==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 20-APR-12 4ERR . COMPND 2 MOLECULE: AUTOTRANSPORTER ADHESIN; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO VULNIFICUS; . AUTHOR G.MINASOV,Z.WAWRZAK,B.GEISSLER,L.SHUVALOVA,I.DUBROVSKA,J.WIN . 165 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9723.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 130 78.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 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 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 1 1 0 0 0 0 0 0 0 0 2 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 3590 A G 0 0 101 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-158.1 16.3 30.8 20.3 2 3591 A Q + 0 0 114 2,-0.1 2,-0.4 73,-0.0 76,-0.1 0.892 360.0 48.7 -73.9 -42.4 16.9 27.2 21.4 3 3592 A I S S- 0 0 13 1,-0.1 69,-0.1 72,-0.1 6,-0.0 -0.846 99.9 -98.2-100.2 141.2 19.5 27.9 24.1 4 3593 A F - 0 0 12 -2,-0.4 2,-0.1 4,-0.1 -1,-0.1 -0.135 28.9-131.1 -47.2 139.5 18.9 30.5 26.8 5 3594 A T > - 0 0 49 -4,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.421 37.0 -99.7 -73.6 168.9 20.4 33.9 26.4 6 3595 A V H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.938 127.3 50.8 -57.7 -43.9 22.2 35.1 29.5 7 3596 A Q H > S+ 0 0 110 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.911 110.5 48.1 -61.3 -42.5 19.1 37.2 30.4 8 3597 A E H > S+ 0 0 80 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.890 110.9 51.6 -65.6 -40.0 16.7 34.2 29.9 9 3598 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.942 111.2 47.4 -58.7 -49.5 19.0 32.0 32.1 10 3599 A K H X S+ 0 0 77 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.894 111.4 50.3 -60.0 -41.6 18.9 34.7 34.8 11 3600 A E H X S+ 0 0 114 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.869 111.8 48.4 -69.5 -35.2 15.1 35.1 34.6 12 3601 A R H X S+ 0 0 90 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.935 110.1 51.3 -66.1 -44.4 14.6 31.2 34.8 13 3602 A A H X S+ 0 0 12 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.890 108.0 54.1 -58.2 -39.8 17.0 31.1 37.8 14 3603 A K H X S+ 0 0 126 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.908 103.8 54.5 -60.5 -45.7 14.9 33.9 39.5 15 3604 A V H < S+ 0 0 93 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.924 115.4 39.6 -56.2 -45.0 11.7 31.9 39.0 16 3605 A F H X S+ 0 0 46 -4,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.832 113.9 54.0 -74.3 -32.5 13.2 28.9 40.8 17 3606 A A H X S+ 0 0 41 -4,-2.4 4,-2.8 -5,-0.2 5,-0.2 0.782 90.5 79.2 -73.9 -24.6 15.1 31.1 43.4 18 3607 A K H X S+ 0 0 170 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.866 96.9 38.4 -55.4 -51.3 11.9 32.9 44.5 19 3608 A P H > S+ 0 0 66 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.850 114.6 55.6 -72.0 -30.3 10.4 30.2 46.8 20 3609 A I H X S+ 0 0 6 -4,-0.7 4,-2.5 1,-0.2 -2,-0.2 0.931 108.1 48.9 -65.4 -44.8 13.8 29.2 48.2 21 3610 A G H X S+ 0 0 26 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.873 107.1 54.8 -61.9 -38.2 14.4 32.8 49.2 22 3611 A A H X S+ 0 0 68 -4,-1.5 4,-1.4 -5,-0.2 -1,-0.2 0.931 110.9 46.0 -59.5 -47.2 11.1 33.1 50.9 23 3612 A S H X S+ 0 0 49 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.907 110.2 53.6 -61.8 -43.7 11.9 30.0 53.0 24 3613 A Y H X S+ 0 0 23 -4,-2.5 4,-2.2 1,-0.2 3,-0.5 0.916 103.4 56.6 -60.0 -41.7 15.4 31.3 53.8 25 3614 A Q H X S+ 0 0 93 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.875 103.1 54.9 -57.5 -38.9 13.9 34.6 55.1 26 3615 A G H X S+ 0 0 29 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.862 106.9 50.8 -63.1 -34.5 11.8 32.6 57.6 27 3616 A I H X S+ 0 0 2 -4,-1.4 4,-2.4 -3,-0.5 -2,-0.2 0.933 109.5 50.1 -65.6 -46.4 15.0 31.0 58.9 28 3617 A L H X S+ 0 0 5 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.917 110.2 50.5 -58.0 -43.8 16.6 34.4 59.3 29 3618 A D H X S+ 0 0 83 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.925 111.9 47.1 -62.2 -43.3 13.6 35.7 61.2 30 3619 A Q H X S+ 0 0 25 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.849 108.3 56.0 -68.2 -35.0 13.6 32.6 63.6 31 3620 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.928 105.6 50.7 -64.1 -42.5 17.4 33.0 64.1 32 3621 A D H X S+ 0 0 62 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.923 108.3 53.9 -58.5 -43.1 16.9 36.6 65.3 33 3622 A L H X S+ 0 0 89 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.909 105.6 53.1 -60.3 -41.6 14.2 35.3 67.7 34 3623 A V H >< S+ 0 0 4 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.934 111.4 44.9 -58.3 -47.1 16.6 32.8 69.2 35 3624 A H H 3< S+ 0 0 53 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.761 113.6 50.4 -70.8 -24.0 19.2 35.5 69.9 36 3625 A Q H 3< S+ 0 0 133 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.620 101.3 79.0 -87.8 -12.6 16.6 37.8 71.3 37 3626 A A << - 0 0 19 -4,-1.2 2,-0.3 -3,-0.5 3,-0.0 -0.489 60.0-162.6 -93.4 162.5 15.2 35.2 73.7 38 3627 A K >> - 0 0 156 -2,-0.2 3,-1.1 0, 0.0 4,-0.5 -0.957 51.2 -11.9-139.5 157.7 16.5 33.9 77.0 39 3628 A G H >> S- 0 0 50 -2,-0.3 4,-1.8 1,-0.2 3,-0.8 -0.194 127.2 -1.9 57.5-136.8 15.8 30.8 79.1 40 3629 A R H 3> S+ 0 0 207 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.815 134.0 57.1 -58.9 -33.0 12.8 28.5 78.2 41 3630 A D H <> S+ 0 0 118 -3,-1.1 4,-2.2 2,-0.2 -1,-0.3 0.861 105.8 49.3 -65.7 -37.9 11.8 30.9 75.4 42 3631 A Q H - 0 0 24 -2,-0.5 4,-2.5 81,-0.2 5,-0.2 -0.128 24.8-113.2 -64.1 161.2 19.6 26.4 44.1 64 3653 A G H > S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.931 120.2 52.2 -57.3 -42.3 17.5 28.3 41.6 65 3654 A R H > S+ 0 0 80 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.938 108.7 47.7 -59.3 -48.1 20.7 28.9 39.7 66 3655 A N H > S+ 0 0 7 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.882 110.0 53.1 -66.7 -38.4 21.7 25.2 39.6 67 3656 A Q H X S+ 0 0 72 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.918 111.5 45.7 -59.9 -44.8 18.2 24.2 38.5 68 3657 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.869 109.4 55.6 -66.4 -38.5 18.3 26.6 35.6 69 3658 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.861 102.7 55.8 -62.1 -36.1 21.9 25.4 34.7 70 3659 A T H X S+ 0 0 82 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.917 110.0 46.0 -63.0 -41.8 20.7 21.8 34.4 71 3660 A Q H X S+ 0 0 73 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.912 109.6 54.8 -67.3 -43.0 18.1 23.0 31.9 72 3661 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.920 104.7 54.5 -55.8 -44.0 20.7 25.1 30.0 73 3662 A K H X S+ 0 0 50 -4,-2.5 4,-3.4 1,-0.2 5,-0.3 0.970 106.1 50.7 -56.8 -53.7 22.9 22.0 29.6 74 3663 A E H X S+ 0 0 109 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.884 109.6 51.6 -52.1 -39.7 20.1 20.0 28.0 75 3664 A Q H X S+ 0 0 35 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.934 113.5 44.2 -62.8 -44.1 19.5 22.8 25.5 76 3665 A V H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.915 111.5 52.4 -65.8 -46.7 23.2 22.9 24.7 77 3666 A T H X S+ 0 0 20 -4,-3.4 4,-2.8 1,-0.2 -1,-0.2 0.881 112.8 46.1 -54.1 -42.6 23.5 19.1 24.4 78 3667 A S H < S+ 0 0 73 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.873 108.9 54.3 -70.8 -36.7 20.5 19.1 22.0 79 3668 A A H < S+ 0 0 53 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.792 119.3 35.4 -65.1 -28.0 22.0 22.0 20.0 80 3669 A L H < S- 0 0 51 -4,-1.6 -2,-0.2 1,-0.3 2,-0.2 0.852 114.1-114.7 -92.3 -41.1 25.2 19.9 19.5 81 3670 A G < 0 0 44 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.1 -0.615 360.0 360.0 121.5 175.4 23.8 16.4 19.3 82 3671 A L 0 0 201 -2,-0.2 -4,-0.1 -4,-0.1 -5,-0.0 -0.237 360.0 360.0-168.9 360.0 24.2 13.3 21.5 83 !* 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 84 3590 B G 0 0 109 0, 0.0 4,-0.1 0, 0.0 -49,-0.0 0.000 360.0 360.0 360.0 -91.7 27.1 32.3 71.6 85 3591 B Q + 0 0 108 2,-0.1 2,-0.4 73,-0.1 76,-0.1 0.587 360.0 65.1 -91.8 -9.2 27.7 28.8 70.2 86 3592 B I S S- 0 0 17 73,-0.1 69,-0.1 1,-0.0 70,-0.0 -0.900 91.5 -98.6-115.9 146.8 25.4 29.6 67.2 87 3593 B F - 0 0 16 -2,-0.4 2,-0.1 4,-0.1 -2,-0.1 -0.177 29.3-133.2 -52.9 142.3 25.7 32.1 64.3 88 3594 B T > - 0 0 49 1,-0.1 4,-2.7 -4,-0.1 5,-0.2 -0.428 36.0 -99.4 -78.0 168.9 23.9 35.5 64.4 89 3595 B V H > S+ 0 0 12 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.918 127.7 50.1 -54.1 -45.9 22.0 36.5 61.2 90 3596 B Q H > S+ 0 0 120 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.949 111.7 47.1 -59.1 -47.6 25.0 38.7 60.3 91 3597 B E H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.884 111.4 51.3 -61.6 -42.4 27.5 35.9 60.9 92 3598 B L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.931 111.2 47.4 -58.4 -48.6 25.4 33.5 58.9 93 3599 B K H X S+ 0 0 91 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.902 111.4 51.9 -60.5 -41.5 25.2 36.0 56.0 94 3600 B E H X S+ 0 0 116 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.924 111.8 45.9 -59.0 -46.9 29.0 36.5 56.2 95 3601 B R H X S+ 0 0 90 -4,-2.5 4,-1.9 1,-0.2 5,-0.2 0.914 109.9 53.2 -66.4 -44.0 29.7 32.8 56.1 96 3602 B A H X S+ 0 0 12 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.897 107.7 53.3 -54.8 -42.6 27.3 32.2 53.2 97 3603 B K H X S+ 0 0 140 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.894 105.6 52.2 -63.7 -41.5 29.2 35.0 51.3 98 3604 B V H < S+ 0 0 91 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.914 114.8 42.0 -59.2 -45.1 32.6 33.3 51.8 99 3605 B F H X S+ 0 0 47 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.847 113.4 54.2 -70.1 -35.1 31.3 30.0 50.4 100 3606 B A H X S+ 0 0 40 -4,-2.4 4,-2.9 -5,-0.2 5,-0.2 0.776 89.8 78.5 -70.7 -26.7 29.4 31.8 47.6 101 3607 B K H X S+ 0 0 145 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.893 97.1 39.1 -54.2 -54.2 32.4 33.7 46.3 102 3608 B P H > S+ 0 0 71 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.821 115.6 54.1 -67.7 -28.7 34.1 30.8 44.3 103 3609 B I H X S+ 0 0 7 -4,-0.7 4,-2.7 2,-0.2 -2,-0.2 0.934 107.6 50.1 -68.7 -44.7 30.8 29.6 43.1 104 3610 B G H X S+ 0 0 27 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.858 108.7 53.2 -60.4 -37.3 29.9 33.0 41.8 105 3611 B A H X S+ 0 0 67 -4,-1.8 4,-1.6 -5,-0.2 -1,-0.2 0.924 110.3 45.7 -64.0 -46.9 33.2 33.2 40.0 106 3612 B S H X S+ 0 0 38 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.919 112.0 53.5 -61.6 -41.4 32.6 29.8 38.2 107 3613 B Y H X S+ 0 0 21 -4,-2.7 4,-2.5 1,-0.2 3,-0.2 0.916 104.3 53.9 -59.9 -44.6 29.1 31.0 37.4 108 3614 B Q H X S+ 0 0 90 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.866 104.3 56.9 -57.6 -36.8 30.4 34.2 35.8 109 3615 B G H X S+ 0 0 28 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.894 107.7 47.1 -60.1 -41.5 32.6 32.0 33.6 110 3616 B I H X S+ 0 0 2 -4,-1.6 4,-2.6 -3,-0.2 -2,-0.2 0.933 111.6 50.8 -63.7 -47.0 29.5 30.2 32.4 111 3617 B L H X S+ 0 0 5 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.862 111.0 48.7 -59.1 -41.1 27.7 33.5 31.7 112 3618 B D H X S+ 0 0 87 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.908 112.4 47.7 -67.2 -40.7 30.6 34.8 29.7 113 3619 B Q H X S+ 0 0 28 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.874 108.3 55.3 -69.7 -34.8 30.9 31.7 27.6 114 3620 B L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.911 106.2 51.1 -63.2 -41.9 27.1 31.7 27.0 115 3621 B D H X S+ 0 0 63 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.920 108.1 53.0 -60.9 -40.9 27.5 35.3 25.6 116 3622 B L H X S+ 0 0 86 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.911 105.4 54.8 -59.3 -41.8 30.3 34.0 23.3 117 3623 B V H < S+ 0 0 1 -4,-2.3 3,-0.5 1,-0.2 -1,-0.2 0.946 112.5 42.3 -56.3 -48.0 28.0 31.2 22.1 118 3624 B H H < S+ 0 0 68 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.750 113.9 51.2 -74.7 -20.2 25.3 33.8 21.1 119 3625 B Q H < S+ 0 0 128 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.655 96.2 88.5 -88.5 -17.4 27.8 36.3 19.6 120 3626 B A < - 0 0 19 -4,-1.5 2,-0.3 -3,-0.5 3,-0.0 -0.452 62.8-152.1 -82.1 151.5 29.5 33.6 17.4 121 3627 B K > - 0 0 157 -2,-0.1 3,-1.3 4,-0.0 4,-0.3 -0.941 53.6 -31.0-122.2 149.4 28.4 32.7 13.9 122 3628 B G T >> S+ 0 0 50 -2,-0.3 4,-1.2 1,-0.2 3,-1.0 -0.138 129.3 7.9 50.0-127.4 28.7 29.3 12.1 123 3629 B R H 3> S+ 0 0 203 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.808 127.9 59.3 -56.2 -35.6 31.8 27.2 13.1 124 3630 B D H <> S+ 0 0 117 -3,-1.3 4,-2.1 1,-0.2 -1,-0.3 0.883 101.9 54.9 -62.5 -36.1 32.7 29.5 15.9 125 3631 B Q H <> S+ 0 0 78 -3,-1.0 4,-1.8 -4,-0.3 -1,-0.2 0.875 106.0 51.5 -66.5 -36.7 29.3 28.9 17.5 126 3632 B I H X S+ 0 0 76 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.959 111.1 46.2 -64.5 -51.3 29.8 25.1 17.6 127 3633 B A H X S+ 0 0 63 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.918 112.1 51.4 -57.9 -43.2 33.2 25.3 19.3 128 3634 B A H X S+ 0 0 14 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.854 106.9 54.7 -64.4 -35.1 31.9 27.8 21.8 129 3635 B S H X S+ 0 0 9 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.892 104.7 52.9 -68.9 -39.1 29.0 25.4 22.6 130 3636 B F H X S+ 0 0 121 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.923 111.4 46.5 -59.4 -42.5 31.3 22.5 23.4 131 3637 B E H X S+ 0 0 88 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.862 109.0 54.7 -72.2 -32.4 33.2 24.6 25.8 132 3638 B L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.941 107.3 51.2 -59.6 -47.6 30.1 25.9 27.4 133 3639 B N H X S+ 0 0 26 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.903 109.6 49.7 -59.0 -41.1 29.0 22.4 28.0 134 3640 B K H X S+ 0 0 106 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.925 109.9 50.7 -61.8 -45.3 32.3 21.6 29.7 135 3641 B K H X S+ 0 0 78 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.919 112.6 46.0 -60.5 -43.8 32.1 24.6 31.9 136 3642 B I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.950 112.9 50.7 -62.7 -48.4 28.5 23.7 33.0 137 3643 B N H X S+ 0 0 88 -4,-2.8 4,-1.3 -5,-0.2 -2,-0.2 0.879 112.8 45.9 -55.4 -44.7 29.6 20.0 33.6 138 3644 B D H X S+ 0 0 65 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.883 111.9 51.5 -68.1 -40.4 32.6 21.2 35.7 139 3645 B Y H X S+ 0 0 5 -4,-2.4 4,-3.2 -5,-0.2 -2,-0.2 0.931 107.4 51.5 -61.5 -48.3 30.5 23.6 37.7 140 3646 B I H < S+ 0 0 58 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.827 115.0 43.8 -63.7 -31.3 27.9 21.0 38.6 141 3647 B A H < S+ 0 0 83 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.889 121.3 39.2 -74.3 -40.2 30.6 18.6 39.8 142 3648 B E H < S+ 0 0 125 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.790 124.1 34.0 -81.1 -32.6 32.5 21.4 41.7 143 3649 B H < + 0 0 16 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.1 -0.491 61.0 145.3-130.1 63.0 29.6 23.4 43.2 144 3650 B P + 0 0 76 0, 0.0 2,-0.4 0, 0.0 -81,-0.2 0.748 69.0 50.5 -70.2 -23.0 26.7 21.1 44.1 145 3651 B T S S- 0 0 54 -3,-0.1 -83,-0.1 -83,-0.1 5,-0.0 -0.969 85.1-122.4-129.1 127.5 25.6 23.1 47.1 146 3652 B S > - 0 0 26 -2,-0.4 4,-2.6 -85,-0.2 5,-0.2 -0.108 26.9-111.7 -62.1 159.1 25.1 26.9 47.3 147 3653 B G H > S+ 0 0 4 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.927 120.4 51.7 -54.5 -46.7 27.0 29.1 49.7 148 3654 B R H > S+ 0 0 80 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.938 109.9 47.7 -55.7 -48.9 23.8 29.7 51.6 149 3655 B N H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.899 109.8 52.3 -66.1 -38.0 23.1 26.0 51.9 150 3656 B Q H X S+ 0 0 69 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.920 112.6 45.8 -60.4 -43.3 26.6 25.2 53.1 151 3657 B A H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.892 111.1 52.2 -67.9 -41.5 26.3 27.9 55.8 152 3658 B L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.847 105.0 56.0 -61.6 -36.1 22.8 26.6 56.8 153 3659 B T H X S+ 0 0 73 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.899 109.1 47.2 -63.4 -39.7 24.3 23.1 57.2 154 3660 B Q H X S+ 0 0 73 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.906 110.7 52.1 -67.6 -39.8 26.9 24.5 59.6 155 3661 B L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.909 106.6 53.2 -59.3 -46.7 24.1 26.4 61.5 156 3662 B K H X S+ 0 0 40 -4,-2.5 4,-3.3 1,-0.2 5,-0.2 0.928 108.0 50.6 -55.3 -44.5 22.1 23.2 61.8 157 3663 B E H X S+ 0 0 124 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.880 110.1 50.1 -63.6 -38.8 25.0 21.4 63.4 158 3664 B Q H X S+ 0 0 40 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.905 113.6 45.2 -64.0 -42.9 25.5 24.3 65.9 159 3665 B V H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.935 113.4 48.4 -69.2 -46.8 21.8 24.2 66.8 160 3666 B T H X>S+ 0 0 9 -4,-3.3 5,-2.5 2,-0.2 4,-0.7 0.914 113.5 48.9 -59.1 -42.7 21.7 20.4 67.2 161 3667 B S H ><5S+ 0 0 72 -4,-2.3 3,-0.8 -5,-0.2 -2,-0.2 0.924 110.4 50.6 -62.1 -43.8 24.9 20.6 69.3 162 3668 B A H 3<5S+ 0 0 55 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.843 115.9 41.8 -63.1 -34.0 23.4 23.3 71.5 163 3669 B L H 3<5S- 0 0 38 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.421 112.2-115.4 -94.4 -3.1 20.2 21.3 72.0 164 3670 B G T <<5 + 0 0 56 -3,-0.8 2,-0.2 -4,-0.7 -3,-0.2 0.778 68.9 138.4 72.9 27.8 22.0 17.9 72.5 165 3671 B L < 0 0 57 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.629 360.0 360.0 -98.2 158.8 20.4 16.4 69.4 166 3672 B E 0 0 211 -2,-0.2 -1,-0.1 -5,-0.0 -6,-0.0 0.108 360.0 360.0-116.3 360.0 22.2 14.1 66.9