==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM-BINDING PROTEIN 02-JUN-96 1NCZ . COMPND 2 MOLECULE: TROPONIN C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR M.SUNDARALINGAM,S.T.RAO . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9893.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 71.6 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 . 8 4.9 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 54.3 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 1 0 1 1 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 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 . 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 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 1 A A 0 0 96 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 122.3 1.2 19.2 2.5 2 2 A S > - 0 0 59 1,-0.1 4,-3.1 4,-0.0 5,-0.2 -0.243 360.0 -95.3 -77.1-178.0 2.9 17.1 5.3 3 3 A M H > S+ 0 0 50 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.906 129.0 50.7 -73.0 -36.1 4.7 18.7 8.2 4 4 A T H > S+ 0 0 98 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.892 113.3 47.2 -63.6 -35.4 8.1 18.4 6.4 5 5 A D H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.963 113.0 47.2 -66.1 -50.5 6.4 20.0 3.4 6 6 A Q H X S+ 0 0 50 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.859 111.2 53.5 -57.8 -37.6 4.9 22.7 5.7 7 7 A Q H X S+ 0 0 35 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.912 108.3 47.6 -66.1 -42.8 8.3 23.1 7.3 8 8 A A H X S+ 0 0 61 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.890 113.5 49.2 -66.7 -36.3 10.0 23.7 3.9 9 9 A E H X S+ 0 0 124 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.919 109.3 51.7 -71.1 -38.1 7.3 26.2 3.0 10 10 A A H X S+ 0 0 3 -4,-2.6 4,-0.7 1,-0.2 -2,-0.2 0.912 111.8 47.3 -64.0 -40.5 7.7 28.0 6.4 11 11 A R H >< S+ 0 0 82 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.890 109.5 53.4 -67.2 -38.4 11.4 28.3 5.7 12 12 A A H 3< S+ 0 0 87 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.747 103.2 59.2 -65.1 -28.4 10.8 29.5 2.2 13 13 A F H 3< S+ 0 0 108 -4,-1.4 2,-0.3 -3,-0.2 -1,-0.2 0.735 103.1 59.8 -69.7 -28.2 8.5 32.2 3.5 14 14 A L S << S- 0 0 20 -3,-0.8 2,-0.2 -4,-0.7 69,-0.0 -0.709 84.1-114.7-107.3 153.8 11.2 33.8 5.7 15 15 A S > - 0 0 48 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.566 34.6-114.5 -78.0 158.2 14.6 35.3 5.0 16 16 A E H > S+ 0 0 118 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.883 114.6 55.1 -64.1 -36.7 17.5 33.4 6.4 17 17 A E H > S+ 0 0 140 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.885 107.7 50.3 -65.9 -32.1 18.5 36.2 8.8 18 18 A M H > S+ 0 0 72 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.916 109.0 51.5 -71.6 -37.7 15.0 36.2 10.3 19 19 A I H X S+ 0 0 6 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.950 112.3 46.9 -61.0 -46.6 15.1 32.5 10.7 20 20 A A H X S+ 0 0 53 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.902 110.5 51.8 -61.0 -42.2 18.4 32.9 12.5 21 21 A E H X S+ 0 0 106 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.929 111.1 48.4 -59.9 -43.5 17.1 35.7 14.7 22 22 A F H X S+ 0 0 6 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.900 109.6 51.9 -64.6 -39.1 14.1 33.5 15.6 23 23 A K H X S+ 0 0 71 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.847 102.8 60.0 -69.3 -30.0 16.4 30.6 16.5 24 24 A A H X S+ 0 0 66 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.932 111.0 39.7 -62.9 -42.8 18.5 32.9 18.7 25 25 A A H >X S+ 0 0 15 -4,-1.5 3,-0.6 2,-0.2 4,-0.5 0.929 115.1 53.3 -70.1 -42.9 15.5 33.6 20.9 26 26 A F H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.2 4,-0.3 0.937 105.2 54.4 -56.0 -49.5 14.3 30.0 20.7 27 27 A D H >X S+ 0 0 64 -4,-3.1 3,-1.4 1,-0.3 4,-1.2 0.779 92.7 70.7 -61.0 -23.8 17.8 28.7 21.8 28 28 A M H << S+ 0 0 126 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.761 106.7 39.7 -63.6 -21.6 17.6 30.9 25.0 29 29 A F T << S+ 0 0 53 -3,-1.9 9,-0.5 -4,-0.5 -1,-0.3 0.338 105.4 67.4-107.9 1.5 14.9 28.4 26.2 30 30 A D T <4 + 0 0 17 -3,-1.4 2,-2.1 -4,-0.3 -2,-0.2 0.941 56.8 157.9 -82.3 -71.3 16.5 25.3 24.9 31 31 A A S < S+ 0 0 103 -4,-1.2 -1,-0.1 1,-0.2 6,-0.1 -0.185 70.5 64.1 82.3 -45.7 19.6 25.1 27.2 32 32 A D S S- 0 0 140 -2,-2.1 -1,-0.2 4,-0.2 5,-0.1 0.476 103.4-134.4 -84.1 -9.1 20.0 21.5 26.7 33 33 A G + 0 0 64 -6,-0.2 4,-0.1 1,-0.1 -2,-0.1 0.814 61.5 136.6 58.8 33.0 20.7 22.3 23.0 34 34 A G S S- 0 0 48 2,-0.4 -1,-0.1 -4,-0.1 3,-0.1 0.593 78.3-108.7 -81.7 -14.9 18.3 19.5 21.9 35 35 A G S S+ 0 0 23 1,-0.3 40,-1.8 39,-0.1 2,-0.3 0.592 90.8 88.4 91.6 18.4 16.9 21.7 19.2 36 36 A D E -A 74 0A 55 38,-0.2 -2,-0.4 39,-0.1 -1,-0.3 -0.980 56.4-156.4-147.1 158.6 13.6 22.0 21.2 37 37 A I E -A 73 0A 2 36,-1.9 36,-2.1 -2,-0.3 2,-0.1 -0.812 40.4 -83.1-126.1 162.2 12.0 23.9 24.0 38 38 A S E > -A 72 0A 48 -9,-0.5 3,-1.8 -2,-0.3 4,-0.4 -0.467 30.7-128.9 -65.4 142.0 9.2 23.1 26.4 39 39 A T G > S+ 0 0 5 32,-2.3 3,-1.0 1,-0.3 4,-0.5 0.794 109.6 68.9 -62.5 -22.6 5.7 23.6 25.0 40 40 A K G 3 S+ 0 0 157 31,-0.4 4,-0.3 1,-0.2 -1,-0.3 0.766 101.0 45.2 -64.2 -25.5 5.2 25.6 28.2 41 41 A E G <> S+ 0 0 72 -3,-1.8 4,-2.4 1,-0.1 -1,-0.2 0.477 85.0 95.2 -97.6 -1.1 7.5 28.3 26.8 42 42 A L H <> S+ 0 0 0 -3,-1.0 4,-2.6 -4,-0.4 5,-0.2 0.911 85.1 48.9 -57.6 -47.3 6.1 28.4 23.3 43 43 A G H > S+ 0 0 7 -4,-0.5 4,-2.7 1,-0.2 5,-0.2 0.937 110.5 51.8 -57.8 -45.4 3.8 31.4 24.1 44 44 A T H > S+ 0 0 57 -4,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.925 111.8 44.5 -61.6 -48.6 6.7 33.3 25.6 45 45 A V H X S+ 0 0 0 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.922 113.6 51.0 -66.7 -40.5 9.1 32.9 22.6 46 46 A M H <>S+ 0 0 0 -4,-2.6 5,-2.7 -5,-0.2 3,-0.3 0.925 112.6 46.3 -60.8 -40.8 6.3 33.7 20.1 47 47 A R H ><5S+ 0 0 105 -4,-2.7 3,-1.7 1,-0.2 -1,-0.2 0.883 107.3 56.1 -70.1 -37.0 5.4 36.9 22.0 48 48 A M H 3<5S+ 0 0 98 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.803 107.5 52.6 -60.9 -27.3 9.1 37.9 22.3 49 49 A L T 3<5S- 0 0 26 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 -0.032 127.8 -98.8 -99.4 26.6 9.1 37.6 18.5 50 50 A G T < 5S+ 0 0 58 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.550 80.9 128.8 73.4 10.0 6.1 39.9 18.1 51 51 A Q < - 0 0 22 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.685 42.5-157.8 -95.6 159.4 3.4 37.3 17.6 52 52 A N + 0 0 96 -2,-0.3 2,-0.1 33,-0.2 -9,-0.0 -0.606 16.3 174.1-136.1 68.6 0.2 37.3 19.6 53 53 A P - 0 0 9 0, 0.0 2,-0.1 0, 0.0 -6,-0.0 -0.463 33.0-120.4 -67.1 148.2 -1.5 33.8 19.7 54 54 A T > - 0 0 70 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.488 27.5-107.2 -80.4 168.3 -4.5 33.6 21.9 55 55 A K H > S+ 0 0 143 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.914 124.1 52.5 -63.5 -38.7 -4.3 31.0 24.7 56 56 A E H > S+ 0 0 129 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.919 108.4 50.6 -61.1 -43.0 -6.8 28.8 22.8 57 57 A E H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.912 110.5 49.1 -60.6 -42.8 -4.5 29.1 19.7 58 58 A L H X S+ 0 0 12 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.930 109.9 50.9 -64.7 -45.0 -1.5 28.1 21.8 59 59 A D H X S+ 0 0 86 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.929 110.8 50.3 -60.1 -39.6 -3.4 25.1 23.3 60 60 A A H X S+ 0 0 42 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.908 112.9 44.4 -62.7 -46.3 -4.3 24.0 19.7 61 61 A I H X S+ 0 0 13 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.933 112.6 52.6 -62.5 -46.9 -0.7 24.2 18.5 62 62 A I H X S+ 0 0 32 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.931 110.9 46.6 -57.7 -46.0 0.6 22.5 21.6 63 63 A E H < S+ 0 0 124 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.843 111.6 52.9 -67.6 -31.8 -1.9 19.6 21.0 64 64 A E H < S+ 0 0 80 -4,-1.8 3,-0.4 -5,-0.2 -2,-0.2 0.889 118.3 33.5 -70.1 -40.7 -0.9 19.5 17.4 65 65 A V H < S+ 0 0 19 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.743 114.2 58.2 -91.3 -17.0 2.9 19.2 18.0 66 66 A D >< + 0 0 32 -4,-2.4 3,-1.9 -5,-0.3 -1,-0.2 -0.008 56.0 126.4-107.0 39.6 2.8 17.2 21.2 67 67 A E T 3 S+ 0 0 168 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.791 75.3 55.9 -68.4 -21.3 0.9 14.0 20.4 68 68 A D T 3 S- 0 0 130 -3,-0.4 -1,-0.3 1,-0.0 -2,-0.1 0.440 110.1-120.3 -86.3 0.8 3.8 11.8 21.7 69 69 A G S < S+ 0 0 63 -3,-1.9 -2,-0.1 1,-0.1 -3,-0.1 0.703 71.9 132.1 75.5 18.4 3.7 13.5 25.2 70 70 A S - 0 0 64 2,-0.2 3,-0.1 1,-0.1 -1,-0.1 0.705 62.4-136.8 -74.4 -19.0 7.3 14.7 25.0 71 71 A G + 0 0 24 1,-0.3 -32,-2.3 -5,-0.2 -31,-0.4 0.709 67.2 101.2 71.5 20.6 6.2 18.2 26.2 72 72 A T E -A 38 0A 37 -34,-0.3 2,-0.4 -33,-0.1 -1,-0.3 -0.854 57.0-151.1-132.8 167.7 8.5 19.9 23.6 73 73 A I E -A 37 0A 0 -36,-2.1 -36,-1.9 -2,-0.3 2,-0.2 -0.995 22.0-135.5-135.4 135.5 8.3 21.5 20.2 74 74 A D E > -A 36 0A 57 -2,-0.4 4,-2.3 -38,-0.2 -38,-0.2 -0.508 26.5-105.0 -89.8 171.5 11.3 21.5 17.9 75 75 A F H > S+ 0 0 9 -40,-1.8 4,-2.6 1,-0.2 5,-0.1 0.878 116.7 53.6 -64.1 -37.8 12.6 24.5 15.9 76 76 A E H > S+ 0 0 51 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.925 112.5 43.6 -64.5 -41.7 11.2 23.3 12.5 77 77 A E H > S+ 0 0 45 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.885 110.4 58.2 -66.2 -38.7 7.7 23.0 13.9 78 78 A F H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.941 104.6 50.0 -56.8 -48.9 8.2 26.2 15.7 79 79 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.883 108.3 52.5 -60.3 -39.3 8.8 27.9 12.4 80 80 A V H X S+ 0 0 5 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.943 112.5 46.2 -61.2 -44.4 5.6 26.4 10.9 81 81 A M H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.910 110.9 51.8 -64.7 -41.9 3.7 27.8 13.8 82 82 A M H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.930 110.6 48.0 -60.0 -45.6 5.3 31.2 13.6 83 83 A V H X S+ 0 0 7 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.903 111.0 51.3 -64.9 -40.6 4.5 31.6 9.9 84 84 A R H X S+ 0 0 91 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.955 113.4 45.2 -61.3 -44.8 0.9 30.5 10.6 85 85 A Q H X S+ 0 0 5 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.861 111.5 52.6 -66.3 -36.4 0.7 33.2 13.3 86 86 A M H X S+ 0 0 28 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.918 110.5 47.1 -64.3 -43.4 2.3 35.8 11.1 87 87 A K H X S+ 0 0 111 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.913 114.8 47.3 -63.7 -43.6 -0.1 35.3 8.3 88 88 A E H X S+ 0 0 90 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.947 115.0 44.5 -62.8 -49.3 -3.0 35.4 10.7 89 89 A D H X S+ 0 0 30 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.941 112.6 51.7 -64.1 -46.2 -1.8 38.5 12.5 90 90 A A H X S+ 0 0 62 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.910 109.4 51.0 -54.7 -43.7 -0.9 40.3 9.2 91 91 A K H X S+ 0 0 112 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.871 109.6 49.8 -62.0 -39.1 -4.4 39.5 7.8 92 92 A G H X S+ 0 0 29 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.867 110.6 49.4 -70.6 -37.4 -6.1 40.9 10.9 93 93 A K H X S+ 0 0 133 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.915 110.5 50.7 -69.6 -41.1 -4.0 44.1 10.7 94 94 A S H X S+ 0 0 46 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.934 110.2 49.6 -62.1 -45.7 -4.9 44.6 7.0 95 95 A E H X S+ 0 0 101 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.928 112.2 48.9 -58.3 -45.2 -8.6 44.1 7.8 96 96 A E H X S+ 0 0 122 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.933 111.7 48.3 -58.7 -50.6 -8.3 46.7 10.6 97 97 A E H X S+ 0 0 105 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.873 109.3 51.9 -63.1 -37.1 -6.5 49.2 8.4 98 98 A L H X S+ 0 0 24 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.894 107.9 52.8 -68.3 -34.6 -9.0 48.8 5.5 99 99 A A H X S+ 0 0 24 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.924 111.7 46.1 -64.7 -40.6 -11.9 49.5 8.0 100 100 A N H X S+ 0 0 60 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.933 110.0 53.3 -68.1 -41.9 -10.1 52.7 9.1 101 101 A C H X S+ 0 0 40 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.913 108.2 53.2 -57.8 -40.4 -9.4 53.7 5.4 102 102 A F H X S+ 0 0 13 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.928 107.0 47.7 -65.8 -46.6 -13.1 53.3 4.8 103 103 A R H < S+ 0 0 169 -4,-1.9 6,-0.3 1,-0.2 -1,-0.2 0.830 114.0 49.1 -68.1 -25.6 -14.3 55.6 7.6 104 104 A I H < S+ 0 0 127 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.938 112.2 47.5 -73.3 -45.6 -11.8 58.2 6.5 105 105 A F H < S+ 0 0 20 -4,-2.8 2,-2.0 1,-0.3 -2,-0.2 0.873 102.7 67.4 -58.1 -41.8 -12.9 57.9 2.8 106 106 A D >< + 0 0 6 -4,-2.5 3,-2.2 -5,-0.2 -1,-0.3 -0.497 68.5 174.5 -87.2 79.5 -16.5 58.2 3.9 107 107 A K T 3 S+ 0 0 86 -2,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.757 76.6 44.0 -55.8 -36.5 -16.3 61.8 5.1 108 108 A N T 3 S- 0 0 91 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.280 103.2-133.0 -96.3 8.5 -19.9 62.2 5.9 109 109 A A < + 0 0 82 -3,-2.2 -2,-0.1 -6,-0.3 4,-0.1 0.730 60.5 137.8 47.2 42.0 -20.0 58.8 7.6 110 110 A D S S- 0 0 77 2,-0.4 -1,-0.2 1,-0.0 3,-0.1 0.367 80.1-102.0 -95.7 8.0 -23.2 57.6 6.0 111 111 A G S S+ 0 0 34 1,-0.2 40,-0.6 -5,-0.2 2,-0.3 0.525 94.0 82.0 86.5 10.2 -21.7 54.1 5.4 112 112 A F E -B 150 0B 53 38,-0.2 2,-0.6 -9,-0.1 -2,-0.4 -0.984 68.6-135.7-144.5 153.1 -20.9 54.7 1.7 113 113 A I E -B 149 0B 0 36,-2.7 36,-2.8 -2,-0.3 2,-0.1 -0.950 30.5-164.5-104.8 116.3 -18.2 56.3 -0.5 114 114 A D E > -B 148 0B 39 -2,-0.6 4,-2.9 34,-0.2 3,-0.3 -0.501 38.0 -94.1 -92.1 174.9 -20.1 58.2 -3.2 115 115 A I H > S+ 0 0 57 32,-0.6 4,-3.0 1,-0.2 5,-0.2 0.833 126.4 54.4 -63.2 -28.6 -18.3 59.5 -6.5 116 116 A E H > S+ 0 0 137 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.913 112.7 41.1 -69.3 -38.2 -17.7 62.9 -4.8 117 117 A E H > S+ 0 0 10 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.933 118.0 47.9 -70.6 -41.6 -16.0 61.3 -1.8 118 118 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.954 113.6 48.5 -60.1 -48.9 -14.2 58.9 -4.2 119 119 A G H X S+ 0 0 1 -4,-3.0 4,-2.7 -5,-0.2 5,-0.3 0.909 110.8 49.3 -57.4 -47.8 -13.2 61.8 -6.5 120 120 A E H X S+ 0 0 119 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.921 113.1 46.5 -64.9 -41.0 -11.9 64.0 -3.6 121 121 A I H X S+ 0 0 45 -4,-2.4 4,-0.6 1,-0.2 -2,-0.2 0.941 114.6 46.5 -67.9 -43.7 -9.8 61.3 -2.1 122 122 A L H >< S+ 0 0 35 -4,-2.6 3,-0.9 -5,-0.2 5,-0.5 0.901 114.2 46.9 -67.4 -40.1 -8.3 60.2 -5.5 123 123 A R H >< S+ 0 0 116 -4,-2.7 3,-2.4 1,-0.2 -1,-0.2 0.911 103.2 64.5 -65.3 -36.5 -7.6 63.8 -6.5 124 124 A A H 3< S+ 0 0 84 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.667 87.7 71.7 -59.7 -18.2 -6.0 64.5 -3.1 125 125 A T T << S- 0 0 85 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.662 106.6-122.8 -70.7 -21.3 -3.3 62.0 -3.9 126 126 A G < + 0 0 56 -3,-2.4 -2,-0.1 1,-0.3 -3,-0.1 0.328 66.5 138.3 91.4 -9.8 -1.7 64.4 -6.5 127 127 A E - 0 0 141 -5,-0.5 2,-2.2 1,-0.1 -1,-0.3 -0.364 68.7-111.4 -62.9 149.8 -2.1 61.8 -9.2 128 128 A H + 0 0 180 -3,-0.1 2,-0.4 -2,-0.0 -1,-0.1 -0.492 56.3 165.0 -85.0 75.8 -3.3 63.1 -12.5 129 129 A V - 0 0 36 -2,-2.2 2,-0.2 -7,-0.1 -3,-0.0 -0.758 24.1-149.5 -90.3 135.6 -6.6 61.4 -12.2 130 130 A T > - 0 0 66 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.592 28.7-108.9 -95.2 169.8 -9.4 62.6 -14.6 131 131 A E H > S+ 0 0 74 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.886 121.7 57.0 -66.6 -33.2 -13.1 62.5 -13.8 132 132 A E H > S+ 0 0 129 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.909 105.2 50.3 -64.0 -40.8 -13.4 59.7 -16.3 133 133 A D H > S+ 0 0 70 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 112.3 47.1 -61.8 -43.3 -10.8 57.7 -14.4 134 134 A I H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.928 112.8 49.2 -64.7 -42.5 -12.7 58.3 -11.2 135 135 A E H X S+ 0 0 90 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.920 110.2 51.9 -63.3 -40.9 -16.0 57.4 -12.9 136 136 A D H X S+ 0 0 72 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.915 109.4 48.4 -62.9 -41.8 -14.3 54.2 -14.2 137 137 A L H X S+ 0 0 60 -4,-2.5 4,-1.8 2,-0.2 5,-0.2 0.936 113.8 47.9 -65.9 -41.8 -13.2 53.1 -10.8 138 138 A M H X S+ 0 0 11 -4,-2.6 4,-2.2 2,-0.2 3,-0.4 0.963 112.8 47.7 -61.5 -48.7 -16.7 53.8 -9.4 139 139 A K H < S+ 0 0 129 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.929 113.8 47.3 -59.0 -49.4 -18.4 51.9 -12.2 140 140 A D H < S+ 0 0 115 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.793 117.5 41.4 -67.6 -24.1 -16.1 49.0 -11.9 141 141 A S H < S+ 0 0 10 -4,-1.8 2,-1.9 -3,-0.4 -1,-0.2 0.683 91.0 91.1 -96.4 -16.3 -16.4 48.7 -8.0 142 142 A D >< + 0 0 10 -4,-2.2 3,-1.0 -5,-0.2 -1,-0.1 -0.499 49.7 173.6 -88.0 91.7 -20.1 49.3 -7.7 143 143 A K T 3 S+ 0 0 123 -2,-1.9 -1,-0.2 1,-0.3 6,-0.1 0.799 75.8 39.6 -66.4 -36.5 -21.4 45.9 -7.8 144 144 A N T 3 S- 0 0 87 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.338 103.4-125.1-100.6 7.5 -25.0 46.6 -7.1 145 145 A N < + 0 0 136 -3,-1.0 -2,-0.1 -6,-0.1 -3,-0.0 0.793 68.7 130.7 53.8 42.0 -25.2 49.8 -9.2 146 146 A D S S- 0 0 48 2,-0.4 -1,-0.1 0, 0.0 3,-0.1 0.276 79.9-109.9-100.3 7.5 -26.5 52.1 -6.6 147 147 A G S S+ 0 0 38 1,-0.2 -32,-0.6 -5,-0.1 2,-0.3 0.470 87.4 79.1 79.5 4.8 -23.8 54.6 -7.5 148 148 A R E S-B 114 0B 102 -34,-0.2 2,-0.6 -33,-0.1 -2,-0.4 -0.899 73.6-120.4-142.0 164.9 -21.7 54.2 -4.3 149 149 A I E -B 113 0B 0 -36,-2.8 -36,-2.7 -2,-0.3 2,-0.1 -0.935 26.3-166.9-107.5 113.7 -19.3 52.0 -2.7 150 150 A D E > -B 112 0B 44 -2,-0.6 4,-2.7 -38,-0.2 5,-0.2 -0.443 43.9 -88.2 -88.9-179.7 -20.3 50.4 0.6 151 151 A F H > S+ 0 0 78 -40,-0.6 4,-2.8 1,-0.2 5,-0.2 0.898 126.6 51.1 -58.9 -44.7 -17.8 48.6 2.9 152 152 A D H > S+ 0 0 94 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.929 113.8 45.1 -57.9 -45.2 -18.1 45.2 1.3 153 153 A E H > S+ 0 0 4 2,-0.2 4,-3.3 1,-0.2 -1,-0.2 0.888 111.2 54.2 -67.4 -34.4 -17.6 46.7 -2.2 154 154 A F H X S+ 0 0 0 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.932 106.8 51.0 -65.7 -42.1 -14.6 48.7 -0.8 155 155 A L H X S+ 0 0 28 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.909 113.8 44.7 -62.5 -40.5 -13.0 45.6 0.5 156 156 A K H X S+ 0 0 55 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.966 113.2 50.6 -66.9 -45.4 -13.4 44.0 -2.9 157 157 A M H < S+ 0 0 37 -4,-3.3 3,-0.3 1,-0.2 -2,-0.2 0.950 117.7 38.9 -54.6 -49.4 -12.2 47.1 -4.7 158 158 A M H < S+ 0 0 88 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.942 115.9 47.8 -70.2 -51.0 -9.1 47.4 -2.5 159 159 A E H < S- 0 0 66 -4,-2.6 2,-3.0 -5,-0.3 3,-0.3 0.619 86.0-168.4 -70.5 -11.3 -8.2 43.7 -2.2 160 160 A G S < S+ 0 0 50 -4,-1.7 -1,-0.2 2,-0.4 -2,-0.1 -0.173 77.3 62.3 65.1 -63.7 -8.6 43.4 -5.9 161 161 A V 0 0 153 -2,-3.0 -1,-0.3 1,-0.2 -5,-0.1 0.881 360.0 360.0 -53.8 -42.0 -8.5 39.6 -6.3 162 162 A Q 0 0 121 -3,-0.3 -2,-0.4 -7,-0.2 -1,-0.2 -0.614 360.0 360.0 -67.7 360.0 -11.5 40.1 -4.1