==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 07-FEB-05 1WY6 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN ST1625; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS TOKODAII; . AUTHOR K.YONEDA,H.SAKURABA,H.TSUGE,N.KATUNUMA,S.KURAMITSU, . 159 2 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8535.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 130 81.8 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 . 6 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 0 1 2 0 2 1 3 1 0 0 0 0 0 0 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 . 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 7 A E > 0 0 157 0, 0.0 4,-2.2 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 140.2 6.8 50.8 -49.8 2 8 A I H > + 0 0 42 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.884 360.0 50.8 -54.9 -46.8 7.5 49.1 -46.4 3 9 A I H > S+ 0 0 85 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.829 108.8 51.9 -65.8 -32.0 11.0 50.6 -46.1 4 10 A R H > S+ 0 0 181 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.948 110.2 48.2 -67.8 -48.0 9.8 54.1 -46.8 5 11 A K H X S+ 0 0 94 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.870 111.8 51.2 -58.5 -37.1 7.2 53.8 -44.1 6 12 A L H X S+ 0 0 3 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.888 108.1 50.1 -68.6 -39.9 9.9 52.4 -41.8 7 13 A M H X S+ 0 0 76 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.834 110.0 52.9 -66.3 -30.5 12.2 55.4 -42.5 8 14 A D H X S+ 0 0 59 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.912 110.8 45.4 -69.1 -42.5 9.2 57.6 -41.7 9 15 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.917 109.7 57.2 -65.5 -42.6 8.7 55.8 -38.4 10 16 A K H X S+ 0 0 41 -4,-3.0 4,-2.9 1,-0.2 5,-0.3 0.928 104.3 50.3 -55.0 -51.6 12.5 56.1 -37.7 11 17 A K H X S+ 0 0 128 -4,-2.1 4,-1.8 1,-0.2 6,-0.2 0.906 109.3 51.1 -55.9 -45.5 12.6 59.9 -38.1 12 18 A F H <>S+ 0 0 61 -4,-1.5 5,-2.6 2,-0.2 4,-0.3 0.965 113.1 46.4 -54.8 -54.2 9.6 60.3 -35.7 13 19 A L H ><5S+ 0 0 0 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.922 109.9 50.9 -55.8 -51.1 11.4 58.1 -33.1 14 20 A L H 3<5S+ 0 0 52 -4,-2.9 35,-0.3 1,-0.3 -1,-0.2 0.843 112.7 50.6 -56.6 -31.6 14.8 59.8 -33.4 15 21 A D T 3<5S- 0 0 93 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.416 121.9-105.6 -87.3 -0.5 12.8 63.1 -32.9 16 22 A G T < 5S+ 0 0 28 -3,-1.9 2,-1.9 -4,-0.3 3,-0.2 0.475 81.3 129.9 91.5 -0.4 11.0 61.9 -29.8 17 23 A Y >< + 0 0 124 -5,-2.6 4,-2.3 -6,-0.2 5,-0.2 -0.528 28.3 162.8 -84.6 68.0 7.6 61.4 -31.5 18 24 A I H > + 0 0 11 -2,-1.9 4,-2.6 1,-0.2 5,-0.2 0.909 65.7 47.6 -57.2 -50.9 7.4 57.9 -29.9 19 25 A D H > S+ 0 0 112 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.908 113.1 49.9 -59.6 -44.1 3.7 57.3 -30.4 20 26 A E H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.963 114.5 42.3 -59.6 -55.2 3.7 58.4 -34.0 21 27 A G H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.865 114.8 51.4 -62.2 -36.4 6.7 56.2 -34.9 22 28 A V H X S+ 0 0 13 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.884 105.6 55.0 -68.2 -38.1 5.4 53.2 -33.0 23 29 A K H X S+ 0 0 141 -4,-2.3 4,-1.1 -5,-0.2 -1,-0.2 0.941 110.3 46.7 -59.3 -48.2 2.0 53.4 -34.6 24 30 A I H >X S+ 0 0 21 -4,-1.9 4,-1.9 1,-0.2 3,-0.6 0.928 111.5 51.6 -59.0 -47.8 3.7 53.2 -38.0 25 31 A V H 3X S+ 0 0 2 -4,-2.2 4,-2.2 1,-0.3 -2,-0.2 0.890 107.3 51.9 -58.5 -41.8 5.8 50.3 -36.8 26 32 A L H 3X S+ 0 0 55 -4,-2.7 4,-0.7 2,-0.2 -1,-0.3 0.747 105.2 57.3 -68.0 -23.2 2.8 48.4 -35.6 27 33 A E H XX S+ 0 0 89 -4,-1.1 4,-1.5 -3,-0.6 3,-1.2 0.964 108.6 44.7 -68.6 -52.4 1.2 48.9 -39.0 28 34 A I H 3X S+ 0 0 7 -4,-1.9 4,-2.6 1,-0.3 -2,-0.2 0.887 107.3 60.3 -56.3 -42.8 4.2 47.2 -40.7 29 35 A T H 3< S+ 0 0 20 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.757 107.0 47.0 -57.7 -26.8 4.1 44.5 -38.1 30 36 A K H << S+ 0 0 170 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.812 117.1 40.1 -85.6 -33.5 0.6 43.6 -39.2 31 37 A S H < S+ 0 0 89 -4,-1.5 -2,-0.2 -3,-0.2 2,-0.2 0.722 117.6 34.5 -90.4 -24.5 1.2 43.6 -42.9 32 38 A S S < S- 0 0 27 -4,-2.6 2,-0.3 -5,-0.2 4,-0.0 -0.606 80.4 -99.4-122.4-175.8 4.6 41.9 -43.2 33 39 A T >> - 0 0 90 -2,-0.2 4,-0.9 1,-0.1 3,-0.5 -0.744 29.8-110.3-109.4 156.7 6.6 39.1 -41.5 34 40 A K H >> S+ 0 0 67 1,-0.3 2,-3.4 -2,-0.3 4,-2.3 0.902 113.0 63.1 -42.4 -60.7 9.5 39.2 -38.9 35 41 A S H 34 S+ 0 0 114 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 -0.065 108.8 45.5 -63.8 41.5 12.1 38.1 -41.4 36 42 A E H <4 S+ 0 0 100 -2,-3.4 -1,-0.2 -3,-0.5 -2,-0.2 0.392 121.8 25.7-152.7 -33.3 11.5 41.3 -43.3 37 43 A Y H X< S+ 0 0 14 -3,-1.3 3,-1.6 -4,-0.9 4,-0.4 0.415 91.4 96.8-119.5 -3.1 11.3 44.2 -40.9 38 44 A N T >X S+ 0 0 11 -4,-2.3 3,-1.0 1,-0.3 4,-0.7 0.837 74.8 65.3 -55.5 -38.6 13.4 42.8 -38.1 39 45 A W H 3> S+ 0 0 90 1,-0.2 4,-2.0 -5,-0.2 -1,-0.3 0.734 85.9 76.9 -56.5 -27.1 16.5 44.7 -39.3 40 46 A F H <> S+ 0 0 0 -3,-1.6 4,-2.8 1,-0.2 -1,-0.2 0.879 88.7 52.5 -54.6 -45.6 14.8 47.9 -38.5 41 47 A I H <> S+ 0 0 0 -3,-1.0 4,-2.5 -4,-0.4 -1,-0.2 0.879 109.2 49.6 -61.6 -38.8 15.3 47.8 -34.7 42 48 A a H X S+ 0 0 20 -4,-0.7 4,-1.0 -3,-0.3 -1,-0.2 0.911 111.8 50.1 -64.1 -43.3 19.0 47.2 -35.1 43 49 A N H >X S+ 0 0 58 -4,-2.0 4,-0.6 2,-0.2 3,-0.6 0.929 111.5 47.2 -61.9 -48.0 19.2 50.2 -37.5 44 50 A L H >X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 3,-1.8 0.953 107.5 55.8 -59.4 -51.3 17.3 52.5 -35.1 45 51 A L H 3< S+ 0 0 3 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.724 94.4 70.4 -55.2 -25.1 19.4 51.5 -32.1 46 52 A E H << S+ 0 0 121 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.826 121.8 7.3 -64.0 -31.7 22.6 52.5 -34.0 47 53 A S H << S+ 0 0 68 -3,-1.8 -2,-0.2 -4,-0.6 -1,-0.2 0.537 89.1 125.2-130.8 -8.5 21.6 56.2 -33.8 48 54 A I < - 0 0 7 -4,-2.5 -34,-0.1 -5,-0.2 5,-0.1 -0.316 69.4-103.9 -61.4 134.2 18.6 56.8 -31.6 49 55 A D >> - 0 0 78 -35,-0.3 3,-2.3 1,-0.2 4,-2.0 -0.276 23.1-125.1 -55.5 136.5 19.2 59.3 -28.8 50 56 A b H 3> S+ 0 0 17 1,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.707 107.5 72.4 -58.8 -19.0 19.6 57.6 -25.4 51 57 A R H 34 S+ 0 0 162 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.751 114.0 22.1 -66.9 -23.8 16.8 59.8 -24.2 52 58 A Y H X> S+ 0 0 33 -3,-2.3 4,-2.2 2,-0.1 3,-0.8 0.661 94.6 94.1-116.1 -26.6 14.4 57.7 -26.2 53 59 A M H 3X S+ 0 0 2 -4,-2.0 4,-2.5 1,-0.3 5,-0.2 0.841 91.9 43.3 -37.2 -54.7 15.9 54.3 -26.8 54 60 A F H 3X S+ 0 0 22 -4,-0.5 4,-2.4 1,-0.2 -1,-0.3 0.835 109.9 55.2 -68.1 -32.7 14.3 52.6 -23.8 55 61 A Q H <> S+ 0 0 95 -3,-0.8 4,-1.1 2,-0.2 -1,-0.2 0.898 111.8 46.4 -64.3 -40.2 10.9 54.2 -24.3 56 62 A V H >X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 3,-0.7 0.953 112.4 48.5 -65.6 -50.5 11.0 52.7 -27.9 57 63 A L H 3X S+ 0 0 4 -4,-2.5 4,-2.1 1,-0.2 5,-0.4 0.856 106.2 57.7 -58.7 -38.9 12.2 49.3 -26.7 58 64 A D H 3< S+ 0 0 106 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.829 115.8 36.9 -61.0 -32.6 9.5 49.2 -24.0 59 65 A K H << S+ 0 0 102 -4,-1.1 -2,-0.2 -3,-0.7 -1,-0.2 0.900 137.7 8.9 -89.6 -42.2 6.8 49.6 -26.7 60 66 A I H >< S+ 0 0 0 -4,-2.9 3,-1.8 -5,-0.1 4,-0.3 0.431 92.0 101.4-122.7 1.3 8.1 47.6 -29.7 61 67 A G G >< S+ 0 0 11 -4,-2.1 3,-2.0 -5,-0.5 5,-0.2 0.895 79.0 62.6 -52.4 -43.0 11.2 45.7 -28.5 62 68 A S G 3 S+ 0 0 105 -5,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.642 92.3 64.9 -59.2 -18.8 9.1 42.5 -28.3 63 69 A Y G < S+ 0 0 79 -3,-1.8 -1,-0.3 2,-0.0 2,-0.3 0.535 100.5 60.3 -82.9 -6.1 8.3 42.5 -32.0 64 70 A F S < S- 0 0 12 -3,-2.0 2,-0.9 -4,-0.3 3,-0.1 -0.775 80.1-122.4-121.4 164.3 12.0 42.0 -33.0 65 71 A D > - 0 0 51 -2,-0.3 3,-1.7 1,-0.2 4,-0.2 -0.870 26.9-175.5-103.2 94.2 14.7 39.5 -32.5 66 72 A L G > S+ 0 0 29 -2,-0.9 3,-2.2 1,-0.3 -1,-0.2 0.787 76.4 72.5 -61.7 -28.2 17.4 41.6 -30.8 67 73 A D G 3 S+ 0 0 86 1,-0.3 -1,-0.3 -3,-0.1 5,-0.1 0.666 89.1 62.2 -62.4 -15.6 19.8 38.7 -30.9 68 74 A K G < S+ 0 0 114 -3,-1.7 -1,-0.3 -30,-0.1 2,-0.3 0.643 85.0 96.4 -84.2 -13.1 20.1 39.3 -34.6 69 75 A a < - 0 0 0 -3,-2.2 3,-0.3 -4,-0.2 -30,-0.0 -0.570 54.5-167.7 -79.5 137.6 21.5 42.8 -34.0 70 76 A Q S S+ 0 0 112 -2,-0.3 3,-0.2 1,-0.2 -1,-0.1 0.483 81.5 63.8-100.8 -8.0 25.3 43.1 -34.1 71 77 A N > + 0 0 26 1,-0.2 3,-2.4 2,-0.1 4,-0.3 -0.063 55.9 129.4-107.2 30.9 25.3 46.6 -32.6 72 78 A L T >> + 0 0 0 -3,-0.3 4,-1.4 1,-0.3 3,-0.8 0.563 56.6 81.9 -65.1 -4.3 23.8 45.8 -29.2 73 79 A K H 3> S+ 0 0 42 1,-0.2 4,-2.5 -3,-0.2 -1,-0.3 0.800 82.1 67.2 -67.1 -24.2 26.7 47.7 -27.7 74 80 A S H <> S+ 0 0 23 -3,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.832 98.2 49.8 -62.4 -34.5 24.5 50.7 -28.5 75 81 A V H <> S+ 0 0 2 -3,-0.8 4,-1.2 -4,-0.3 -1,-0.2 0.910 111.0 47.1 -72.9 -41.8 22.0 49.5 -25.9 76 82 A V H X S+ 0 0 2 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.893 107.7 58.7 -65.0 -39.8 24.6 49.1 -23.2 77 83 A E H X S+ 0 0 37 -4,-2.5 4,-3.0 1,-0.3 -1,-0.2 0.870 104.7 49.2 -56.7 -41.7 26.0 52.5 -24.1 78 84 A b H X S+ 0 0 2 -4,-1.3 4,-2.3 2,-0.2 6,-0.3 0.803 107.3 56.1 -70.0 -27.4 22.6 54.1 -23.3 79 85 A G H <>S+ 0 0 2 -4,-1.2 5,-2.9 2,-0.2 -2,-0.2 0.947 113.0 41.0 -66.5 -44.9 22.6 52.3 -20.1 80 86 A V H ><5S+ 0 0 19 -4,-2.4 3,-0.9 3,-0.2 -2,-0.2 0.915 116.4 47.4 -68.3 -45.1 25.9 53.9 -19.2 81 87 A I H 3<5S+ 0 0 111 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.928 118.5 41.5 -62.8 -44.1 25.1 57.4 -20.5 82 88 A N T 3<5S- 0 0 63 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.406 106.0-135.9 -81.1 2.9 21.7 57.2 -18.7 83 89 A N T < 5 + 0 0 71 -3,-0.9 2,-0.4 1,-0.2 -3,-0.2 0.865 65.0 126.3 41.7 41.4 23.7 55.7 -15.8 84 90 A T < - 0 0 56 -5,-2.9 2,-0.4 -6,-0.3 -2,-0.2 -0.992 52.2-153.1-134.4 136.5 20.8 53.3 -15.6 85 91 A L + 0 0 56 -2,-0.4 2,-0.3 -3,-0.1 36,-0.0 -0.860 30.1 152.5-104.3 138.7 20.6 49.5 -15.6 86 92 A N > - 0 0 36 -2,-0.4 4,-2.5 1,-0.0 5,-0.2 -0.934 59.5 -83.8-154.9 175.7 17.4 47.9 -17.0 87 93 A E H > S+ 0 0 110 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.810 124.9 54.3 -58.0 -33.6 16.1 44.7 -18.6 88 94 A H H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.945 110.0 46.5 -66.0 -48.4 17.1 46.0 -22.1 89 95 A V H > S+ 0 0 4 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.926 114.2 47.5 -59.3 -47.0 20.7 46.7 -21.0 90 96 A N H X S+ 0 0 62 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.937 111.6 48.7 -62.3 -48.1 21.0 43.3 -19.3 91 97 A K H X S+ 0 0 106 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.896 111.0 52.0 -58.5 -39.9 19.5 41.3 -22.2 92 98 A A H X S+ 0 0 4 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.883 110.0 49.5 -62.6 -40.3 21.9 43.2 -24.6 93 99 A L H X S+ 0 0 6 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.946 110.7 48.8 -63.3 -49.3 24.8 42.2 -22.3 94 100 A D H X S+ 0 0 76 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.899 113.0 48.1 -58.9 -42.3 23.7 38.6 -22.3 95 101 A I H X S+ 0 0 27 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.887 108.8 53.5 -66.6 -38.8 23.4 38.6 -26.1 96 102 A L H <>S+ 0 0 0 -4,-2.3 5,-2.5 2,-0.2 4,-0.5 0.921 110.6 47.2 -61.7 -41.9 26.9 40.3 -26.4 97 103 A V H ><5S+ 0 0 15 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.936 112.9 48.8 -62.4 -46.3 28.4 37.5 -24.3 98 104 A I H 3<5S+ 0 0 128 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.726 109.0 52.5 -66.2 -25.3 26.6 34.8 -26.3 99 105 A Q T 3<5S- 0 0 56 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.552 112.4-124.7 -85.9 -9.2 27.8 36.4 -29.6 100 106 A G T < 5 + 0 0 52 -3,-1.1 2,-1.9 -4,-0.5 3,-0.3 0.786 54.5 157.2 70.3 28.0 31.3 36.3 -28.2 101 107 A K >< + 0 0 38 -5,-2.5 4,-1.9 1,-0.2 3,-0.3 -0.446 3.0 153.8 -86.1 65.2 31.7 40.0 -28.7 102 108 A R H > + 0 0 83 -2,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.825 68.1 62.2 -59.4 -35.5 34.4 40.3 -26.0 103 109 A D H > S+ 0 0 80 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.915 104.4 45.2 -58.9 -47.7 35.8 43.3 -27.9 104 110 A K H > S+ 0 0 49 -3,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.926 112.4 51.4 -64.3 -45.5 32.5 45.3 -27.4 105 111 A L H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.868 110.2 49.7 -59.6 -38.1 32.3 44.3 -23.7 106 112 A E H X S+ 0 0 33 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.881 106.9 54.5 -69.4 -39.1 36.0 45.4 -23.1 107 113 A E H X S+ 0 0 65 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.944 110.1 46.6 -58.6 -47.8 35.3 48.8 -24.8 108 114 A I H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.924 110.4 55.5 -59.7 -43.0 32.4 49.4 -22.4 109 115 A G H X S+ 0 0 2 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.900 110.5 42.2 -57.0 -45.4 34.7 48.3 -19.5 110 116 A R H >< S+ 0 0 138 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.913 111.5 56.7 -67.8 -44.0 37.4 50.8 -20.3 111 117 A E H 3< S+ 0 0 91 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.857 105.3 49.6 -55.9 -41.9 34.9 53.6 -20.9 112 118 A I H 3< 0 0 5 -4,-2.2 5,-0.4 -5,-0.2 4,-0.3 0.683 360.0 360.0 -75.4 -14.8 33.3 53.3 -17.5 113 119 A L << 0 0 75 -3,-0.9 -2,-0.2 -4,-0.6 -3,-0.1 0.876 360.0 360.0 -98.8 360.0 36.7 53.4 -15.9 114 ! 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 0.0 115 122 A N 0 0 74 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 106.0 34.3 56.8 -13.5 116 123 A E + 0 0 169 -4,-0.3 -3,-0.1 2,-0.1 -4,-0.1 0.454 360.0 111.2-133.1 -14.3 30.8 58.1 -12.9 117 124 A V S S- 0 0 6 -5,-0.4 -37,-0.1 1,-0.1 -36,-0.0 -0.254 71.9-103.2 -65.7 153.6 28.6 55.0 -13.3 118 125 A S > - 0 0 39 1,-0.1 4,-1.8 -35,-0.1 5,-0.2 -0.194 31.5-104.7 -71.9 168.2 26.8 53.5 -10.3 119 126 A A H > S+ 0 0 15 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.875 118.0 60.0 -62.4 -38.8 28.1 50.3 -8.6 120 127 A S H > S+ 0 0 52 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.924 106.0 46.4 -56.6 -47.4 25.3 48.2 -10.2 121 128 A I H > S+ 0 0 4 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.931 111.1 51.6 -62.8 -45.2 26.5 49.1 -13.7 122 129 A L H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.908 112.7 47.8 -57.4 -40.6 30.1 48.3 -12.8 123 130 A V H X S+ 0 0 30 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.905 109.2 52.2 -67.2 -42.7 28.9 45.0 -11.4 124 131 A A H X S+ 0 0 17 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.958 115.4 40.2 -58.8 -53.6 26.8 44.2 -14.5 125 132 A I H X S+ 0 0 2 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.870 112.8 56.1 -64.5 -39.0 29.7 44.8 -16.9 126 133 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.941 110.7 43.6 -58.1 -49.7 32.3 43.1 -14.6 127 134 A N H X S+ 0 0 76 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.818 113.6 50.7 -67.9 -31.6 30.3 39.9 -14.5 128 135 A A H X S+ 0 0 7 -4,-1.7 4,-0.5 -5,-0.2 -2,-0.2 0.917 111.1 50.1 -71.1 -41.6 29.6 39.9 -18.3 129 136 A L H ><>S+ 0 0 0 -4,-2.9 3,-2.2 1,-0.2 5,-2.0 0.937 105.4 54.5 -60.6 -46.8 33.3 40.5 -18.9 130 137 A R H ><5S+ 0 0 67 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.845 102.6 60.7 -57.3 -30.3 34.3 37.5 -16.6 131 138 A R H 3<5S+ 0 0 140 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.670 105.3 46.6 -70.8 -18.0 31.9 35.5 -18.8 132 139 A V T <<5S- 0 0 28 -3,-2.2 -1,-0.2 -4,-0.5 -2,-0.2 0.281 127.0 -95.7-105.8 9.2 34.1 36.3 -21.9 133 140 A G T < 5S+ 0 0 45 -3,-1.1 2,-1.0 -4,-0.4 3,-0.2 0.570 84.7 128.6 91.7 10.5 37.4 35.5 -20.2 134 141 A D >< + 0 0 8 -5,-2.0 4,-2.1 1,-0.2 5,-0.1 -0.585 16.0 153.6-100.4 71.6 38.4 39.0 -19.1 135 142 A E H > + 0 0 98 -2,-1.0 4,-3.2 1,-0.2 5,-0.3 0.860 67.4 60.9 -65.0 -38.3 39.1 38.5 -15.4 136 143 A R H > S+ 0 0 209 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.936 114.0 32.9 -56.1 -53.0 41.6 41.4 -15.2 137 144 A D H > S+ 0 0 46 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.874 115.8 58.9 -73.3 -36.0 39.1 44.1 -16.2 138 145 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.951 110.8 42.5 -55.1 -49.8 36.3 42.2 -14.5 139 146 A T H X S+ 0 0 33 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.915 108.5 57.8 -62.7 -47.4 38.2 42.4 -11.2 140 147 A T H X S+ 0 0 66 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.881 110.4 45.7 -51.5 -41.1 39.2 46.0 -11.7 141 148 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.916 110.8 49.8 -70.3 -46.9 35.5 46.9 -12.0 142 149 A L H X S+ 0 0 3 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.837 109.7 54.1 -61.9 -31.5 34.4 44.9 -9.0 143 150 A I H X S+ 0 0 85 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.931 110.1 46.1 -66.9 -44.3 37.2 46.6 -7.0 144 151 A E H X S+ 0 0 42 -4,-1.7 4,-1.9 -5,-0.2 -2,-0.2 0.877 111.7 51.7 -64.5 -38.5 35.8 50.0 -8.1 145 152 A A H <>S+ 0 0 0 -4,-2.7 5,-3.0 2,-0.2 -1,-0.2 0.871 108.5 51.1 -65.5 -37.6 32.2 48.8 -7.2 146 153 A c H ><5S+ 0 0 36 -4,-2.0 3,-1.8 3,-0.2 -2,-0.2 0.926 109.0 51.7 -64.5 -43.0 33.5 47.8 -3.8 147 154 A K H 3<5S+ 0 0 168 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.874 105.2 55.3 -60.2 -38.4 35.0 51.2 -3.4 148 155 A K T 3<5S- 0 0 84 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.446 131.1 -96.3 -75.0 -0.2 31.7 52.8 -4.3 149 156 A G T < 5 + 0 0 45 -3,-1.8 2,-0.9 1,-0.2 -3,-0.2 0.582 69.3 154.9 98.2 12.1 30.2 50.8 -1.5 150 157 A E >< - 0 0 68 -5,-3.0 4,-1.9 1,-0.2 -1,-0.2 -0.643 26.9-161.4 -79.4 107.3 28.8 47.7 -3.2 151 158 A K H > S+ 0 0 158 -2,-0.9 4,-2.5 1,-0.2 3,-0.4 0.921 85.8 44.8 -49.9 -64.9 28.7 45.0 -0.6 152 159 A E H > S+ 0 0 141 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.826 112.1 56.1 -55.2 -32.3 28.5 41.8 -2.7 153 160 A A H > S+ 0 0 4 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.899 107.1 48.5 -66.7 -41.4 31.2 43.3 -4.9 154 161 A c H X S+ 0 0 31 -4,-1.9 4,-2.2 -3,-0.4 -2,-0.2 0.917 110.9 50.7 -64.3 -43.7 33.5 43.7 -1.9 155 162 A N H X S+ 0 0 106 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.866 111.5 48.5 -63.4 -33.4 32.7 40.1 -0.8 156 163 A A H >< S+ 0 0 31 -4,-2.0 3,-0.6 -5,-0.2 4,-0.4 0.893 109.0 52.2 -72.5 -40.6 33.6 38.9 -4.3 157 164 A V H >< S+ 0 0 26 -4,-2.4 3,-1.3 1,-0.2 -2,-0.2 0.894 106.2 55.9 -62.0 -37.5 36.8 40.9 -4.4 158 165 A N H 3< S+ 0 0 128 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.770 100.1 58.9 -67.4 -23.9 37.8 39.3 -1.1 159 166 A T T << 0 0 121 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.530 360.0 360.0 -82.4 -5.4 37.4 35.8 -2.5 160 167 A L < 0 0 112 -3,-1.3 -3,-0.0 -4,-0.4 0, 0.0 -0.575 360.0 360.0-118.5 360.0 40.0 36.4 -5.2