==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-MAR-12 4E4W . COMPND 2 MOLECULE: DNA MISMATCH REPAIR PROTEIN MLH1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE S288C; . AUTHOR E.GUENEAU,P.LEGRAND,J.B.CHARBONNIER . 474 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24570.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 338 71.3 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 . 73 15.4 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 34 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 2 2 0 1 3 0 2 0 0 4 1 0 3 0 0 0 1 0 0 0 0 0 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 . 5 0 0 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 1 509 A V 0 0 68 0, 0.0 6,-0.1 0, 0.0 70,-0.0 0.000 360.0 360.0 360.0 128.2 64.6 4.5 97.5 2 510 A N + 0 0 158 4,-0.0 2,-0.1 2,-0.0 0, 0.0 0.655 360.0 121.4 -63.5 -23.0 65.8 2.6 100.6 3 511 A L > - 0 0 25 1,-0.1 4,-1.0 2,-0.0 3,-0.0 -0.258 52.3-163.3 -63.8 131.3 62.2 2.0 101.7 4 512 A T H > S+ 0 0 104 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.793 93.6 58.0 -70.5 -35.1 60.4 -1.3 102.3 5 513 A S H > S+ 0 0 9 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.827 101.0 50.5 -68.5 -44.2 57.0 0.5 102.2 6 514 A I H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.914 108.1 54.8 -66.1 -39.2 57.3 2.0 98.7 7 515 A K H X S+ 0 0 99 -4,-1.0 4,-2.4 2,-0.2 -2,-0.2 0.890 104.7 53.2 -61.4 -41.6 58.2 -1.4 97.2 8 516 A K H X S+ 0 0 110 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.910 111.6 46.5 -60.2 -40.5 55.1 -3.0 98.7 9 517 A L H X S+ 0 0 2 -4,-1.5 4,-1.2 2,-0.2 -1,-0.2 0.816 111.2 50.8 -71.1 -32.3 52.9 -0.3 97.0 10 518 A R H X S+ 0 0 69 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.865 110.7 49.5 -71.9 -36.9 54.8 -0.7 93.7 11 519 A E H X S+ 0 0 92 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.908 106.9 55.5 -67.4 -38.5 54.2 -4.5 93.8 12 520 A K H X S+ 0 0 122 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.836 109.0 47.2 -61.3 -38.4 50.5 -3.8 94.6 13 521 A V H >X S+ 0 0 15 -4,-1.2 3,-1.0 2,-0.2 4,-0.8 0.950 111.2 51.9 -67.1 -51.5 50.3 -1.7 91.3 14 522 A D H >< S+ 0 0 107 -4,-2.4 3,-0.7 1,-0.3 -2,-0.2 0.835 106.3 54.6 -52.1 -40.4 52.1 -4.5 89.4 15 523 A D H 3< S+ 0 0 126 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.797 109.3 46.9 -67.6 -26.7 49.5 -7.0 90.7 16 524 A S H << S+ 0 0 26 -3,-1.0 223,-2.3 -4,-0.8 -1,-0.2 0.520 80.9 128.2 -91.9 -7.9 46.6 -5.0 89.4 17 525 A I B << -A 238 0A 39 -4,-0.8 2,-0.7 -3,-0.7 -3,-0.0 -0.301 48.9-149.3 -60.0 123.2 48.0 -4.3 85.8 18 526 A H > - 0 0 30 219,-3.5 4,-2.1 1,-0.2 219,-0.4 -0.883 4.2-160.1 -95.0 110.4 45.6 -5.2 83.0 19 527 A R H > S+ 0 0 230 -2,-0.7 4,-1.7 1,-0.2 -1,-0.2 0.903 88.3 42.0 -56.5 -51.0 47.7 -6.2 80.0 20 528 A E H > S+ 0 0 145 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.829 116.0 48.4 -68.9 -39.2 45.0 -5.7 77.3 21 529 A L H > S+ 0 0 4 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.853 110.1 53.5 -71.3 -29.9 43.7 -2.5 78.8 22 530 A T H X S+ 0 0 24 -4,-2.1 4,-2.1 215,-0.3 -2,-0.2 0.853 105.6 53.2 -69.1 -38.1 47.3 -1.2 79.0 23 531 A D H X S+ 0 0 78 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.882 103.7 57.5 -65.6 -37.7 47.8 -2.0 75.3 24 532 A I H < S+ 0 0 26 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.893 113.2 39.2 -56.7 -44.0 44.7 0.1 74.5 25 533 A F H >< S+ 0 0 0 -4,-1.3 3,-1.2 1,-0.2 -2,-0.2 0.835 110.1 59.6 -76.8 -34.1 46.3 3.2 76.3 26 534 A A H 3< S+ 0 0 40 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.752 117.7 32.2 -61.6 -31.4 49.8 2.4 74.9 27 535 A N T 3< S+ 0 0 88 -4,-1.4 19,-0.4 -3,-0.2 -1,-0.3 -0.015 87.6 145.8-118.4 24.8 48.4 2.7 71.3 28 536 A L < - 0 0 4 -3,-1.2 2,-0.5 17,-0.1 17,-0.2 -0.322 38.2-152.5 -66.5 147.7 45.7 5.3 71.8 29 537 A N E -B 44 0B 82 15,-2.5 15,-3.1 -2,-0.0 2,-0.3 -0.975 25.9-128.9-118.3 105.3 44.9 7.8 69.1 30 538 A Y E +B 43 0B 40 -2,-0.5 13,-0.2 13,-0.2 15,-0.0 -0.476 33.7 170.2 -65.7 123.5 43.5 10.9 70.8 31 539 A V E - 0 0 13 11,-1.9 262,-0.4 1,-0.3 2,-0.3 0.886 46.9 -92.2 -94.9 -59.0 40.1 12.3 69.4 32 540 A G E -B 42 0B 3 10,-1.8 10,-3.7 260,-0.2 2,-0.4 -0.970 43.0 -50.3 165.4-176.9 39.0 14.9 71.9 33 541 A V E +B 41 0B 14 258,-0.5 8,-0.3 -2,-0.3 3,-0.1 -0.746 34.4 177.2 -86.3 134.4 37.0 16.0 75.0 34 542 A V E S+ 0 0 0 6,-2.6 2,-0.4 -2,-0.4 7,-0.2 0.837 75.3 11.5-101.9 -48.3 33.4 14.9 75.2 35 543 A D E >> -B 40 0B 3 5,-1.8 5,-2.2 1,-0.1 4,-0.8 -0.948 50.6-173.5-142.4 116.4 32.5 16.3 78.7 36 544 A E T 45S+ 0 0 10 -2,-0.4 158,-2.6 3,-0.2 -1,-0.1 0.657 93.0 48.9 -79.0 -20.2 34.6 18.7 80.7 37 545 A E T 45S+ 0 0 70 156,-0.3 -1,-0.1 1,-0.1 -2,-0.0 0.922 122.2 29.2 -82.5 -58.0 32.2 18.4 83.7 38 546 A R T 45S- 0 0 54 156,-0.1 17,-0.2 155,-0.1 -2,-0.2 0.549 110.4-126.6 -79.1 -12.9 31.9 14.5 83.8 39 547 A R T <5 + 0 0 0 -4,-0.8 15,-1.1 1,-0.2 16,-0.7 0.969 48.5 160.9 61.3 62.7 35.5 14.4 82.4 40 548 A L E < -BC 35 53B 0 -5,-2.2 -6,-2.6 13,-0.2 -5,-1.8 -0.926 14.9-175.9-111.5 132.7 34.9 12.1 79.4 41 549 A A E -BC 33 52B 0 11,-2.7 11,-3.5 -2,-0.4 2,-0.4 -0.922 19.0-132.5-125.3 150.7 37.4 12.0 76.6 42 550 A A E +BC 32 51B 1 -10,-3.7 -11,-1.9 -2,-0.3 -10,-1.8 -0.910 26.5 175.7-107.6 134.0 37.2 10.1 73.3 43 551 A I E -BC 30 50B 0 7,-2.4 7,-3.6 -2,-0.4 2,-0.4 -0.956 24.0-133.1-131.1 153.4 40.1 8.0 72.0 44 552 A Q E -BC 29 49B 14 -15,-3.1 -15,-2.5 -2,-0.3 2,-0.4 -0.922 17.7-176.9-106.3 133.6 40.6 5.7 69.0 45 553 A H E > - C 0 48B 17 3,-2.6 3,-2.9 -2,-0.4 2,-0.2 -0.977 62.2 -60.6-129.4 114.2 42.2 2.3 69.5 46 554 A D T 3 S- 0 0 112 -2,-0.4 -22,-0.0 -19,-0.4 -17,-0.0 -0.272 124.3 -7.7 51.9-107.7 42.6 0.4 66.2 47 555 A L T 3 S+ 0 0 96 -2,-0.2 204,-2.9 -3,-0.1 2,-0.3 0.354 122.8 83.5 -97.2 -1.2 39.1 -0.1 64.8 48 556 A K E < -CD 45 250B 74 -3,-2.9 -3,-2.6 202,-0.2 2,-0.5 -0.830 62.4-145.1-114.0 152.5 37.2 1.2 67.9 49 557 A L E -CD 44 249B 0 200,-2.6 199,-2.7 -2,-0.3 200,-1.1 -0.933 26.4-163.2-109.5 123.2 36.2 4.5 69.4 50 558 A F E -CD 43 247B 16 -7,-3.6 -7,-2.4 -2,-0.5 2,-0.5 -0.879 18.2-144.6-112.1 146.9 36.4 4.6 73.2 51 559 A L E -CD 42 246B 0 195,-2.7 195,-2.4 -2,-0.4 2,-0.4 -0.943 28.7-168.5-106.5 119.2 34.8 7.0 75.8 52 560 A I E -CD 41 245B 0 -11,-3.5 -11,-2.7 -2,-0.5 2,-0.9 -0.922 25.6-136.3-114.2 143.2 37.3 7.3 78.7 53 561 A D E > -C 40 0B 0 191,-1.8 4,-1.4 -2,-0.4 3,-0.4 -0.860 21.3-173.0 -96.9 97.4 36.9 8.9 82.1 54 562 A Y H > S+ 0 0 0 -15,-1.1 4,-2.1 -2,-0.9 5,-0.2 0.563 78.8 68.7 -70.4 -9.2 40.1 10.9 82.3 55 563 A G H > S+ 0 0 0 -16,-0.7 4,-1.7 -17,-0.2 -1,-0.2 0.956 106.8 40.7 -67.0 -45.7 39.4 11.8 86.0 56 564 A S H > S+ 0 0 3 -3,-0.4 4,-1.6 -17,-0.2 -2,-0.2 0.849 116.9 48.1 -68.9 -39.7 39.9 8.1 86.8 57 565 A V H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 -1,-0.2 0.923 111.8 48.0 -72.5 -45.8 42.9 7.7 84.4 58 566 A C H X S+ 0 0 0 -4,-2.1 4,-3.2 1,-0.2 5,-0.3 0.873 107.4 59.0 -63.8 -34.2 44.8 10.8 85.7 59 567 A Y H X S+ 0 0 6 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.952 112.4 36.5 -57.8 -52.4 44.2 9.6 89.2 60 568 A E H X S+ 0 0 11 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.899 117.4 54.4 -67.6 -39.7 46.1 6.3 88.6 61 569 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.931 112.8 40.9 -57.0 -54.9 48.7 8.1 86.3 62 570 A F H X S+ 0 0 1 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.824 114.5 53.5 -67.9 -28.9 49.6 10.7 88.9 63 571 A Y H X S+ 0 0 4 -4,-1.7 4,-2.1 -5,-0.3 -2,-0.2 0.928 111.3 46.0 -66.2 -45.7 49.5 8.0 91.6 64 572 A Q H X S+ 0 0 7 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.864 112.7 49.2 -64.5 -42.5 51.9 5.9 89.5 65 573 A I H X S+ 0 0 2 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.913 111.4 51.0 -62.0 -45.3 54.2 8.9 88.8 66 574 A G H X S+ 0 0 2 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.909 110.0 49.7 -58.9 -44.0 54.1 9.6 92.6 67 575 A L H < S+ 0 0 3 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.849 114.8 44.3 -62.0 -41.3 55.1 6.0 93.3 68 576 A T H < S+ 0 0 75 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.892 118.8 39.1 -73.2 -44.8 58.0 6.2 90.8 69 577 A D H >< S+ 0 0 61 -4,-3.0 3,-2.7 -5,-0.1 -2,-0.2 0.373 79.5 151.6 -94.5 9.5 59.5 9.5 91.8 70 578 A F T 3< S+ 0 0 1 -4,-0.8 53,-0.2 1,-0.3 52,-0.1 -0.059 75.6 4.9 -41.7 127.8 59.0 9.2 95.6 71 579 A A T 3 S+ 0 0 36 51,-2.9 -1,-0.3 1,-0.1 52,-0.1 0.443 124.7 72.1 68.4 6.2 61.7 11.2 97.5 72 580 A N < + 0 0 130 -3,-2.7 2,-0.3 50,-0.3 -2,-0.2 -0.069 65.1 140.4-141.9 34.3 63.1 12.6 94.2 73 581 A F - 0 0 19 49,-0.2 74,-0.1 1,-0.1 51,-0.0 -0.631 46.7-130.9 -83.6 144.3 60.4 15.1 93.1 74 582 A G E -E 146 0C 38 72,-0.8 72,-2.5 -2,-0.3 2,-0.4 -0.209 33.0-112.3 -75.3 172.6 61.0 18.5 91.5 75 583 A K E -E 145 0C 66 70,-0.3 2,-0.7 68,-0.0 50,-0.1 -0.908 9.6-148.5-119.3 144.7 59.1 21.5 92.9 76 584 A I E -E 144 0C 17 68,-2.4 68,-1.5 -2,-0.4 2,-0.6 -0.954 30.0-141.4-103.0 105.9 56.4 23.9 91.7 77 585 A N E -E 143 0C 128 -2,-0.7 66,-0.2 66,-0.2 65,-0.1 -0.657 18.9-172.4 -75.1 108.5 57.5 27.0 93.6 78 586 A L + 0 0 35 64,-2.6 2,-0.4 -2,-0.6 65,-0.2 0.480 51.1 93.5 -84.7 -8.2 54.1 28.5 94.6 79 587 A Q + 0 0 67 63,-0.6 2,-0.1 7,-0.1 4,-0.1 -0.816 45.8 176.6-102.7 137.2 55.4 31.9 96.0 80 588 A S - 0 0 68 2,-0.5 6,-0.1 -2,-0.4 -2,-0.0 -0.372 52.8 -89.5-110.9-171.9 55.8 35.2 94.2 81 589 A T S S+ 0 0 150 -2,-0.1 2,-1.0 1,-0.1 3,-0.1 0.537 107.2 91.9 -77.0 -10.2 56.9 38.7 95.3 82 590 A N > - 0 0 75 1,-0.2 3,-1.4 2,-0.0 -2,-0.5 -0.812 57.2-174.5 -91.4 100.8 53.2 39.2 96.1 83 591 A V G > S+ 0 0 97 -2,-1.0 3,-1.3 1,-0.3 -1,-0.2 0.762 81.7 65.7 -64.1 -29.0 52.9 38.2 99.8 84 592 A S G 3 S+ 0 0 103 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.596 93.5 60.5 -71.2 -13.3 49.1 38.7 99.5 85 593 A D G < S+ 0 0 103 -3,-1.4 -1,-0.2 2,-0.1 -2,-0.2 0.434 79.9 126.8 -93.3 -3.8 49.0 35.7 97.0 86 594 A D < - 0 0 28 -3,-1.3 2,-0.8 -4,-0.1 56,-0.1 -0.007 65.0-119.7 -54.1 150.7 50.4 33.3 99.6 87 595 A I - 0 0 26 54,-0.4 54,-2.0 4,-0.0 2,-0.4 -0.899 28.6-168.2-103.2 106.3 48.6 30.1 100.4 88 596 A V B > -F 140 0C 20 -2,-0.8 4,-1.5 52,-0.2 52,-0.2 -0.857 16.3-148.0 -95.7 126.8 47.6 30.0 104.1 89 597 A L H > S+ 0 0 0 50,-2.4 4,-1.9 -2,-0.4 5,-0.2 0.859 99.5 53.9 -63.4 -39.5 46.3 26.6 105.3 90 598 A Y H > S+ 0 0 36 49,-0.4 4,-0.6 46,-0.3 -1,-0.2 0.874 107.8 51.3 -60.0 -42.1 43.9 28.2 107.8 91 599 A N H 4 S+ 0 0 103 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.823 110.2 49.5 -62.2 -39.7 42.4 30.3 105.0 92 600 A L H >< S+ 0 0 23 -4,-1.5 3,-1.2 1,-0.2 -1,-0.2 0.830 107.1 53.7 -67.0 -42.5 41.9 27.1 102.8 93 601 A L H >< S+ 0 0 0 -4,-1.9 3,-1.6 1,-0.3 6,-0.2 0.640 90.6 77.7 -71.2 -13.1 40.2 25.2 105.7 94 602 A S T 3< S+ 0 0 49 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.506 76.9 73.7 -74.3 -5.0 37.7 28.1 106.1 95 603 A E T < S+ 0 0 128 -3,-1.2 2,-0.8 1,-0.1 -1,-0.3 0.632 83.8 79.4 -79.7 -18.1 35.9 26.7 103.0 96 604 A F X - 0 0 20 -3,-1.6 3,-1.4 1,-0.1 -1,-0.1 -0.857 60.8-170.5-101.4 103.4 34.6 23.9 105.3 97 605 A D T 3 S+ 0 0 136 -2,-0.8 3,-0.2 1,-0.3 -1,-0.1 0.717 85.3 66.2 -62.7 -25.0 31.7 25.1 107.4 98 606 A E T 3 S+ 0 0 160 1,-0.3 2,-0.9 2,-0.1 -1,-0.3 0.708 86.0 69.4 -73.1 -19.6 31.9 21.8 109.5 99 607 A L S < S+ 0 0 7 -3,-1.4 -1,-0.3 -6,-0.2 6,-0.2 -0.381 71.7 160.7 -88.9 52.4 35.3 23.0 110.8 100 608 A N + 0 0 136 -2,-0.9 2,-0.3 -3,-0.2 -1,-0.2 0.313 50.0 58.3 -61.8 2.2 33.1 25.7 112.6 101 609 A D S >> S- 0 0 70 1,-0.1 4,-1.3 -3,-0.1 3,-0.6 -0.996 81.4-125.7-139.0 143.5 35.8 26.6 115.2 102 610 A D H 3> S+ 0 0 78 -2,-0.3 4,-2.8 1,-0.2 3,-0.2 0.859 111.1 59.1 -48.8 -42.3 39.4 27.9 114.9 103 611 A A H 3> S+ 0 0 56 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.849 101.4 51.5 -57.3 -45.4 40.6 24.9 117.0 104 612 A S H <> S+ 0 0 19 -3,-0.6 4,-1.2 2,-0.2 -1,-0.2 0.849 114.0 44.1 -64.2 -35.9 39.2 22.2 114.6 105 613 A K H X S+ 0 0 27 -4,-1.3 4,-2.0 -3,-0.2 -2,-0.2 0.904 113.9 51.5 -71.1 -42.3 41.1 24.0 111.6 106 614 A E H X S+ 0 0 52 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.790 103.0 59.9 -63.0 -30.6 44.1 24.3 114.0 107 615 A K H X S+ 0 0 155 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.947 108.7 43.0 -61.1 -50.6 43.9 20.5 114.7 108 616 A I H X S+ 0 0 4 -4,-1.2 4,-1.9 1,-0.2 -2,-0.2 0.898 115.0 48.7 -61.3 -48.6 44.4 19.7 111.0 109 617 A I H X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 -1,-0.2 0.813 106.7 58.5 -64.8 -34.1 47.2 22.3 110.5 110 618 A S H X S+ 0 0 43 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.950 108.6 42.8 -62.6 -50.4 49.0 21.0 113.7 111 619 A K H X S+ 0 0 60 -4,-1.7 4,-1.2 2,-0.2 3,-0.5 0.981 117.5 46.2 -59.9 -56.1 49.3 17.4 112.3 112 620 A I H >< S+ 0 0 1 -4,-1.9 3,-0.8 1,-0.2 -2,-0.2 0.897 114.3 49.6 -47.5 -51.7 50.4 18.6 108.8 113 621 A W H >< S+ 0 0 36 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 0.802 106.5 52.5 -62.0 -38.8 52.9 21.1 110.4 114 622 A D H 3< S+ 0 0 106 -4,-2.2 3,-0.3 -3,-0.5 -1,-0.2 0.713 111.7 49.4 -69.2 -22.9 54.6 18.6 112.7 115 623 A M T + 0 0 27 -3,-1.2 4,-1.9 1,-0.2 11,-0.2 0.758 69.3 60.4 -61.8 -32.5 56.6 19.2 107.5 117 625 A S H > S+ 0 0 92 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.951 115.1 34.0 -62.5 -47.3 60.2 17.8 107.6 118 626 A M H >>S+ 0 0 37 2,-0.2 4,-2.6 -3,-0.2 5,-0.7 0.854 113.2 59.2 -74.9 -37.4 59.1 14.5 105.9 119 627 A L H X5S+ 0 0 0 -4,-2.5 6,-2.1 1,-0.2 4,-1.1 0.906 114.7 39.5 -58.3 -37.4 56.3 16.2 103.7 120 628 A N H X5S+ 0 0 49 -4,-1.9 4,-1.6 4,-0.3 -2,-0.2 0.955 119.0 44.9 -73.4 -51.9 59.1 18.3 102.3 121 629 A E H <5S+ 0 0 119 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.898 126.9 25.9 -56.6 -53.2 61.9 15.5 102.1 122 630 A Y H <5S+ 0 0 70 -4,-2.6 -51,-2.9 1,-0.1 -50,-0.3 0.754 137.2 23.3 -85.0 -37.4 59.7 12.7 100.5 123 631 A Y H < - 0 0 122 1,-0.1 3,-3.1 2,-0.0 -1,-0.3 -0.646 69.7-112.0 -79.7 138.0 56.3 32.7 115.3 133 641 A D T 3 S+ 0 0 99 1,-0.3 -1,-0.1 -2,-0.3 -3,-0.0 0.680 115.5 53.5 -38.6 -38.2 56.7 28.8 114.9 134 642 A N T 3 S+ 0 0 125 1,-0.1 2,-1.6 -5,-0.0 -1,-0.3 0.413 78.4 107.3 -85.5 0.8 53.5 28.1 117.0 135 643 A D X + 0 0 68 -3,-3.1 3,-1.8 1,-0.2 -4,-0.2 -0.604 40.0 173.6 -85.8 86.8 51.3 30.3 114.8 136 644 A L G > S+ 0 0 25 -2,-1.6 3,-1.5 1,-0.3 -46,-0.3 0.756 75.6 64.7 -58.8 -31.8 49.2 27.7 112.9 137 645 A K G 3 S+ 0 0 80 1,-0.3 -1,-0.3 -3,-0.1 -46,-0.2 0.612 103.6 49.1 -69.9 -14.0 47.1 30.5 111.4 138 646 A S G < S+ 0 0 19 -3,-1.8 -8,-1.6 -6,-0.2 2,-0.4 0.096 79.9 127.6-112.0 20.6 50.2 31.7 109.6 139 647 A V E < - G 0 129C 0 -3,-1.5 -50,-2.4 -10,-0.2 -49,-0.4 -0.672 42.3-165.4 -80.4 128.0 51.3 28.2 108.2 140 648 A K E -FG 88 128C 19 -12,-3.4 -12,-3.0 -2,-0.4 2,-0.7 -0.903 25.9-129.2-124.0 148.6 51.9 28.5 104.5 141 649 A L E + G 0 127C 1 -54,-2.0 -54,-0.4 -2,-0.3 -14,-0.2 -0.861 31.1 168.1 -98.8 108.5 52.3 26.2 101.4 142 650 A K E + 0 0 77 -16,-2.8 -64,-2.6 -2,-0.7 -63,-0.6 0.769 61.7 14.1 -92.2 -36.2 55.5 27.2 99.6 143 651 A S E -EG 77 126C 1 -17,-1.4 -17,-1.5 -66,-0.2 -1,-0.3 -0.984 54.5-162.2-143.2 154.0 56.0 24.3 97.1 144 652 A L E -E 76 0C 1 -68,-1.5 -68,-2.4 -2,-0.3 -19,-0.2 -0.879 43.1 -86.6-124.0 158.0 54.2 21.3 95.7 145 653 A P E -E 75 0C 1 0, 0.0 2,-0.9 0, 0.0 -70,-0.3 -0.441 33.8-133.4 -67.6 144.3 55.7 18.2 94.0 146 654 A L E +E 74 0C 64 -72,-2.5 -72,-0.8 1,-0.2 3,-0.1 -0.876 33.9 168.3 -97.9 98.8 56.3 18.6 90.2 147 655 A L + 0 0 12 -2,-0.9 2,-0.4 1,-0.2 -1,-0.2 0.834 61.9 25.5 -81.2 -38.2 54.9 15.4 88.8 148 656 A L S > S- 0 0 18 3,-0.3 3,-2.0 0, 0.0 -1,-0.2 -0.990 78.2-120.7-136.9 126.2 54.9 16.1 85.1 149 657 A K T 3 S+ 0 0 197 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 -0.422 104.5 23.1 -63.8 132.9 56.9 18.5 83.0 150 658 A G T 3 S+ 0 0 65 1,-0.2 2,-0.4 -2,-0.1 -1,-0.3 0.395 105.4 105.4 88.6 -2.6 54.6 21.0 81.3 151 659 A Y < + 0 0 4 -3,-2.0 -3,-0.3 75,-0.1 -1,-0.2 -0.945 38.2 171.3-117.1 130.8 51.9 20.4 83.9 152 660 A I - 0 0 121 -2,-0.4 3,-0.1 -3,-0.1 -6,-0.1 -0.975 33.2-131.4-129.2 114.5 50.9 22.7 86.8 153 661 A P - 0 0 4 0, 0.0 2,-0.1 0, 0.0 36,-0.1 -0.378 23.3-103.4 -69.9 154.5 47.8 21.5 88.6 154 662 A S - 0 0 42 34,-0.2 3,-0.4 35,-0.1 36,-0.0 -0.447 22.0-146.1 -69.4 144.6 44.9 23.8 89.3 155 663 A L S > S+ 0 0 59 1,-0.2 3,-2.5 -2,-0.1 -1,-0.1 0.453 74.1 102.4 -99.2 6.9 44.8 24.9 93.0 156 664 A V T 3 S+ 0 0 101 1,-0.3 4,-0.2 2,-0.1 -1,-0.2 0.803 83.5 51.1 -55.8 -35.9 41.0 25.0 93.2 157 665 A K T 3> S+ 0 0 0 -3,-0.4 4,-1.8 31,-0.2 3,-0.5 0.419 77.0 105.6 -86.6 4.8 41.1 21.6 95.0 158 666 A L H <> S+ 0 0 3 -3,-2.5 4,-2.2 1,-0.2 5,-0.2 0.875 75.0 58.2 -50.8 -44.0 43.8 22.8 97.6 159 667 A P H > S+ 0 0 12 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.933 109.3 44.7 -50.9 -47.1 41.1 23.0 100.4 160 668 A F H > S+ 0 0 45 -3,-0.5 4,-2.9 1,-0.2 5,-0.2 0.845 109.8 56.2 -61.8 -41.0 40.3 19.3 99.9 161 669 A F H X S+ 0 0 1 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.913 113.7 38.7 -56.8 -48.8 44.0 18.4 99.7 162 670 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.942 116.6 50.5 -69.7 -50.3 44.7 20.0 103.2 163 671 A Y H X S+ 0 0 31 -4,-2.8 4,-1.4 -5,-0.2 5,-0.2 0.894 116.4 41.6 -54.6 -47.0 41.4 18.7 104.7 164 672 A R H X>S+ 0 0 2 -4,-2.9 4,-2.5 2,-0.2 5,-1.4 0.858 112.5 53.1 -74.7 -34.0 42.1 15.1 103.5 165 673 A L H <5S+ 0 0 1 -4,-2.1 4,-0.2 -5,-0.2 -2,-0.2 0.911 116.9 41.5 -61.0 -42.0 45.8 15.3 104.4 166 674 A G H <5S+ 0 0 19 -4,-2.7 -2,-0.2 -5,-0.1 -1,-0.2 0.714 132.9 19.0 -78.5 -24.1 44.7 16.4 108.0 167 675 A K H <5S+ 0 0 105 -4,-1.4 -3,-0.2 -5,-0.2 -2,-0.2 0.679 125.8 41.0-120.3 -32.7 41.7 13.9 108.3 168 676 A E T <5S+ 0 0 112 -4,-2.5 2,-0.3 -5,-0.2 -3,-0.2 0.799 88.5 91.4 -91.7 -33.5 42.0 11.0 105.9 169 677 A V S - 0 0 80 6,-0.3 3,-1.1 -2,-0.3 7,-0.2 -0.668 24.2-178.9 -85.9 83.4 46.6 7.4 108.6 171 679 A W T 3 S+ 0 0 33 -2,-1.6 -1,-0.2 1,-0.2 6,-0.1 0.688 71.7 67.5 -55.2 -22.3 49.8 9.1 109.9 172 680 A E T 3 S+ 0 0 165 1,-0.1 2,-0.6 -3,-0.1 -1,-0.2 0.749 91.0 60.3 -76.5 -26.2 50.3 6.1 112.4 173 681 A D S <> S- 0 0 78 -3,-1.1 4,-3.1 1,-0.1 5,-0.2 -0.938 73.8-145.6-110.7 118.1 51.1 3.3 109.9 174 682 A E H > S+ 0 0 109 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.858 98.8 40.3 -45.6 -51.7 54.2 3.8 107.6 175 683 A Q H > S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.940 118.7 45.0 -66.7 -51.6 52.7 2.1 104.5 176 684 A E H > S+ 0 0 87 2,-0.2 4,-2.3 1,-0.2 -6,-0.3 0.839 114.0 51.3 -61.6 -34.1 49.1 3.5 104.9 177 685 A C H X S+ 0 0 11 -4,-3.1 4,-2.2 2,-0.2 -2,-0.2 0.976 112.9 43.8 -65.5 -56.0 50.6 7.0 105.6 178 686 A L H X S+ 0 0 7 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.872 116.6 46.9 -53.6 -51.1 52.9 6.9 102.4 179 687 A D H X S+ 0 0 19 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.943 111.2 53.5 -57.6 -48.7 50.1 5.5 100.2 180 688 A G H X S+ 0 0 13 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.840 108.7 47.1 -56.6 -44.7 47.6 8.1 101.6 181 689 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.957 111.9 49.7 -65.7 -49.0 49.9 11.1 100.8 182 690 A L H X S+ 0 0 2 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.869 111.4 51.5 -55.4 -39.6 50.6 9.8 97.2 183 691 A R H X S+ 0 0 74 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.929 109.7 48.9 -63.7 -42.4 46.8 9.4 96.9 184 692 A E H X S+ 0 0 8 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.867 112.1 47.9 -64.7 -41.4 46.2 13.0 98.0 185 693 A I H X S+ 0 0 3 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.933 112.9 48.7 -62.7 -49.4 48.8 14.3 95.6 186 694 A A H X S+ 0 0 0 -4,-2.4 4,-0.8 -5,-0.2 -2,-0.2 0.913 111.2 50.6 -56.5 -44.7 47.2 12.3 92.8 187 695 A L H >< S+ 0 0 10 -4,-2.7 3,-0.8 1,-0.2 -2,-0.2 0.922 111.6 46.8 -61.3 -47.8 43.6 13.5 93.7 188 696 A L H 3< S+ 0 0 2 -4,-2.2 -31,-0.2 1,-0.2 -1,-0.2 0.838 109.3 57.1 -59.6 -39.0 44.7 17.2 93.7 189 697 A Y H 3< S+ 0 0 1 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.643 78.0 106.1 -70.2 -20.3 46.6 16.7 90.3 190 698 A I S << S- 0 0 1 -3,-0.8 -36,-0.1 -4,-0.8 -135,-0.1 -0.471 86.2-101.0 -63.9 129.8 43.5 15.5 88.4 191 699 A P - 0 0 4 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.106 50.6 -95.3 -49.9 143.1 42.3 18.3 86.0 192 700 A D - 0 0 29 1,-0.1 2,-0.5 -3,-0.1 -153,-0.1 -0.144 30.4-106.6 -60.1 159.7 39.2 20.1 87.4 193 701 A M - 0 0 45 -3,-0.1 -156,-0.3 -155,-0.1 -1,-0.1 -0.742 33.2-155.0 -80.3 123.8 35.6 19.3 86.7 194 702 A V - 0 0 6 -158,-2.6 -155,-0.1 -2,-0.5 -158,-0.1 -0.895 12.5-138.2-105.9 102.6 34.4 22.2 84.4 195 703 A P - 0 0 83 0, 0.0 2,-0.2 0, 0.0 -159,-0.0 -0.298 27.1-100.8 -59.2 148.2 30.6 22.6 84.8 196 704 A K - 0 0 43 2,-0.0 2,-0.4 -161,-0.0 -161,-0.0 -0.471 36.1-164.1 -70.2 135.9 28.6 23.2 81.6 197 705 A V - 0 0 52 -2,-0.2 2,-0.8 -3,-0.1 -3,-0.0 -0.974 22.8-120.4-123.8 135.3 27.6 26.9 80.9 198 706 A D > - 0 0 65 -2,-0.4 3,-0.6 1,-0.2 6,-0.2 -0.725 22.6-173.1 -82.6 106.2 24.8 27.8 78.3 199 707 A T T 3 S+ 0 0 62 -2,-0.8 -1,-0.2 1,-0.2 10,-0.1 0.659 84.5 58.0 -72.3 -17.0 26.4 30.1 75.7 200 708 A S T 3 S+ 0 0 72 87,-0.1 2,-0.6 2,-0.0 -1,-0.2 0.683 80.8 103.0 -84.1 -23.2 22.9 30.7 74.1 201 709 A D X - 0 0 18 -3,-0.6 3,-1.1 1,-0.2 -3,-0.0 -0.537 52.2-168.2 -68.9 109.3 21.4 32.1 77.4 202 710 A A T 3 S+ 0 0 97 -2,-0.6 -1,-0.2 1,-0.2 4,-0.1 0.667 83.9 72.7 -69.2 -18.2 21.2 35.9 77.1 203 711 A S T 3 S+ 0 0 110 2,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.696 84.4 78.8 -67.3 -27.8 20.5 35.9 80.9 204 712 A L S < S- 0 0 72 -3,-1.1 5,-0.1 -6,-0.2 -7,-0.0 -0.708 92.1-100.3 -90.7 138.1 24.2 34.9 81.7 205 713 A S > - 0 0 41 -2,-0.3 4,-0.9 1,-0.1 3,-0.3 -0.081 17.3-122.9 -60.1 153.5 26.9 37.7 81.7 206 714 A E H > S+ 0 0 150 1,-0.2 4,-1.2 2,-0.2 3,-0.2 0.819 112.9 52.0 -62.0 -39.2 29.4 38.4 78.8 207 715 A D H > S+ 0 0 100 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.751 104.2 56.0 -71.2 -29.2 32.4 37.9 81.2 208 716 A E H > S+ 0 0 110 -3,-0.3 4,-1.0 2,-0.1 -1,-0.2 0.737 105.3 55.6 -74.4 -26.7 31.1 34.5 82.4 209 717 A K H >X S+ 0 0 53 -4,-0.9 4,-2.4 -3,-0.2 3,-1.5 0.998 107.4 41.5 -69.8 -68.6 31.0 33.3 78.7 210 718 A A H 3X S+ 0 0 70 -4,-1.2 4,-1.8 1,-0.3 -1,-0.2 0.693 114.3 58.1 -54.1 -21.9 34.7 33.9 77.5 211 719 A Q H 3X S+ 0 0 93 -4,-0.7 4,-1.6 2,-0.2 -1,-0.3 0.813 107.7 43.1 -77.2 -36.3 35.7 32.6 81.0 212 720 A F H S+ 0 0 40 -4,-2.0 4,-2.3 -5,-0.2 5,-2.1 0.953 114.8 43.0 -58.9 -53.4 46.1 20.2 78.5 223 731 A L H <>S+ 0 0 0 -4,-3.5 5,-2.7 1,-0.2 -2,-0.2 0.905 120.0 43.0 -60.5 -44.6 44.6 16.8 77.6 224 732 A E H <5S+ 0 0 97 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.830 125.7 27.6 -72.9 -40.0 45.9 16.9 74.1 225 733 A H H <5S+ 0 0 125 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.798 134.9 13.6-100.8 -22.2 49.4 18.2 74.6 226 734 A V T X5S+ 0 0 31 -4,-2.3 4,-1.3 -5,-0.4 -3,-0.2 0.816 123.2 40.8-113.7 -59.8 50.4 17.2 78.1 227 735 A L H > S+ 0 0 42 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.906 113.6 44.2 -56.2 -38.7 50.9 11.9 75.4 230 738 A C H X S+ 0 0 4 -4,-1.3 4,-2.2 2,-0.2 5,-0.5 0.952 114.0 48.9 -67.7 -49.1 52.0 11.0 79.1 231 739 A I H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.891 112.8 49.5 -49.2 -48.9 49.2 8.4 79.4 232 740 A K H < S+ 0 0 91 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.810 115.3 42.8 -65.7 -31.6 50.2 6.9 76.0 233 741 A R H < S+ 0 0 177 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.744 134.8 4.8 -86.4 -37.3 53.9 6.7 76.9 234 742 A R H < S+ 0 0 91 -4,-2.2 2,-0.2 -5,-0.1 -3,-0.2 0.478 82.3 131.8-135.1 -5.4 53.8 5.3 80.6 235 743 A F < - 0 0 7 -4,-1.9 2,-0.6 -5,-0.5 -209,-0.1 -0.393 34.0-164.0 -68.1 126.7 50.2 4.4 81.7 236 744 A L - 0 0 64 -2,-0.2 -172,-0.1 -211,-0.1 -217,-0.1 -0.952 19.3-138.8-106.7 115.0 49.7 1.1 83.4 237 745 A A - 0 0 0 -2,-0.6 -219,-3.5 -219,-0.4 -215,-0.3 -0.734 9.2-146.3 -85.9 112.8 46.0 0.3 83.4 238 746 A P B > -A 17 0A 2 0, 0.0 3,-1.5 0, 0.0 -221,-0.2 -0.401 22.0-120.7 -69.1 152.8 44.7 -1.3 86.7 239 747 A R G > S+ 0 0 133 -223,-2.3 3,-1.6 1,-0.3 4,-0.2 0.780 107.7 72.4 -68.7 -19.8 41.9 -3.8 86.1 240 748 A H G 3 S+ 0 0 106 1,-0.3 3,-0.4 -224,-0.2 -1,-0.3 0.603 88.6 67.8 -68.7 -6.6 39.5 -1.8 88.3 241 749 A I G X + 0 0 0 -3,-1.5 3,-2.3 1,-0.2 4,-0.5 0.474 65.7 95.9 -93.2 -4.6 39.4 0.8 85.4 242 750 A L G X S+ 0 0 87 -3,-1.6 3,-0.6 1,-0.3 -1,-0.2 0.763 82.3 57.3 -57.4 -29.3 37.6 -1.4 82.9 243 751 A K G 3 S+ 0 0 187 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.645 103.4 55.4 -73.1 -19.1 34.3 0.3 84.0 244 752 A D G < S+ 0 0 29 -3,-2.3 -191,-1.8 -191,-0.1 2,-0.4 0.431 99.2 65.8 -94.5 -7.2 35.9 3.7 83.0 245 753 A V E < -D 52 0B 15 -3,-0.6 2,-0.4 -4,-0.5 -193,-0.2 -0.985 67.5-180.0-117.7 117.6 36.7 2.7 79.4 246 754 A V E -D 51 0B 49 -195,-2.4 -195,-2.7 -2,-0.4 2,-0.3 -0.984 26.9-132.2-133.6 127.7 33.7 2.1 77.1 247 755 A E E +D 50 0B 88 -2,-0.4 -197,-0.2 -197,-0.2 3,-0.1 -0.607 30.3 167.4 -71.5 126.3 33.5 1.1 73.5 248 756 A I E + 0 0 31 -199,-2.7 2,-0.3 1,-0.4 -198,-0.2 0.578 60.3 7.0-116.7 -22.0 31.0 3.4 71.7 249 757 A A E -D 49 0B 9 -200,-1.1 -200,-2.6 4,-0.0 -1,-0.4 -0.978 54.4-154.2-162.5 152.8 31.6 2.7 67.9 250 758 A N E > -D 48 0B 29 -2,-0.3 4,-2.4 -202,-0.2 3,-0.3 -0.999 22.6-131.1-138.3 135.9 33.5 0.4 65.6 251 759 A L H > S+ 0 0 10 -204,-2.9 4,-3.4 -2,-0.4 5,-0.2 0.869 105.5 57.5 -53.0 -44.3 34.7 1.0 62.0 252 760 A P H 4 S+ 0 0 56 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.923 113.2 40.8 -55.6 -44.4 33.4 -2.3 60.6 253 761 A D H >> S+ 0 0 86 -3,-0.3 3,-1.3 2,-0.2 4,-0.5 0.903 116.4 49.1 -67.4 -43.3 29.8 -1.4 61.8 254 762 A L H >X S+ 0 0 17 -4,-2.4 4,-2.4 1,-0.3 3,-1.8 0.933 105.8 57.8 -62.4 -44.2 30.2 2.3 60.8 255 763 A Y H 3< S+ 0 0 105 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.2 0.461 96.2 64.2 -68.4 1.5 31.4 1.3 57.3 256 764 A K H <4 S+ 0 0 142 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.709 117.7 25.6 -92.5 -23.5 28.2 -0.7 56.8 257 765 A V H << S+ 0 0 34 -3,-1.8 2,-0.5 -4,-0.5 -2,-0.2 0.854 114.7 62.6-101.0 -53.1 26.1 2.6 56.9 258 766 A F S < S+ 0 0 6 -4,-2.4 2,-0.3 199,-0.1 -1,-0.2 -0.648 73.8 169.7 -77.8 113.7 28.6 5.4 55.8 259 767 A E - 0 0 97 -2,-0.5 -3,-0.1 199,-0.1 59,-0.1 -0.940 37.3 -90.2-131.3 156.0 29.6 4.6 52.2 260 768 A R 0 0 225 -2,-0.3 -1,-0.0 1,-0.1 0, 0.0 -0.212 360.0 360.0 -60.0 147.6 31.5 6.2 49.3 261 769 A C 0 0 60 161,-0.1 -1,-0.1 196,-0.1 195,-0.1 -0.517 360.0 360.0 -65.7 360.0 29.5 8.3 46.8 262 !* 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 0.0 263 649 B K > 0 0 115 0, 0.0 3,-1.6 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -51.6 18.4 -6.6 51.8 264 650 B D G > + 0 0 96 1,-0.3 3,-0.8 2,-0.1 4,-0.2 0.580 360.0 70.7 -61.7 -16.1 16.9 -7.0 55.3 265 651 B E G > S+ 0 0 163 1,-0.2 3,-1.5 2,-0.1 4,-0.4 0.712 78.3 78.9 -72.3 -27.4 20.0 -5.2 56.8 266 652 B L G <> S+ 0 0 47 -3,-1.6 4,-1.9 1,-0.3 -1,-0.2 0.539 74.4 76.0 -60.3 -14.0 18.7 -1.8 55.3 267 653 B E H <> S+ 0 0 110 -3,-0.8 4,-2.3 1,-0.2 -1,-0.3 0.842 90.7 55.6 -67.3 -34.4 16.1 -1.5 58.2 268 654 B D H <> S+ 0 0 73 -3,-1.5 4,-0.6 1,-0.2 -1,-0.2 0.783 108.3 48.5 -66.6 -30.8 19.0 -0.4 60.4 269 655 B F H > S+ 0 0 56 -4,-0.4 4,-1.4 2,-0.2 3,-0.4 0.892 111.2 50.2 -72.9 -45.6 19.8 2.4 57.8 270 656 B E H X S+ 0 0 87 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.905 107.1 52.4 -59.5 -49.3 16.1 3.5 57.7 271 657 B Q H X S+ 0 0 55 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.706 107.0 55.8 -62.0 -24.6 15.7 3.7 61.6 272 658 B G H X S+ 0 0 16 -4,-0.6 4,-1.8 -3,-0.4 -1,-0.2 0.909 110.9 40.9 -73.2 -46.9 18.8 6.0 61.7 273 659 B E H X S+ 0 0 67 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.792 114.9 54.0 -69.6 -33.3 17.3 8.6 59.2 274 660 B K H X S+ 0 0 104 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.886 108.2 49.3 -66.5 -43.0 13.9 8.2 61.0 275 661 B Y H >X S+ 0 0 94 -4,-1.6 4,-3.1 1,-0.2 3,-0.7 0.921 109.7 52.4 -61.7 -46.4 15.6 9.1 64.3 276 662 B L H 3X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.875 101.5 57.9 -58.7 -47.8 17.3 12.1 62.8 277 663 B T H 3< S+ 0 0 59 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.778 120.2 30.8 -54.6 -31.9 14.1 13.7 61.4 278 664 B L H << S+ 0 0 156 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.853 123.8 43.3 -93.8 -47.6 12.6 13.7 65.0 279 665 B T H < S+ 0 0 29 -4,-3.1 2,-0.5 1,-0.1 -3,-0.2 0.662 108.4 58.9 -75.2 -25.1 15.7 14.2 67.2 280 666 B V < - 0 0 9 -4,-2.4 2,-0.2 -5,-0.2 -1,-0.1 -0.936 60.0-176.6-121.1 115.9 17.6 16.9 65.1 281 667 B S > - 0 0 59 -2,-0.5 4,-0.9 1,-0.1 3,-0.3 -0.519 44.5-100.7 -96.6 166.3 16.1 20.4 64.2 282 668 B K H >> S+ 0 0 97 1,-0.2 3,-0.8 2,-0.2 4,-0.6 0.927 126.4 47.3 -51.3 -49.0 17.8 23.2 62.1 283 669 B N H >> S+ 0 0 107 1,-0.2 4,-1.1 2,-0.2 3,-0.8 0.802 97.1 71.8 -63.7 -32.1 18.8 25.0 65.3 284 670 B D H 34 S+ 0 0 28 -3,-0.3 3,-0.4 1,-0.3 -1,-0.2 0.829 95.8 53.4 -52.5 -37.3 20.2 21.8 66.9 285 671 B F H X< S+ 0 0 3 -4,-0.9 3,-1.1 -3,-0.8 -1,-0.3 0.819 102.4 56.0 -65.7 -40.1 23.1 22.0 64.4 286 672 B K H << S+ 0 0 104 -3,-0.8 -1,-0.2 -4,-0.6 -2,-0.2 0.731 110.3 46.9 -66.1 -25.6 24.1 25.6 65.3 287 673 B K T 3< S+ 0 0 66 -4,-1.1 17,-0.4 -3,-0.4 -1,-0.2 0.305 87.2 115.0 -99.4 6.3 24.4 24.4 69.0 288 674 B M < - 0 0 4 -3,-1.1 2,-0.4 15,-0.1 15,-0.2 -0.560 54.5-145.6 -79.3 142.5 26.5 21.3 68.3 289 675 B E E -H 302 0D 68 13,-2.8 13,-2.6 -2,-0.2 2,-0.5 -0.907 12.4-123.0-114.5 135.0 30.1 21.1 69.6 290 676 B V E +H 301 0D 20 -2,-0.4 11,-0.2 11,-0.2 -257,-0.2 -0.628 23.7 179.4 -76.3 123.6 33.0 19.4 67.9 291 677 B V E - 0 0 15 9,-2.8 -258,-0.5 -2,-0.5 2,-0.3 0.916 56.6 -83.9 -82.0 -50.7 34.8 16.8 70.0 292 678 B G E -H 300 0D 6 8,-1.1 8,-2.7 -260,-0.2 2,-0.4 -0.975 48.7 -56.5 166.8-171.7 37.4 15.9 67.3 293 679 B Q E -H 299 0D 33 -262,-0.4 2,-0.5 -2,-0.3 6,-0.2 -0.824 40.4-156.4-102.6 134.8 38.2 14.0 64.2 294 680 B F E >> S-H 298 0D 0 4,-2.6 4,-2.2 -2,-0.4 3,-1.8 -0.957 70.4 -19.1-121.6 122.9 37.9 10.2 64.1 295 681 B N T 34 S- 0 0 56 -2,-0.5 -1,-0.1 1,-0.3 134,-0.0 0.677 107.8 -80.1 56.6 27.9 39.9 8.0 61.6 296 682 B L T 34 S+ 0 0 80 2,-0.2 133,-3.4 1,-0.1 134,-0.5 0.682 130.4 69.0 58.0 21.5 40.5 11.1 59.3 297 683 B G T <4 S+ 0 0 0 -3,-1.8 19,-1.8 131,-0.2 20,-0.4 0.468 87.1 60.4-140.9 -14.5 37.0 10.6 58.0 298 684 B F E < -HI 294 315D 2 -4,-2.2 -4,-2.6 17,-0.2 2,-0.5 -0.933 57.3-146.6-127.2 149.4 34.5 11.5 60.8 299 685 B I E -HI 293 314D 0 15,-3.1 15,-2.4 -2,-0.3 2,-0.5 -0.967 18.6-151.4-110.4 119.2 33.6 14.5 62.9 300 686 B I E -HI 292 313D 1 -8,-2.7 -9,-2.8 -2,-0.5 -8,-1.1 -0.806 22.1-176.2 -90.7 128.1 32.4 13.5 66.5 301 687 B V E -HI 290 312D 0 11,-2.2 11,-2.8 -2,-0.5 2,-0.3 -0.977 20.3-144.2-130.2 147.4 30.0 16.0 67.9 302 688 B T E -HI 289 311D 8 -13,-2.6 -13,-2.8 -2,-0.3 2,-0.4 -0.807 10.3-170.0-103.5 147.5 28.2 16.6 71.2 303 689 B R E - I 0 310D 7 7,-2.5 7,-2.3 -2,-0.3 2,-0.7 -0.888 4.8-179.8-139.4 100.8 24.6 18.0 71.4 304 690 B K E + I 0 309D 85 -17,-0.4 5,-0.3 -2,-0.4 2,-0.2 -0.916 17.7 160.7-109.9 106.4 23.4 19.0 74.9 305 691 B V - 0 0 39 3,-2.4 2,-0.2 -2,-0.7 5,-0.0 -0.749 60.8 -22.7-169.5 128.7 19.8 20.4 74.8 306 692 B D S S- 0 0 123 -2,-0.2 -2,-0.0 1,-0.0 0, 0.0 -0.679 121.2 -44.6 -90.0 -51.6 17.7 20.7 77.0 307 693 B N S S+ 0 0 147 -2,-0.2 2,-0.2 2,-0.0 -1,-0.0 0.349 118.2 100.7-112.5 -9.5 18.6 18.2 79.7 308 694 B K - 0 0 125 157,-0.0 -3,-2.4 2,-0.0 2,-0.4 -0.586 55.1-170.2 -80.7 137.2 19.2 15.7 76.9 309 695 B Y E +I 304 0D 5 -5,-0.3 157,-3.0 -2,-0.2 2,-0.3 -0.991 10.5 168.8-136.3 119.8 22.8 15.0 75.8 310 696 B D E -IJ 303 465D 1 -7,-2.3 -7,-2.5 -2,-0.4 2,-0.4 -0.961 27.6-138.4-135.1 154.0 23.8 13.0 72.7 311 697 B L E -IJ 302 464D 0 153,-3.1 152,-3.1 -2,-0.3 153,-0.9 -0.910 22.5-167.0-103.5 137.3 26.9 12.2 70.6 312 698 B F E -IJ 301 462D 0 -11,-2.8 -11,-2.2 -2,-0.4 2,-0.5 -0.858 14.3-140.2-122.4 152.3 26.6 12.2 66.7 313 699 B I E -IJ 300 461D 1 148,-3.4 148,-2.1 -2,-0.3 2,-0.4 -0.989 19.4-165.2-115.7 121.7 29.0 10.9 64.1 314 700 B V E -IJ 299 460D 0 -15,-2.4 -15,-3.1 -2,-0.5 2,-0.6 -0.953 20.1-132.3-112.3 129.5 29.3 13.1 60.9 315 701 B D E > -I 298 0D 13 144,-3.3 4,-2.1 -2,-0.4 5,-0.4 -0.704 17.4-149.7 -75.9 113.6 30.9 11.9 57.6 316 702 B Q H > S+ 0 0 0 -19,-1.8 4,-1.1 -2,-0.6 110,-0.3 0.844 92.5 41.8 -57.3 -37.6 33.3 14.8 56.7 317 703 B H H > S+ 0 0 26 -20,-0.4 4,-2.6 2,-0.2 109,-0.2 0.978 116.5 43.7 -73.4 -59.3 32.9 14.3 52.9 318 704 B A H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.821 116.8 46.5 -58.0 -37.4 29.1 13.6 52.6 319 705 B S H X S+ 0 0 0 -4,-2.1 4,-1.5 140,-0.3 -1,-0.2 0.907 114.4 46.6 -74.2 -40.5 28.1 16.4 54.9 320 706 B D H X S+ 0 0 11 -4,-1.1 4,-2.3 -5,-0.4 -2,-0.2 0.916 114.7 49.7 -64.3 -41.7 30.5 18.9 53.2 321 707 B E H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.882 104.5 55.8 -62.6 -48.3 29.2 17.7 49.8 322 708 B K H X S+ 0 0 32 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.880 112.2 46.2 -57.2 -36.2 25.4 18.0 50.8 323 709 B Y H X S+ 0 0 47 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.969 114.6 43.6 -68.0 -56.1 26.2 21.7 51.6 324 710 B N H X S+ 0 0 38 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.859 115.4 51.7 -56.3 -41.2 28.2 22.5 48.4 325 711 B F H X S+ 0 0 3 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.943 110.1 46.0 -61.4 -53.3 25.6 20.6 46.3 326 712 B E H X S+ 0 0 39 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.796 112.1 53.5 -64.8 -25.8 22.6 22.5 47.8 327 713 B T H X S+ 0 0 51 -4,-1.9 4,-2.7 2,-0.2 5,-0.4 0.937 110.4 46.3 -71.1 -48.1 24.6 25.8 47.3 328 714 B L H X S+ 0 0 31 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.877 111.1 53.5 -59.9 -40.6 25.2 24.9 43.6 329 715 B Q H < S+ 0 0 15 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.853 117.6 36.1 -63.6 -37.8 21.5 24.0 43.2 330 716 B A H < S+ 0 0 18 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.877 127.5 27.5 -84.9 -43.3 20.3 27.3 44.6 331 717 B V H < S+ 0 0 100 -4,-2.7 2,-0.2 -5,-0.1 -3,-0.2 0.776 87.9 104.1 -94.5 -32.6 22.9 29.9 43.3 332 718 B T < - 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