==== 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 CHAPERONE 25-MAY-12 4FCV . COMPND 2 MOLECULE: CHAPERONE PROTEIN CLPB; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR A.B.BITER,S.LEE,N.SUNG,F.T.F.TSAI . 933 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45304.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 698 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 87 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 3.4 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 . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 53 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 127 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 346 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.7 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 6 0 3 6 9 0 3 6 0 9 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 6 6 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 PARALLEL BRIDGES PER LADDER . 3 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 3 0 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 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 1 542 A X 0 0 126 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.2 -18.7 -6.8 9.3 2 543 A L > + 0 0 146 3,-0.1 4,-2.1 5,-0.0 5,-0.1 0.538 360.0 41.5-132.2 -45.5 -22.1 -8.2 8.5 3 544 A G H > S+ 0 0 47 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.810 112.4 55.8 -77.3 -33.8 -22.8 -7.4 4.8 4 545 A E H > S+ 0 0 77 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.811 109.1 50.0 -66.1 -32.0 -19.3 -8.2 3.8 5 546 A R H >> S+ 0 0 150 2,-0.2 3,-2.6 1,-0.2 4,-1.6 0.989 105.7 53.8 -62.7 -64.2 -19.9 -11.6 5.4 6 547 A E H 3X S+ 0 0 103 -4,-2.1 4,-1.2 1,-0.3 -2,-0.2 0.793 106.7 54.2 -40.0 -40.2 -23.2 -12.1 3.5 7 548 A K H 3< S+ 0 0 60 -4,-1.7 -1,-0.3 1,-0.2 7,-0.2 0.775 108.2 49.6 -67.5 -28.6 -21.3 -11.5 0.2 8 549 A L H X< S+ 0 0 12 -3,-2.6 3,-1.1 -4,-0.7 4,-0.3 0.836 108.3 49.1 -83.3 -36.4 -18.8 -14.2 1.1 9 550 A L H 3< S+ 0 0 122 -4,-1.6 3,-0.2 1,-0.3 -2,-0.2 0.788 119.1 41.7 -71.0 -28.7 -21.2 -17.0 1.9 10 551 A R T 3X S+ 0 0 93 -4,-1.2 4,-1.5 -5,-0.3 -1,-0.3 0.016 85.0 117.2-100.0 23.4 -23.0 -16.2 -1.3 11 552 A L H <> + 0 0 0 -3,-1.1 4,-1.1 1,-0.2 5,-0.2 0.895 67.9 52.7 -65.4 -45.3 -19.7 -15.8 -3.2 12 553 A E H >> S+ 0 0 36 -4,-0.3 4,-2.4 1,-0.2 3,-0.7 0.907 108.2 51.8 -57.9 -44.9 -20.1 -18.6 -5.7 13 554 A E H 3> S+ 0 0 122 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.887 106.1 55.4 -56.9 -41.4 -23.5 -17.3 -6.8 14 555 A E H 3< S+ 0 0 58 -4,-1.5 4,-0.3 1,-0.2 -1,-0.2 0.754 112.6 42.7 -63.5 -26.8 -21.9 -13.8 -7.3 15 556 A L H XX S+ 0 0 0 -4,-1.1 4,-2.2 -3,-0.7 3,-0.9 0.788 104.6 61.0 -90.3 -34.0 -19.3 -15.3 -9.6 16 557 A H H 3< S+ 0 0 63 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.1 0.706 89.6 74.9 -68.7 -18.0 -21.6 -17.6 -11.6 17 558 A K T 3< S+ 0 0 127 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.911 116.0 17.4 -53.0 -46.4 -23.5 -14.5 -12.7 18 559 A R T <4 S+ 0 0 79 -3,-0.9 2,-0.6 -4,-0.3 -2,-0.2 0.586 123.7 63.1-106.7 -17.1 -20.6 -13.7 -15.1 19 560 A V < - 0 0 4 -4,-2.2 -1,-0.2 44,-0.1 2,-0.2 -0.906 68.9-157.9-118.8 106.4 -18.9 -17.0 -15.2 20 561 A V - 0 0 22 -2,-0.6 -3,-0.1 -3,-0.1 200,-0.1 -0.491 59.3 -15.7 -73.2 143.6 -20.9 -19.9 -16.7 21 562 A G S S+ 0 0 8 -2,-0.2 5,-0.1 1,-0.1 195,-0.1 -0.075 80.6 107.4 62.8-157.1 -19.8 -23.5 -15.8 22 563 A Q > + 0 0 1 193,-0.2 4,-1.0 1,-0.1 -1,-0.1 0.897 38.9 162.4 49.9 49.6 -16.4 -24.3 -14.2 23 564 A D H >> + 0 0 92 1,-0.2 4,-2.2 2,-0.2 3,-0.6 0.913 69.0 54.0 -67.4 -44.2 -18.1 -25.0 -10.9 24 565 A E H 3> S+ 0 0 13 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.910 108.6 50.8 -53.2 -46.4 -15.1 -27.0 -9.5 25 566 A A H 3> S+ 0 0 1 187,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.782 110.0 50.6 -62.8 -28.4 -12.8 -24.1 -10.3 26 567 A I H X S+ 0 0 51 -4,-3.3 4,-2.2 1,-0.2 3,-1.2 0.976 104.5 53.3 -58.9 -59.8 -12.9 -21.4 -0.5 32 573 A A H 3X S+ 0 0 0 -4,-1.6 4,-0.9 1,-0.3 -1,-0.2 0.770 109.6 50.9 -45.5 -33.0 -9.4 -20.0 -0.5 33 574 A I H 3X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 -1,-0.3 0.808 106.3 52.7 -80.5 -30.9 -10.9 -16.5 0.0 34 575 A R H S+ 0 0 69 -4,-2.2 5,-2.8 2,-0.2 4,-1.2 0.817 109.5 50.6 -63.3 -31.5 -10.0 -19.0 4.6 36 577 A A H ><5S+ 0 0 21 -4,-0.9 3,-1.1 -5,-0.3 5,-0.3 0.996 113.5 40.9 -64.2 -66.1 -8.5 -15.6 4.1 37 578 A R H 3<5S+ 0 0 72 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.663 114.3 53.7 -63.1 -19.9 -11.4 -13.6 5.7 38 579 A A H 3<5S- 0 0 72 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.822 115.2-119.7 -77.5 -34.1 -11.8 -16.2 8.4 39 580 A G T <<5S+ 0 0 58 -4,-1.2 -3,-0.2 -3,-1.1 -2,-0.1 0.862 75.5 123.9 95.7 48.7 -8.1 -15.8 9.2 40 581 A L < + 0 0 122 -5,-2.8 2,-0.3 -4,-0.1 -4,-0.2 0.448 56.4 82.9-112.8 -9.7 -6.7 -19.2 8.7 41 582 A K S S- 0 0 80 -6,-0.9 4,-0.0 -5,-0.3 6,-0.0 -0.720 96.8 -92.7 -95.6 147.1 -4.1 -18.1 6.2 42 583 A D > - 0 0 78 -2,-0.3 3,-1.1 1,-0.2 -2,-0.1 -0.440 36.0-145.7 -51.6 114.7 -0.7 -16.6 7.0 43 584 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.534 92.4 65.2 -74.0 -7.0 -1.5 -12.8 6.9 44 585 A N T 3 S+ 0 0 76 2,-0.1 103,-0.1 100,-0.1 114,-0.1 0.008 94.4 73.3 -98.5 24.6 1.9 -11.9 5.5 45 586 A R S < S- 0 0 46 -3,-1.1 98,-0.1 114,-0.2 99,-0.1 -0.976 99.0 -83.1-136.3 146.6 1.1 -13.7 2.3 46 587 A P - 0 0 8 0, 0.0 113,-0.2 0, 0.0 114,-0.2 -0.075 44.3-103.3 -54.9 150.1 -1.3 -12.6 -0.4 47 588 A I S S- 0 0 12 114,-0.7 2,-0.3 111,-0.3 115,-0.2 0.828 97.9 -13.1 -39.6 -48.8 -5.1 -13.3 -0.1 48 589 A G E -a 162 0A 0 113,-0.9 115,-3.5 -12,-0.0 2,-0.4 -0.982 55.7-158.6-157.6 151.3 -4.8 -16.1 -2.5 49 590 A S E -a 163 0A 0 -2,-0.3 159,-1.6 113,-0.2 160,-1.4 -0.994 22.7-177.2-132.1 124.9 -2.4 -17.5 -5.1 50 591 A F E -ab 164 209A 0 113,-2.5 115,-3.1 -2,-0.4 2,-0.6 -0.928 28.1-147.7-130.8 148.3 -3.7 -19.8 -7.9 51 592 A L E -ab 165 210A 0 158,-2.0 160,-2.7 -2,-0.4 2,-0.9 -0.965 19.1-159.1-104.7 120.8 -2.5 -21.8 -10.8 52 593 A F E +ab 166 211A 0 113,-3.0 115,-1.8 -2,-0.6 2,-0.2 -0.813 17.6 176.1-102.9 92.5 -5.1 -21.8 -13.6 53 594 A L E +ab 167 212A 0 158,-2.2 160,-2.2 -2,-0.9 115,-0.2 -0.636 29.9 75.3 -91.6 155.0 -4.5 -24.8 -15.8 54 595 A G S S- 0 0 0 113,-0.7 117,-0.2 -2,-0.2 160,-0.1 -0.763 77.9 -39.5 135.3 178.4 -6.7 -25.8 -18.7 55 596 A P - 0 0 18 0, 0.0 3,-0.5 0, 0.0 2,-0.3 -0.046 62.6 -95.6 -70.5 174.7 -7.7 -24.8 -22.3 56 597 A T S S+ 0 0 63 205,-0.3 209,-0.1 204,-0.2 112,-0.0 -0.738 97.9 23.4 -97.5 143.8 -8.0 -21.3 -23.7 57 598 A G S S+ 0 0 30 -2,-0.3 207,-2.2 206,-0.2 -1,-0.2 0.617 88.7 106.0 85.1 18.1 -11.3 -19.3 -24.0 58 599 A V S S- 0 0 6 -3,-0.5 156,-0.1 205,-0.2 -2,-0.1 0.295 100.8 -69.4-116.8 9.1 -13.2 -21.3 -21.3 59 600 A G S > S+ 0 0 12 154,-0.1 4,-3.4 -40,-0.0 5,-0.3 0.327 90.1 119.7 131.5 -7.4 -13.2 -18.7 -18.4 60 601 A K H > S+ 0 0 18 -5,-0.3 4,-2.5 1,-0.2 5,-0.1 0.957 90.1 34.1 -52.0 -67.5 -9.8 -18.2 -16.9 61 602 A T H > S+ 0 0 43 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.901 116.9 57.9 -52.9 -45.3 -9.5 -14.4 -17.6 62 603 A E H > S+ 0 0 68 2,-0.2 4,-4.1 1,-0.2 5,-0.2 0.941 108.1 44.5 -52.0 -55.2 -13.3 -14.1 -17.0 63 604 A L H X S+ 0 0 0 -4,-3.4 4,-3.9 2,-0.2 5,-0.3 0.930 112.9 53.2 -53.4 -48.5 -13.1 -15.5 -13.5 64 605 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.931 116.0 38.7 -51.2 -50.9 -10.0 -13.2 -13.0 65 606 A K H X S+ 0 0 68 -4,-3.4 4,-2.8 2,-0.2 -2,-0.2 0.933 118.2 48.6 -66.5 -47.2 -12.0 -10.2 -14.1 66 607 A T H X S+ 0 0 1 -4,-4.1 4,-3.1 -5,-0.2 5,-0.2 0.942 111.7 48.9 -61.1 -51.3 -15.2 -11.3 -12.4 67 608 A L H X S+ 0 0 0 -4,-3.9 4,-1.2 1,-0.2 5,-0.4 0.952 111.6 49.9 -50.2 -56.8 -13.4 -12.0 -9.1 68 609 A A H >X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.3 3,-0.7 0.913 114.0 46.1 -47.2 -49.8 -11.7 -8.7 -9.3 69 610 A A H 3X S+ 0 0 20 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.883 114.8 45.5 -64.7 -41.2 -15.1 -7.0 -9.9 70 611 A T H 3< S+ 0 0 19 -4,-3.1 -1,-0.2 2,-0.2 -2,-0.2 0.496 122.0 36.3 -83.7 -2.3 -16.9 -8.9 -7.2 71 612 A L H << S+ 0 0 12 -4,-1.2 -2,-0.2 -3,-0.7 -3,-0.2 0.695 133.0 22.4-116.6 -35.5 -14.3 -8.4 -4.5 72 613 A F H < S- 0 0 30 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.2 0.185 104.5-116.5-124.4 9.3 -12.9 -4.9 -5.2 73 614 A D S < S+ 0 0 132 -4,-1.0 2,-0.2 -5,-0.2 -4,-0.2 0.791 81.5 63.3 61.9 40.1 -16.0 -3.6 -7.1 74 615 A T S > S- 0 0 48 -6,-0.5 3,-0.6 -9,-0.2 -2,-0.2 -0.811 70.8-131.1 179.9 146.1 -14.5 -2.9 -10.6 75 616 A E T 3 S+ 0 0 88 -2,-0.2 3,-0.3 1,-0.2 -6,-0.1 0.773 108.4 66.6 -67.6 -29.3 -12.9 -4.7 -13.6 76 617 A E T 3 S+ 0 0 136 1,-0.2 2,-1.4 -3,-0.1 -1,-0.2 0.741 79.1 85.1 -61.7 -24.5 -10.2 -2.0 -13.4 77 618 A A S < S+ 0 0 2 -3,-0.6 45,-2.0 -12,-0.1 2,-0.3 -0.101 79.4 78.7 -77.3 39.6 -9.1 -3.5 -10.1 78 619 A X E -c 122 0A 31 -2,-1.4 2,-0.5 -3,-0.3 45,-0.2 -0.988 64.2-147.9-150.2 146.7 -6.9 -6.1 -11.8 79 620 A I E -c 123 0A 21 43,-2.7 45,-3.9 -2,-0.3 2,-0.5 -0.926 10.4-156.9-117.2 122.8 -3.5 -6.1 -13.4 80 621 A R E -c 124 0A 75 -2,-0.5 2,-0.4 43,-0.2 45,-0.2 -0.887 10.2-177.4-106.0 131.1 -2.6 -8.3 -16.3 81 622 A I E -c 125 0A 7 43,-4.2 45,-2.7 -2,-0.5 2,-0.7 -0.978 16.7-145.8-125.3 135.5 1.0 -9.3 -17.0 82 623 A D E > -c 126 0A 36 -2,-0.4 3,-2.4 43,-0.2 45,-0.1 -0.865 1.4-157.9-109.8 104.9 2.0 -11.4 -20.0 83 624 A X G > S+ 0 0 1 43,-2.2 3,-1.1 -2,-0.7 49,-0.2 0.562 86.5 77.4 -59.2 -7.6 4.9 -13.7 -19.3 84 625 A T G 3 S+ 0 0 62 1,-0.2 3,-0.5 42,-0.2 -1,-0.3 0.834 92.4 51.5 -67.7 -33.7 5.6 -13.8 -23.1 85 626 A E G < S+ 0 0 89 -3,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.285 103.8 63.4 -85.8 11.7 7.2 -10.4 -22.8 86 627 A Y < + 0 0 0 -3,-1.1 46,-3.2 -4,-0.1 -1,-0.2 -0.268 60.5 109.0-130.9 47.3 9.4 -11.6 -20.0 87 628 A X + 0 0 92 -3,-0.5 -1,-0.1 44,-0.2 2,-0.1 0.472 69.1 74.7 -99.3 -3.1 11.6 -14.3 -21.5 88 629 A E S S- 0 0 123 -3,-0.1 4,-0.4 44,-0.1 44,-0.2 -0.328 86.2-116.9-102.0 177.6 14.7 -12.1 -21.4 89 630 A K S >> S+ 0 0 150 1,-0.2 3,-1.1 2,-0.2 4,-0.5 0.909 115.9 62.7 -74.0 -49.6 17.2 -11.0 -18.7 90 631 A H H 3> S+ 0 0 114 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.625 88.5 79.1 -45.9 -19.4 16.1 -7.4 -19.4 91 632 A A H >> S+ 0 0 2 1,-0.2 3,-2.0 2,-0.2 4,-1.9 0.948 80.7 58.1 -60.4 -58.0 12.6 -8.5 -18.2 92 633 A V H <> S+ 0 0 33 -3,-1.1 4,-2.1 -4,-0.4 5,-0.4 0.847 104.8 54.3 -41.6 -44.5 13.2 -8.4 -14.5 93 634 A S H 3X S+ 0 0 20 -4,-0.5 4,-1.2 1,-0.2 5,-0.3 0.782 108.2 48.1 -66.6 -28.4 14.1 -4.7 -14.8 94 635 A R H << S+ 0 0 90 -3,-2.0 16,-0.9 -4,-0.8 17,-0.4 0.802 110.4 53.9 -78.6 -30.2 10.8 -4.0 -16.6 95 636 A L H < S+ 0 0 0 -4,-1.9 17,-1.3 14,-0.2 16,-1.1 0.936 129.4 10.3 -67.2 -50.2 8.8 -5.9 -14.0 96 637 A I H < S- 0 0 30 -4,-2.1 55,-1.3 -5,-0.2 13,-0.6 0.556 125.2 -67.7-111.8 -13.0 10.1 -4.1 -10.9 97 638 A G < - 0 0 3 -4,-1.2 -3,-0.2 -5,-0.4 12,-0.2 0.228 48.9-102.2 119.1 112.9 12.0 -1.1 -12.2 98 639 A A - 0 0 9 6,-0.8 4,-0.3 -5,-0.3 10,-0.1 -0.336 53.6 -89.4 -60.4 140.6 15.2 -1.0 -14.2 99 640 A P - 0 0 66 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.052 65.3 -66.2 -53.1 156.6 18.2 -0.1 -12.0 100 641 A P S S+ 0 0 82 0, 0.0 3,-0.1 0, 0.0 4,-0.1 0.068 120.7 34.1 -47.2 152.2 19.0 3.7 -11.8 101 642 A G S S+ 0 0 78 1,-0.3 2,-0.4 -3,-0.1 3,-0.0 0.840 93.4 127.0 66.3 40.8 20.2 5.5 -14.9 102 643 A Y S > S- 0 0 140 -4,-0.3 3,-2.1 -3,-0.1 -1,-0.3 -0.986 73.9-110.9-136.4 143.3 18.0 3.4 -17.1 103 644 A V T 3 S+ 0 0 122 -2,-0.4 2,-0.3 1,-0.3 4,-0.2 0.719 117.1 33.2 -30.0 -55.2 15.4 4.2 -19.7 104 645 A G T 3 S+ 0 0 23 1,-0.1 -6,-0.8 2,-0.1 -1,-0.3 -0.269 89.8 111.2-104.6 46.6 12.5 3.0 -17.5 105 646 A Y S X S+ 0 0 45 -3,-2.1 3,-1.9 -2,-0.3 47,-0.2 0.980 81.5 25.7 -82.5 -74.9 13.8 3.8 -14.1 106 647 A E T 3 S+ 0 0 160 1,-0.3 -2,-0.1 -4,-0.2 3,-0.1 0.767 114.6 65.6 -68.3 -26.3 11.7 6.7 -12.5 107 648 A E T 3 S- 0 0 126 -4,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.459 107.5-143.1 -69.6 -1.9 8.7 5.7 -14.6 108 649 A G < - 0 0 13 -3,-1.9 2,-0.5 -10,-0.1 -11,-0.3 0.031 20.5 -62.0 73.5-177.4 8.9 2.6 -12.4 109 650 A G > - 0 0 1 -13,-0.6 4,-3.0 -12,-0.2 5,-0.3 -0.957 45.9-127.5-107.7 130.3 8.3 -1.1 -13.3 110 651 A Q H > S+ 0 0 67 -16,-0.9 4,-1.2 -2,-0.5 -15,-0.1 0.738 104.7 49.2 -55.3 -31.1 4.7 -1.7 -14.3 111 652 A L H >> S+ 0 0 0 -16,-1.1 4,-2.5 -17,-0.4 3,-0.6 0.991 117.3 38.0 -67.9 -61.5 4.1 -4.5 -11.8 112 653 A T H 3> S+ 0 0 0 -17,-1.3 4,-2.0 1,-0.2 -2,-0.2 0.819 118.6 51.4 -60.6 -32.3 5.4 -2.8 -8.7 113 654 A E H 3X S+ 0 0 28 -4,-3.0 4,-1.6 2,-0.2 -1,-0.2 0.766 110.6 48.1 -76.0 -26.6 3.9 0.5 -9.9 114 655 A A H > S- 0 0 15 -2,-0.4 3,-2.1 39,-0.2 4,-0.5 0.913 70.1-177.1 59.4 50.4 1.7 -18.1 -19.7 128 669 A I G >4 S+ 0 0 0 38,-2.2 3,-0.9 -3,-0.5 39,-0.1 0.762 77.7 60.6 -49.9 -30.7 3.7 -18.3 -16.4 129 670 A E G 34 S+ 0 0 31 1,-0.2 -1,-0.3 37,-0.2 -2,-0.1 0.798 93.4 63.8 -68.8 -28.8 5.9 -21.1 -18.0 130 671 A K G <4 S+ 0 0 83 -3,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.670 83.3 111.3 -68.0 -17.4 7.1 -18.7 -20.7 131 672 A A S << S- 0 0 6 -3,-0.9 -44,-0.2 -4,-0.5 -47,-0.1 -0.261 80.3-108.3 -62.3 140.9 8.7 -16.5 -18.0 132 673 A H >> - 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0 0 52 0, 0.0 4,-1.1 0, 0.0 -4,-0.0 0.364 49.7 -18.0 -89.6-139.8 -13.6 -37.0 -13.4 184 725 A Y T 4 S+ 0 0 113 1,-0.2 4,-0.3 2,-0.1 -2,-0.1 0.731 134.8 4.8 -34.1 -55.7 -13.6 -34.4 -10.6 185 726 A E T > S+ 0 0 120 2,-0.1 4,-0.8 1,-0.1 3,-0.4 0.808 108.1 78.6-108.5 -38.9 -10.1 -35.0 -9.1 186 727 A R H > S+ 0 0 137 1,-0.3 4,-2.5 2,-0.2 3,-0.2 0.745 98.2 52.0 -53.9 -28.3 -8.1 -37.6 -11.1 187 728 A I H X S+ 0 0 12 -4,-1.1 4,-2.0 2,-0.2 5,-0.3 0.946 103.4 56.0 -66.9 -50.2 -7.3 -34.9 -13.7 188 729 A R H 4 S+ 0 0 80 -3,-0.4 4,-0.2 -4,-0.3 -2,-0.2 0.594 114.5 44.7 -57.9 -11.5 -6.0 -32.5 -10.9 189 730 A D H >X S+ 0 0 99 -4,-0.8 4,-1.0 -3,-0.2 3,-0.7 0.872 109.4 47.8 -94.1 -59.4 -3.7 -35.5 -10.1 190 731 A E H 3X S+ 0 0 63 -4,-2.5 4,-0.6 1,-0.3 -2,-0.2 0.712 111.7 55.3 -60.2 -21.2 -2.4 -36.7 -13.4 191 732 A V H >X S+ 0 0 8 -4,-2.0 4,-2.1 2,-0.2 3,-0.8 0.852 95.0 65.0 -76.7 -38.2 -1.6 -33.1 -14.3 192 733 A F H <> S+ 0 0 65 -3,-0.7 4,-2.2 -5,-0.3 -2,-0.2 0.838 96.9 58.8 -52.7 -37.2 0.5 -32.6 -11.1 193 734 A K H 3X S+ 0 0 120 -4,-1.0 4,-0.8 1,-0.2 -1,-0.3 0.871 109.0 42.2 -59.2 -42.1 2.9 -35.1 -12.6 194 735 A V H X S+ 0 0 1 -4,-2.1 4,-3.6 1,-0.2 3,-0.8 0.880 101.0 55.1 -68.0 -40.8 3.6 -29.8 -13.5 196 737 A Q H 3< S+ 0 0 105 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.843 103.8 56.5 -59.6 -36.0 6.5 -31.2 -11.5 197 738 A Q H 3< S+ 0 0 156 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.727 120.5 28.6 -69.6 -24.4 8.5 -31.7 -14.7 198 739 A H H << S+ 0 0 116 -3,-0.8 2,-0.4 -4,-0.7 -2,-0.2 0.693 122.3 48.8-106.0 -29.1 8.1 -28.0 -15.6 199 740 A F S < S- 0 0 9 -4,-3.6 -1,-0.2 -5,-0.1 -70,-0.0 -0.936 80.6-116.8-121.6 139.8 7.9 -26.4 -12.1 200 741 A R >> - 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0 0 18 0, 0.0 3,-0.5 0, 0.0 2,-0.3 -0.085 62.2 -97.1 -72.7 174.3 0.7 -4.7 -48.1 368 597 B T S S+ 0 0 70 205,-0.3 209,-0.1 1,-0.2 112,-0.0 -0.715 97.7 25.4 -96.6 143.3 1.3 -1.2 -49.3 369 598 B G S S+ 0 0 28 -2,-0.3 207,-2.5 206,-0.2 -1,-0.2 0.649 89.1 104.5 85.7 18.2 -0.3 0.4 -52.4 370 599 B V S S- 0 0 7 -3,-0.5 156,-0.1 205,-0.2 -2,-0.1 0.292 100.9 -69.1-118.1 10.0 -3.4 -1.9 -52.4 371 600 B G S > S+ 0 0 13 154,-0.1 4,-3.2 -40,-0.0 5,-0.3 0.339 89.7 119.2 131.3 -9.3 -6.1 0.4 -51.2 372 601 B K H > S+ 0 0 19 -5,-0.3 4,-2.4 1,-0.2 5,-0.1 0.953 90.3 34.2 -50.9 -66.6 -5.8 1.3 -47.5 373 602 B T H > S+ 0 0 45 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.911 116.6 58.2 -54.0 -45.9 -5.5 5.1 -47.9 374 603 B E H > S+ 0 0 69 1,-0.2 4,-4.2 2,-0.2 -2,-0.2 0.927 108.2 44.0 -52.3 -54.2 -7.8 5.0 -50.8 375 604 B L H X S+ 0 0 0 -4,-3.2 4,-3.7 2,-0.2 5,-0.3 0.911 112.8 53.8 -55.5 -46.8 -10.6 3.4 -48.8 376 605 B A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.944 116.3 38.0 -49.9 -54.0 -9.7 5.9 -46.0 377 606 B K H X S+ 0 0 59 -4,-3.5 4,-2.8 2,-0.2 -2,-0.2 0.942 118.5 48.6 -64.3 -49.8 -10.1 8.8 -48.5 378 607 B T H X S+ 0 0 0 -4,-4.2 4,-3.0 -5,-0.2 5,-0.2 0.921 111.3 49.2 -59.3 -50.4 -13.1 7.2 -50.3 379 608 B L H X S+ 0 0 0 -4,-3.7 4,-1.3 2,-0.2 5,-0.3 0.951 111.7 50.1 -50.1 -55.2 -15.0 6.5 -47.1 380 609 B A H >X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.3 3,-0.7 0.922 113.6 45.8 -49.4 -52.0 -14.3 10.0 -45.9 381 610 B A H 3X S+ 0 0 19 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.896 115.6 45.4 -60.5 -43.7 -15.6 11.4 -49.2 382 611 B T H 3< S+ 0 0 20 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.548 122.0 36.0 -81.9 -5.7 -18.7 9.1 -49.3 383 612 B L H << S+ 0 0 12 -4,-1.3 -2,-0.2 -3,-0.7 -1,-0.2 0.713 133.4 22.3-114.6 -31.8 -19.7 9.7 -45.6 384 613 B F H < S- 0 0 31 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.164 104.6-116.5-127.1 9.7 -18.8 13.3 -45.1 385 614 B D S < S+ 0 0 132 -4,-1.0 2,-0.2 -5,-0.2 -4,-0.2 0.782 81.5 62.7 60.7 39.7 -18.9 14.4 -48.7 386 615 B T S > S- 0 0 47 -6,-0.5 3,-0.7 -9,-0.2 -2,-0.2 -0.811 70.9-130.6-179.6 146.7 -15.2 15.5 -49.3 387 616 B E T 3 S+ 0 0 82 -2,-0.2 3,-0.3 1,-0.2 -6,-0.1 0.792 108.2 66.9 -67.6 -30.0 -11.7 14.1 -49.3 388 617 B E T 3 S+ 0 0 145 1,-0.3 2,-1.5 -3,-0.1 -1,-0.2 0.731 79.0 86.0 -61.4 -22.3 -10.7 17.1 -47.1 389 618 B A S < S+ 0 0 2 -3,-0.7 45,-2.0 -12,-0.1 2,-0.3 -0.087 79.0 77.3 -78.6 39.7 -12.9 15.5 -44.4 390 619 B X E -k 434 0E 31 -2,-1.5 2,-0.5 -3,-0.3 45,-0.2 -0.986 65.1-146.3-152.0 145.3 -10.1 13.3 -43.2 391 620 B I E -k 435 0E 21 43,-2.5 45,-3.6 -2,-0.3 2,-0.5 -0.914 10.9-155.6-115.7 122.8 -7.0 13.7 -41.1 392 621 B R E -k 436 0E 53 -2,-0.5 2,-0.4 43,-0.2 45,-0.2 -0.878 10.9-177.5-104.5 130.3 -3.7 11.8 -41.7 393 622 B I E -k 437 0E 5 43,-3.7 45,-3.0 -2,-0.5 2,-0.8 -0.984 16.3-147.3-124.3 133.6 -1.2 11.3 -38.9 394 623 B D E > -k 438 0E 27 -2,-0.4 3,-2.6 43,-0.2 45,-0.1 -0.849 1.4-158.3-108.1 103.1 2.1 9.5 -39.5 395 624 B X G > S+ 0 0 0 43,-2.3 3,-1.1 -2,-0.8 49,-0.2 0.558 86.0 78.3 -57.1 -7.3 3.2 7.5 -36.4 396 625 B T G 3 S+ 0 0 65 1,-0.2 3,-0.4 42,-0.2 -1,-0.3 0.821 92.1 51.2 -68.6 -32.2 6.8 7.7 -37.8 397 626 B E G < S+ 0 0 79 -3,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.264 103.6 63.7 -87.0 12.6 7.0 11.3 -36.5 398 627 B Y < + 0 0 1 -3,-1.1 46,-3.2 -4,-0.1 -1,-0.2 -0.274 60.5 108.9-131.3 47.7 5.8 10.1 -33.0 399 628 B X + 0 0 94 -3,-0.4 2,-0.1 44,-0.2 -1,-0.1 0.457 68.9 74.7-100.1 -2.7 8.5 7.8 -31.8 400 629 B E S S- 0 0 122 -3,-0.1 4,-0.4 44,-0.1 44,-0.2 -0.346 86.4-117.0-102.1 177.4 9.8 10.3 -29.2 401 630 B K S >> S+ 0 0 138 1,-0.2 3,-1.1 2,-0.2 4,-0.5 0.908 116.0 63.1 -74.7 -48.5 8.6 11.5 -25.8 402 631 B H H 3> S+ 0 0 112 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.619 88.2 79.2 -46.6 -18.1 8.2 15.0 -27.3 403 632 B A H >> S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 3,-1.8 0.944 80.5 58.3 -61.5 -56.7 5.6 13.4 -29.6 404 633 B V H <>>S+ 0 0 33 -3,-1.1 4,-2.2 -4,-0.4 5,-0.6 0.854 104.7 53.8 -42.2 -45.7 2.6 13.3 -27.2 405 634 B S H 3X5S+ 0 0 24 -4,-0.5 4,-0.6 1,-0.2 5,-0.4 0.763 107.9 49.0 -65.7 -28.1 2.9 17.1 -26.8 406 635 B R H <<5S+ 0 0 86 -3,-1.8 16,-1.2 -4,-0.8 17,-0.4 0.797 111.5 52.4 -78.2 -29.5 2.7 17.6 -30.6 407 636 B L H <5S+ 0 0 0 -4,-1.9 17,-1.2 14,-0.2 16,-1.1 0.941 132.1 4.4 -70.1 -53.5 -0.3 15.3 -30.8 408 637 B I H <5S- 0 0 28 -4,-2.2 55,-1.4 15,-0.2 13,-0.8 0.629 123.6 -58.4-112.5 -21.9 -2.6 17.0 -28.1 409 638 B G << - 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0 0 19 -3,-0.8 -11,-0.4 -4,-0.5 2,-0.3 -0.307 34.1 -51.3 83.6-175.6 5.0 41.8 -48.6 733 650 C G > - 0 0 1 -13,-1.9 4,-3.1 -12,-0.2 5,-0.3 -0.788 45.7-125.6 -95.7 144.6 6.9 38.5 -48.8 734 651 C Q H > S+ 0 0 68 -16,-1.1 4,-1.0 -2,-0.3 -15,-0.1 0.776 109.0 50.5 -62.2 -29.1 9.6 38.1 -51.4 735 652 C L H >> S+ 0 0 0 -16,-0.9 4,-2.5 -17,-0.4 3,-0.7 0.989 116.7 37.3 -68.6 -62.3 8.0 34.9 -52.8 736 653 C T H 3> S+ 0 0 0 -17,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.839 118.8 51.8 -58.7 -35.2 4.4 36.4 -53.2 737 654 C E H 3X S+ 0 0 29 -4,-3.1 4,-1.4 2,-0.2 -1,-0.2 0.754 110.6 48.1 -73.0 -25.9 5.9 39.7 -54.3 738 655 C A H > S- 0 0 17 -2,-0.4 3,-2.2 39,-0.3 4,-0.5 0.918 70.3-177.7 59.0 50.9 17.1 22.3 -50.0 752 669 C I G >4 S+ 0 0 0 38,-2.1 3,-0.8 -3,-0.5 39,-0.1 0.755 77.6 60.5 -50.7 -30.0 13.4 21.8 -49.7 753 670 C E G 34 S+ 0 0 31 37,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.806 93.5 63.8 -70.1 -27.9 13.9 19.3 -46.8 754 671 C K G <4 S+ 0 0 87 -3,-2.2 -1,-0.2 2,-0.1 -2,-0.2 0.682 82.9 111.1 -69.6 -17.2 15.6 22.1 -44.7 755 672 C A S << S- 0 0 6 -3,-0.8 -44,-0.2 -4,-0.5 -47,-0.1 -0.259 80.3-108.8 -62.3 140.4 12.3 23.9 -44.7 756 673 C H >> - 0 0 32 -46,-3.0 3,-1.2 -44,-0.2 4,-1.0 -0.574 32.7-118.9 -66.9 129.2 10.2 24.3 -41.6 757 674 C P H 3> S+ 0 0 77 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.608 112.2 63.4 -54.9 -17.6 7.1 22.0 -42.0 758 675 C D H >> S+ 0 0 60 2,-0.2 4,-1.1 1,-0.2 3,-0.8 0.973 99.2 53.2 -61.7 -56.7 4.8 25.1 -41.7 759 676 C V H <> S+ 0 0 0 -3,-1.2 4,-1.9 1,-0.3 -1,-0.2 0.803 101.7 62.2 -49.9 -36.2 6.3 26.5 -44.9 760 677 C F H 3X S+ 0 0 17 -4,-1.0 4,-3.0 1,-0.2 3,-0.3 0.949 97.7 55.1 -50.6 -55.0 5.5 23.2 -46.6 761 678 C N H X S+ 0 0 74 -4,-2.3 4,-2.6 1,-0.2 3,-1.0 0.927 111.7 47.1 -49.2 -49.3 -1.7 24.8 -51.0 766 683 C X H 3X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.866 106.1 58.2 -61.4 -40.3 0.0 26.6 -53.9 767 684 C L H 3< S+ 0 0 1 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.697 117.9 32.4 -63.1 -21.8 0.8 23.3 -55.7 768 685 C D H << S+ 0 0 39 -4,-1.2 -2,-0.2 -3,-1.0 -1,-0.2 0.702 127.1 37.4-104.5 -31.1 -3.0 22.5 -55.7 769 686 C D H < S- 0 0 60 -4,-2.6 -3,-0.2 2,-0.3 -2,-0.2 0.677 84.2-140.7 -95.9 -20.9 -4.5 25.9 -56.0 770 687 C G S < S+ 0 0 0 -4,-2.4 12,-4.5 -5,-0.3 13,-0.9 0.655 81.8 93.5 59.5 14.1 -2.0 27.5 -58.4 771 688 C R E -U 781 0J 113 -6,-0.4 2,-0.3 10,-0.2 -2,-0.3 -0.978 55.2-175.6-138.6 145.5 -2.9 30.3 -55.9 772 689 C L E -U 780 0J 2 8,-1.8 8,-3.2 -2,-0.3 2,-0.5 -0.953 20.4-135.4-134.9 154.9 -1.5 31.6 -52.6 773 690 C T E -U 779 0J 68 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.967 22.1-154.3-114.9 121.2 -2.9 34.3 -50.3 774 691 C D > - 0 0 7 4,-1.9 3,-1.2 -2,-0.5 -53,-0.2 -0.046 36.6 -86.5 -79.0-173.6 -0.4 36.8 -49.0 775 692 C S T 3 S+ 0 0 27 -55,-0.8 -54,-0.1 1,-0.3 -53,-0.0 0.955 127.3 52.5 -58.4 -54.0 -0.5 38.8 -45.8 776 693 C H T 3 S- 0 0 48 -47,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.307 118.2-112.5 -71.5 10.7 -2.5 41.7 -47.3 777 694 C G S < S+ 0 0 42 -3,-1.2 2,-0.3 1,-0.3 -1,-0.1 0.402 70.8 142.4 76.1 -3.1 -5.0 39.1 -48.5 778 695 C R - 0 0 89 -5,-0.1 -4,-1.9 1,-0.1 2,-0.4 -0.578 51.0-128.0 -71.7 127.6 -4.2 39.7 -52.2 779 696 C T E -U 773 0J 100 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.642 18.5-148.0 -86.6 131.5 -4.2 36.3 -54.0 780 697 C V E -U 772 0J 2 -8,-3.2 -8,-1.8 -2,-0.4 2,-0.6 -0.828 9.7-132.8-106.8 134.4 -1.2 35.5 -56.0 781 698 C D E +U 771 0J 51 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.2 -0.750 30.5 165.4 -96.8 120.4 -1.4 33.4 -59.2 782 699 C F > + 0 0 0 -12,-4.5 3,-2.3 -2,-0.6 -111,-0.3 0.324 47.8 107.8-110.3 3.3 1.1 30.6 -59.8 783 700 C R T 3 S+ 0 0 91 -13,-0.9 -112,-0.3 1,-0.3 -114,-0.2 0.611 84.4 46.6 -62.3 -11.0 -0.8 28.9 -62.6 784 701 C N T 3 S+ 0 0 37 -41,-0.4 -39,-0.7 -3,-0.2 -1,-0.3 0.183 94.3 93.9-117.4 16.2 1.9 30.1 -64.9 785 702 C T E < - 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