3 2,-0.0 -1,-0.3 -0.815 67.7-173.5-120.2 91.2 -28.6 37.2 -8.6 608 831 B P G > S+ 0 0 43 0, 0.0 3,-2.5 0, 0.0 -8,-0.3 0.755 78.2 74.3 -56.7 -27.4 -28.9 40.9 -7.5 609 832 B E G > S+ 0 0 92 1,-0.3 3,-1.7 2,-0.2 -81,-0.5 0.735 80.8 72.2 -60.8 -20.2 -32.0 40.1 -5.4 610 833 B R G < S+ 0 0 69 -3,-2.3 -1,-0.3 1,-0.3 -88,-0.1 0.729 88.9 62.1 -63.9 -18.6 -29.7 38.5 -2.9 611 834 B b G X S- 0 0 3 -3,-2.5 3,-2.0 1,-0.3 -74,-0.4 0.483 96.2-153.0 -83.3 -4.2 -28.6 42.1 -2.1 612 835 B L T < S- 0 0 12 -3,-1.7 -1,-0.3 1,-0.3 -76,-0.2 -0.479 72.0 -16.7 65.4-131.3 -32.1 42.8 -0.9 613 836 B R T 3 S- 0 0 93 -78,-2.2 -1,-0.3 -82,-0.3 2,-0.2 0.623 121.5 -88.6 -75.4 -11.0 -32.8 46.6 -1.4 614 837 B G < - 0 0 0 -3,-2.0 -77,-2.9 -79,-0.1 -1,-0.3 -0.718 58.4 -40.9 133.4-179.8 -29.0 47.0 -1.6 615 838 B F B S-rS 537 598C 35 -17,-2.7 -17,-2.3 -2,-0.2 -77,-0.2 -0.545 75.5 -84.4 -78.7 144.9 -25.9 47.5 0.5 616 839 B V - 0 0 2 -79,-2.5 2,-0.4 -2,-0.2 -1,-0.1 -0.171 42.6-167.2 -52.3 135.1 -26.2 50.0 3.4 617 840 B N > + 0 0 33 -24,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.758 13.4 173.7-132.2 79.7 -25.5 53.6 2.2 618 841 B I H > S+ 0 0 1 -304,-0.6 4,-2.9 -2,-0.4 5,-0.2 0.899 79.5 56.4 -57.5 -45.1 -25.0 55.9 5.2 619 842 B P H > S+ 0 0 56 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.920 110.1 45.4 -56.6 -43.5 -24.1 59.0 3.0 620 843 B G H > S+ 0 0 12 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.930 113.4 49.8 -61.8 -43.9 -27.4 58.7 1.1 621 844 B A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.903 108.4 53.2 -63.6 -39.3 -29.4 58.2 4.4 622 845 B M H X S+ 0 0 4 -4,-2.9 4,-2.5 1,-0.2 6,-1.3 0.852 108.4 51.2 -61.5 -36.2 -27.7 61.3 5.9 623 846 B K H X S+ 0 0 134 -4,-1.5 4,-1.6 5,-0.3 -2,-0.2 0.927 112.3 44.9 -65.5 -46.8 -28.8 63.3 2.9 624 847 B V H < S+ 0 0 92 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.923 124.0 33.9 -63.8 -44.1 -32.4 62.2 3.2 625 848 B L H < S+ 0 0 22 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.862 137.1 14.5 -84.1 -36.8 -32.6 62.7 6.9 626 849 B F H < S- 0 0 27 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.413 94.0-114.0-125.1 -0.5 -30.3 65.7 7.5 627 850 B G < 0 0 67 -4,-1.6 -4,-0.3 -5,-0.4 -3,-0.1 0.722 360.0 360.0 69.9 23.4 -29.6 67.4 4.1 628 851 B Q 0 0 103 -6,-1.3 -5,-0.3 -9,-0.1 -8,-0.1 0.832 360.0 360.0 -84.9 360.0 -25.9 66.4 4.3