==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 10-NOV-03 1RFJ . COMPND 2 MOLECULE: CALMODULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SOLANUM TUBEROSUM; . AUTHOR D.C.LIANG,C.H.YUN,W.R.CHANG . 148 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9791.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 108 73.0 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 . 5 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 . 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 . 10 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 52.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 1 1 1 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 . 1 1 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 . 1 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 0 A M 0 0 65 0, 0.0 2,-0.8 0, 0.0 74,-0.1 0.000 360.0 360.0 360.0 -54.6 5.8 -0.1 27.8 2 1 A A - 0 0 53 72,-0.1 3,-0.1 1,-0.0 76,-0.1 -0.815 360.0 -59.5 103.0-102.6 7.7 -3.3 27.8 3 2 A D S S+ 0 0 47 -2,-0.8 75,-0.0 1,-0.4 -1,-0.0 -0.047 98.9 61.3-144.8-109.7 6.2 -6.1 25.7 4 3 A Q - 0 0 181 1,-0.1 -1,-0.4 -2,-0.1 2,-0.3 0.034 68.1-144.7 -35.8 128.0 2.8 -7.8 25.8 5 4 A L - 0 0 21 -3,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.691 15.7-108.5-100.1 154.4 0.0 -5.3 25.2 6 5 A T > - 0 0 76 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.385 27.7-112.6 -78.6 159.7 -3.4 -5.4 26.8 7 6 A E H > S+ 0 0 170 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.903 117.8 50.6 -58.3 -43.1 -6.5 -6.3 24.9 8 7 A D H > S+ 0 0 111 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.893 108.8 51.2 -64.0 -40.4 -7.9 -2.7 25.1 9 8 A Q H > S+ 0 0 68 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.934 113.3 45.7 -61.5 -45.1 -4.6 -1.2 23.9 10 9 A I H X S+ 0 0 42 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.944 110.9 51.6 -62.3 -50.4 -4.7 -3.5 20.9 11 10 A S H X S+ 0 0 53 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.854 111.1 49.6 -55.9 -37.3 -8.4 -2.9 20.1 12 11 A E H >X S+ 0 0 107 -4,-2.0 4,-2.3 2,-0.2 3,-0.7 0.965 107.3 52.1 -68.0 -52.0 -7.7 0.8 20.2 13 12 A F H 3X S+ 0 0 32 -4,-2.5 4,-3.0 1,-0.3 -2,-0.2 0.848 107.5 55.7 -52.6 -33.3 -4.7 0.6 17.9 14 13 A K H 3X S+ 0 0 116 -4,-2.1 4,-2.1 2,-0.2 -1,-0.3 0.892 104.9 50.5 -67.0 -39.0 -7.0 -1.3 15.6 15 14 A E H X S+ 0 0 33 -4,-2.3 3,-2.6 1,-0.2 4,-1.3 0.974 110.3 50.3 -58.9 -58.8 -6.6 3.9 14.7 17 16 A F H 3X S+ 0 0 14 -4,-3.0 4,-2.7 1,-0.3 -1,-0.2 0.865 103.0 64.1 -47.6 -38.6 -5.2 1.7 12.0 18 17 A S H 3< S+ 0 0 76 -4,-2.1 -1,-0.3 1,-0.2 6,-0.2 0.755 99.5 52.3 -58.4 -27.7 -8.8 1.6 10.7 19 18 A L H << S+ 0 0 112 -3,-2.6 -1,-0.2 -4,-0.7 -2,-0.2 0.899 110.2 46.6 -75.9 -43.6 -8.6 5.3 10.0 20 19 A F H < S+ 0 0 51 -4,-1.3 2,-2.6 1,-0.2 -2,-0.2 0.903 98.9 72.7 -63.8 -42.4 -5.3 5.0 8.0 21 20 A D >< + 0 0 8 -4,-2.7 3,-3.2 1,-0.2 -1,-0.2 -0.382 67.1 176.8 -75.9 66.9 -6.8 2.1 6.0 22 21 A K T 3 S+ 0 0 127 -2,-2.6 -1,-0.2 1,-0.3 6,-0.1 0.750 78.5 38.9 -42.0 -42.4 -9.1 4.3 4.0 23 22 A D T 3 S- 0 0 92 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.202 104.8-131.1 -97.4 15.5 -10.5 1.5 1.8 24 23 A G < + 0 0 58 -3,-3.2 -2,-0.1 -6,-0.2 4,-0.1 0.721 63.0 136.1 42.1 35.8 -10.5 -0.9 4.7 25 24 A D S S- 0 0 92 2,-0.3 -1,-0.2 1,-0.0 3,-0.1 0.473 79.4-102.7 -88.0 1.3 -8.8 -3.7 2.9 26 25 A G S S+ 0 0 39 1,-0.2 40,-0.5 -5,-0.2 2,-0.3 0.442 93.3 80.4 95.7 0.2 -6.5 -4.4 5.9 27 26 A C S S- 0 0 22 38,-0.2 2,-0.5 39,-0.1 -2,-0.3 -0.998 70.1-129.6-142.3 145.4 -3.4 -2.7 4.7 28 27 A I B -A 64 0A 5 36,-3.0 36,-2.3 -2,-0.3 2,-0.2 -0.832 25.2-163.0 -97.7 125.3 -2.1 0.9 4.5 29 28 A T > - 0 0 32 -2,-0.5 4,-2.4 -9,-0.2 5,-0.2 -0.531 34.3-108.0 -98.8 167.7 -0.7 2.0 1.1 30 29 A T H > S+ 0 0 21 32,-0.3 4,-3.5 2,-0.2 5,-0.2 0.939 121.8 53.5 -59.1 -46.3 1.5 5.0 0.3 31 30 A K H > S+ 0 0 131 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.931 110.0 46.1 -54.0 -50.3 -1.5 6.7 -1.3 32 31 A E H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.871 113.5 50.1 -63.8 -35.0 -3.6 6.2 1.9 33 32 A L H X S+ 0 0 17 -4,-2.4 4,-3.4 2,-0.2 -2,-0.2 0.935 108.2 52.7 -67.9 -44.7 -0.7 7.4 4.0 34 33 A G H X S+ 0 0 7 -4,-3.5 4,-3.4 1,-0.2 5,-0.3 0.931 106.6 53.1 -54.3 -47.9 -0.3 10.5 1.8 35 34 A T H X S+ 0 0 73 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.932 113.7 43.0 -52.1 -49.9 -4.0 11.3 2.2 36 35 A V H X S+ 0 0 19 -4,-1.8 4,-0.6 2,-0.2 -2,-0.2 0.901 114.5 50.7 -63.8 -44.1 -3.6 11.1 6.0 37 36 A M H ><>S+ 0 0 19 -4,-3.4 3,-1.6 1,-0.2 5,-1.2 0.966 110.9 47.3 -58.7 -56.0 -0.3 13.1 5.9 38 37 A R H ><5S+ 0 0 154 -4,-3.4 3,-3.2 1,-0.3 4,-0.3 0.918 105.1 59.8 -52.4 -49.2 -1.7 15.9 3.8 39 38 A S H 3<5S+ 0 0 92 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.687 101.7 56.2 -55.4 -19.4 -4.8 16.2 6.0 40 39 A L T <<5S- 0 0 118 -3,-1.6 -1,-0.3 -4,-0.6 -2,-0.2 0.308 130.7 -93.9 -96.0 7.7 -2.4 16.9 8.9 41 40 A G T < 5S+ 0 0 65 -3,-3.2 2,-0.2 1,-0.3 -3,-0.2 0.761 87.3 118.1 88.1 27.9 -0.9 19.8 7.0 42 41 A Q < - 0 0 87 -5,-1.2 -1,-0.3 -4,-0.3 -2,-0.1 -0.730 48.9-155.9-120.5 170.7 2.1 18.1 5.4 43 42 A N - 0 0 122 -2,-0.2 -9,-0.1 -6,-0.0 -5,-0.0 -0.473 17.7-173.5-147.4 69.1 3.2 17.4 1.9 44 43 A P - 0 0 24 0, 0.0 2,-0.1 0, 0.0 -6,-0.1 -0.290 27.9-115.4 -63.6 148.0 5.5 14.3 1.7 45 44 A T >> - 0 0 72 1,-0.1 4,-2.6 4,-0.0 3,-0.8 -0.494 27.4-109.7 -80.5 156.5 7.2 13.5 -1.6 46 45 A E H 3> S+ 0 0 118 1,-0.3 4,-1.6 2,-0.2 -1,-0.1 0.814 123.6 54.8 -55.0 -28.6 6.2 10.3 -3.3 47 46 A A H 3> S+ 0 0 64 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.817 108.0 47.2 -74.2 -33.0 9.7 9.1 -2.4 48 47 A E H <> S+ 0 0 96 -3,-0.8 4,-3.0 2,-0.2 5,-0.2 0.903 109.4 52.2 -75.6 -42.5 9.2 9.9 1.3 49 48 A L H X S+ 0 0 12 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.923 110.5 49.8 -59.4 -43.0 5.8 8.2 1.4 50 49 A Q H X S+ 0 0 69 -4,-1.6 4,-2.9 -5,-0.3 -1,-0.2 0.836 111.0 49.6 -64.7 -33.2 7.4 5.1 -0.1 51 50 A D H X S+ 0 0 86 -4,-1.2 4,-3.5 2,-0.2 5,-0.3 0.970 110.3 49.2 -68.3 -54.2 10.2 5.2 2.5 52 51 A M H X S+ 0 0 67 -4,-3.0 4,-0.7 1,-0.2 -2,-0.2 0.902 117.3 42.0 -50.3 -47.0 7.8 5.6 5.4 53 52 A I H >X S+ 0 0 4 -4,-2.5 4,-1.9 -5,-0.2 3,-1.3 0.964 115.9 49.0 -65.8 -51.0 5.8 2.6 4.1 54 53 A N H 3< S+ 0 0 85 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.848 106.4 56.1 -57.7 -37.6 8.9 0.6 3.2 55 54 A E H 3< S+ 0 0 154 -4,-3.5 -1,-0.3 1,-0.2 -2,-0.2 0.697 116.5 36.8 -69.7 -19.0 10.6 1.2 6.6 56 55 A V H << S+ 0 0 30 -3,-1.3 2,-1.9 -4,-0.7 -2,-0.2 0.617 91.2 97.0-105.4 -18.6 7.5 -0.3 8.3 57 56 A D >< + 0 0 11 -4,-1.9 3,-1.4 1,-0.2 5,-0.2 -0.499 47.7 175.2 -75.6 81.0 6.7 -3.0 5.8 58 57 A A T 3 S+ 0 0 91 -2,-1.9 -1,-0.2 1,-0.3 6,-0.1 0.833 77.7 43.2 -57.9 -38.7 8.5 -6.0 7.5 59 58 A D T 3 S- 0 0 93 4,-0.2 -1,-0.3 1,-0.0 -2,-0.1 0.400 104.2-128.9 -91.4 6.4 7.4 -8.6 5.0 60 59 A G < + 0 0 59 -3,-1.4 -2,-0.1 -6,-0.1 4,-0.1 0.725 65.2 134.1 57.1 26.9 8.1 -6.4 2.0 61 60 A N S S- 0 0 90 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.372 78.7-105.8 -87.1 7.1 4.7 -6.9 0.3 62 61 A G S S+ 0 0 34 1,-0.2 -32,-0.3 -5,-0.2 2,-0.3 0.242 90.1 68.3 93.8 -14.4 4.4 -3.1 -0.3 63 62 A T S S- 0 0 25 -34,-0.1 2,-0.6 -9,-0.1 -2,-0.3 -0.857 78.7-109.0-134.7 168.6 1.9 -2.2 2.3 64 63 A I B -A 28 0A 7 -36,-2.3 -36,-3.0 -2,-0.3 2,-0.1 -0.878 31.9-169.1-101.7 122.4 1.5 -1.9 6.1 65 64 A D > - 0 0 42 -2,-0.6 4,-2.4 -38,-0.2 5,-0.2 -0.374 40.5 -87.9 -97.8-175.9 -0.8 -4.5 7.8 66 65 A F H > S+ 0 0 39 -40,-0.5 4,-3.5 1,-0.2 5,-0.2 0.956 123.5 45.8 -61.4 -54.5 -2.0 -4.4 11.4 67 66 A P H > S+ 0 0 68 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.872 114.6 49.9 -56.9 -35.5 0.9 -6.2 13.2 68 67 A E H > S+ 0 0 13 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.942 114.3 45.1 -66.5 -44.7 3.4 -4.1 11.2 69 68 A F H X S+ 0 0 9 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.903 113.4 51.3 -61.8 -43.6 1.5 -1.0 12.2 70 69 A L H X S+ 0 0 23 -4,-3.5 4,-2.3 1,-0.2 -2,-0.2 0.898 106.3 52.4 -62.7 -44.2 1.2 -2.2 15.8 71 70 A N H X S+ 0 0 110 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.818 109.7 50.3 -63.7 -31.8 5.0 -3.0 16.2 72 71 A L H X S+ 0 0 60 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.965 113.0 44.5 -69.3 -52.4 5.8 0.6 15.0 73 72 A M H X S+ 0 0 58 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.815 110.5 55.8 -61.4 -32.5 3.4 2.2 17.5 74 73 A A H X S+ 0 0 12 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.903 108.3 47.5 -67.6 -39.9 4.6 -0.1 20.3 75 74 A R H X S+ 0 0 117 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.874 113.9 47.4 -67.3 -37.8 8.2 1.1 19.7 76 75 A K H X S+ 0 0 121 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.868 110.8 53.1 -69.7 -38.2 7.0 4.7 19.6 77 76 A M H X S+ 0 0 43 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.952 110.6 45.3 -61.1 -51.5 5.0 4.1 22.8 78 77 A K H X S+ 0 0 63 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.864 111.7 52.8 -62.5 -37.0 7.9 2.7 24.7 79 78 A D H X S+ 0 0 76 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.956 111.6 46.2 -62.7 -48.8 10.2 5.5 23.5 80 79 A T H X S+ 0 0 69 -4,-2.5 4,-3.5 2,-0.2 5,-0.2 0.928 112.6 50.4 -57.8 -49.2 7.7 8.0 24.7 81 80 A D H X S+ 0 0 53 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.949 109.5 49.9 -56.1 -52.7 7.3 6.2 28.0 82 81 A S H X S+ 0 0 55 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.933 115.1 44.1 -51.8 -50.7 11.0 6.0 28.6 83 82 A E H X S+ 0 0 90 -4,-2.4 4,-2.3 1,-0.2 3,-0.3 0.937 114.5 48.9 -60.3 -48.4 11.4 9.7 27.9 84 83 A E H X S+ 0 0 65 -4,-3.5 4,-2.5 1,-0.2 -1,-0.2 0.841 108.1 54.9 -62.3 -32.5 8.3 10.6 30.0 85 84 A E H X S+ 0 0 114 -4,-3.1 4,-2.1 -5,-0.2 -1,-0.2 0.846 107.2 50.4 -69.7 -32.8 9.7 8.5 32.9 86 85 A L H X S+ 0 0 35 -4,-1.7 4,-2.2 -3,-0.3 -2,-0.2 0.910 111.2 48.8 -69.6 -41.8 12.9 10.5 32.8 87 86 A K H X S+ 0 0 66 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.915 111.1 49.4 -63.8 -42.9 10.9 13.7 32.9 88 87 A E H X S+ 0 0 121 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.929 110.8 50.7 -60.8 -46.0 8.8 12.4 35.9 89 88 A A H X S+ 0 0 31 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.914 108.4 51.0 -57.8 -45.6 11.8 11.4 37.8 90 89 A F H X S+ 0 0 15 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.939 108.8 52.6 -59.1 -45.5 13.5 14.8 37.2 91 90 A R H < S+ 0 0 142 -4,-2.2 6,-0.2 1,-0.2 -1,-0.2 0.872 105.8 54.2 -57.7 -38.9 10.3 16.4 38.5 92 91 A V H < S+ 0 0 93 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.931 113.8 41.3 -61.7 -45.3 10.4 14.3 41.7 93 92 A F H < S+ 0 0 28 -4,-2.1 2,-2.7 1,-0.2 16,-0.2 0.922 99.9 73.1 -67.8 -46.1 14.0 15.4 42.4 94 93 A D >< + 0 0 10 -4,-3.0 3,-1.9 1,-0.2 -1,-0.2 -0.435 66.4 176.4 -71.1 74.5 13.4 19.1 41.5 95 94 A K T 3 S+ 0 0 127 -2,-2.7 -1,-0.2 1,-0.3 6,-0.1 0.841 76.4 41.2 -51.8 -43.1 11.4 19.6 44.7 96 95 A D T 3 S- 0 0 99 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.345 104.3-129.1 -92.4 10.3 10.9 23.4 44.1 97 96 A Q < + 0 0 168 -3,-1.9 -2,-0.1 -6,-0.2 4,-0.1 0.804 64.4 134.4 49.5 40.4 10.2 22.9 40.4 98 97 A N S S- 0 0 83 2,-0.4 -1,-0.1 0, 0.0 3,-0.1 0.448 80.4-100.6 -96.7 1.3 12.7 25.5 39.3 99 98 A G S S+ 0 0 33 1,-0.2 40,-0.5 -5,-0.1 2,-0.3 0.441 94.5 83.3 97.0 -0.5 14.3 23.4 36.6 100 99 A F E -B 138 0B 65 38,-0.2 2,-0.6 39,-0.1 -2,-0.4 -0.979 68.9-134.1-137.6 149.0 17.3 22.4 38.5 101 100 A I E -B 137 0B 5 36,-2.4 36,-2.7 -2,-0.3 2,-0.2 -0.910 29.2-159.8-102.2 120.7 18.2 19.7 41.1 102 101 A S > - 0 0 38 -2,-0.6 4,-2.7 -9,-0.2 5,-0.2 -0.541 31.4-109.8 -94.9 164.0 20.2 21.2 44.0 103 102 A A H > S+ 0 0 30 32,-0.4 4,-2.6 1,-0.2 5,-0.2 0.929 121.8 52.2 -56.7 -44.3 22.4 19.3 46.4 104 103 A A H > S+ 0 0 71 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.893 110.6 46.8 -60.2 -40.8 19.8 20.0 49.1 105 104 A E H > S+ 0 0 12 2,-0.2 4,-2.6 1,-0.2 5,-0.4 0.902 110.9 51.9 -69.5 -38.5 17.0 18.5 46.9 106 105 A L H X S+ 0 0 19 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.920 111.8 47.1 -62.7 -43.9 19.1 15.5 46.0 107 106 A R H X S+ 0 0 85 -4,-2.6 4,-2.3 -5,-0.2 10,-0.2 0.934 116.9 43.8 -62.1 -47.1 19.7 14.8 49.7 108 107 A H H X S+ 0 0 73 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.993 117.3 41.4 -61.7 -65.8 16.1 15.3 50.6 109 108 A V H < S+ 0 0 13 -4,-2.6 -1,-0.2 -16,-0.2 -3,-0.2 0.896 115.2 53.8 -50.2 -45.2 14.5 13.3 47.8 110 109 A M H ><>S+ 0 0 19 -4,-2.2 3,-3.8 -5,-0.4 5,-1.4 0.981 108.0 47.3 -53.8 -65.5 17.1 10.6 48.2 111 110 A T H ><5S+ 0 0 47 -4,-2.3 3,-2.3 1,-0.3 4,-0.3 0.896 110.9 52.8 -40.6 -53.3 16.5 10.1 51.9 112 111 A N T 3<5S+ 0 0 117 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.440 103.9 60.1 -66.6 2.3 12.8 9.9 51.2 113 112 A L T < 5S- 0 0 107 -3,-3.8 -1,-0.3 2,-0.3 -2,-0.2 0.344 127.5 -94.4-110.1 2.5 13.5 7.3 48.6 114 113 A G T < 5S+ 0 0 60 -3,-2.3 2,-0.4 -4,-0.4 -3,-0.2 0.711 96.0 111.5 90.2 21.9 15.1 4.9 51.1 115 114 A E < - 0 0 90 -5,-1.4 2,-0.7 -4,-0.3 -2,-0.3 -0.940 45.8-170.4-133.8 110.8 18.6 6.1 50.3 116 115 A K - 0 0 150 -2,-0.4 2,-0.3 -6,-0.1 -9,-0.1 -0.902 11.9-176.9-105.8 112.8 20.5 8.0 53.0 117 116 A L - 0 0 23 -2,-0.7 -6,-0.1 -10,-0.2 2,-0.1 -0.738 22.6-120.3-107.1 155.5 23.7 9.6 51.7 118 117 A T > - 0 0 78 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.285 35.6 -99.5 -83.9 175.8 26.3 11.6 53.6 119 118 A D H > S+ 0 0 104 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.935 124.4 51.1 -62.0 -47.5 27.3 15.2 52.8 120 119 A E H > S+ 0 0 115 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.889 110.3 49.5 -56.5 -43.5 30.3 14.1 50.8 121 120 A E H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.893 108.9 52.2 -64.0 -43.4 28.2 11.7 48.8 122 121 A V H X S+ 0 0 6 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.956 112.2 44.3 -59.4 -52.6 25.6 14.3 48.0 123 122 A D H X S+ 0 0 75 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.888 112.5 51.6 -62.5 -40.5 28.1 16.8 46.7 124 123 A E H X S+ 0 0 78 -4,-2.2 4,-3.1 -5,-0.2 -1,-0.2 0.897 108.6 51.7 -63.0 -40.7 30.1 14.2 44.7 125 124 A M H X S+ 0 0 65 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.921 111.6 46.9 -63.0 -42.4 26.9 13.0 43.0 126 125 A I H >X S+ 0 0 11 -4,-2.1 4,-2.0 1,-0.2 3,-0.6 0.972 114.3 47.3 -62.0 -51.9 26.1 16.6 42.1 127 126 A R H 3< S+ 0 0 145 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.890 105.9 58.5 -56.3 -43.6 29.6 17.2 40.8 128 127 A E H 3< S+ 0 0 151 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.863 118.1 31.6 -55.1 -37.9 29.6 13.9 38.8 129 128 A A H << S+ 0 0 9 -4,-1.4 2,-2.0 -3,-0.6 -1,-0.2 0.630 92.0 101.4 -96.2 -15.7 26.6 15.1 36.8 130 129 A D >< + 0 0 23 -4,-2.0 3,-0.6 1,-0.2 -1,-0.1 -0.467 42.2 168.9 -75.5 81.9 27.2 18.8 36.8 131 130 A V T 3 S+ 0 0 97 -2,-2.0 -1,-0.2 1,-0.2 6,-0.1 0.914 76.2 40.5 -60.1 -48.6 28.6 19.2 33.3 132 131 A D T 3 S- 0 0 94 -3,-0.2 -1,-0.2 4,-0.2 -2,-0.1 0.486 104.1-129.2 -83.7 -0.5 28.6 23.0 33.1 133 132 A G < + 0 0 57 -3,-0.6 -2,-0.1 -6,-0.1 4,-0.1 0.747 65.4 132.8 62.3 29.7 29.8 23.3 36.7 134 133 A D S S- 0 0 72 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.449 78.2-108.0 -89.3 1.8 27.1 25.8 38.0 135 134 A G S S+ 0 0 47 1,-0.2 -32,-0.4 -9,-0.1 2,-0.3 0.519 90.2 75.0 89.3 5.1 26.6 23.7 41.1 136 135 A Q S S- 0 0 53 -34,-0.1 2,-0.7 -10,-0.1 -2,-0.3 -0.945 78.6-112.5-143.9 162.5 23.1 22.3 40.2 137 136 A I E -B 101 0B 9 -36,-2.7 -36,-2.4 -2,-0.3 -7,-0.1 -0.874 28.3-165.1-105.5 112.6 21.8 19.6 37.8 138 137 A N E > -B 100 0B 32 -2,-0.7 4,-2.2 -38,-0.2 5,-0.2 -0.323 39.4 -94.6 -84.0 174.0 19.7 20.8 34.9 139 138 A Y H > S+ 0 0 66 -40,-0.5 4,-2.9 1,-0.2 5,-0.2 0.915 123.2 51.6 -57.3 -49.8 17.5 18.4 32.8 140 139 A D H > S+ 0 0 124 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.893 112.5 48.0 -54.4 -41.3 20.0 17.7 30.1 141 140 A E H > S+ 0 0 9 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.896 110.9 50.1 -67.2 -41.1 22.6 16.8 32.7 142 141 A F H X S+ 0 0 7 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.923 112.1 48.0 -62.6 -46.0 20.1 14.6 34.6 143 142 A V H X S+ 0 0 24 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.951 109.7 52.8 -59.8 -49.8 19.3 12.8 31.3 144 143 A K H < S+ 0 0 135 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.902 114.1 41.5 -53.0 -47.0 22.9 12.4 30.4 145 144 A V H >< S+ 0 0 60 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.821 113.8 53.4 -73.2 -31.7 23.8 10.8 33.8 146 145 A M H 3< S+ 0 0 100 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.908 108.4 48.0 -70.1 -42.5 20.6 8.6 33.8 147 146 A M T 3< 0 0 139 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.220 360.0 360.0 -84.2 16.7 21.2 7.1 30.4 148 147 A A < 0 0 120 -3,-0.8 -2,-0.2 -5,-0.1 -3,-0.2 0.548 360.0 360.0-134.8 360.0 24.8 6.3 31.4