==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 03-APR-12 4EHQ . COMPND 2 MOLECULE: CALMODULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR Y.LIU,X.ZHENG,G.A.MUELLER,M.SOBHANY,E.F.DEROSE,Y.ZHANG,R.E.L . 165 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11095.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 69.7 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 3.0 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 . 9 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 52.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 0 2 3 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 2 A D 0 0 153 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.5 24.0 -3.1 35.4 2 3 A Q + 0 0 152 1,-0.0 2,-0.2 5,-0.0 0, 0.0 -0.594 360.0 150.4 -85.2 124.9 22.9 0.3 34.4 3 4 A L - 0 0 80 -2,-0.4 2,-0.1 4,-0.0 -1,-0.0 -0.709 20.8-173.8-149.8 95.5 21.0 2.6 36.7 4 5 A T > - 0 0 63 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.263 41.1-102.3 -82.5 171.6 21.6 6.4 36.2 5 6 A E H > S+ 0 0 176 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.912 125.4 47.3 -57.9 -44.9 20.3 9.3 38.3 6 7 A E H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.876 110.3 51.8 -65.8 -40.4 17.6 9.9 35.7 7 8 A Q H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.889 109.2 50.6 -64.4 -38.8 16.6 6.2 35.5 8 9 A I H X S+ 0 0 58 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.919 109.7 50.4 -63.5 -44.7 16.3 6.1 39.3 9 10 A A H X S+ 0 0 39 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.898 109.9 50.4 -59.6 -40.8 14.0 9.2 39.2 10 11 A E H X S+ 0 0 93 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.883 109.1 51.2 -67.5 -38.2 11.9 7.6 36.5 11 12 A F H X S+ 0 0 14 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.864 109.9 50.0 -62.8 -37.6 11.5 4.4 38.6 12 13 A K H X S+ 0 0 124 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.859 108.4 53.0 -69.8 -34.5 10.4 6.5 41.6 13 14 A E H X S+ 0 0 125 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.922 112.5 44.1 -64.0 -44.7 7.9 8.3 39.5 14 15 A A H X S+ 0 0 18 -4,-2.0 4,-1.0 1,-0.2 3,-0.5 0.920 113.4 51.3 -65.8 -44.1 6.4 5.0 38.3 15 16 A F H >X S+ 0 0 16 -4,-2.6 4,-2.9 1,-0.2 3,-0.6 0.891 105.4 56.4 -58.0 -40.9 6.5 3.6 41.9 16 17 A S H 3< S+ 0 0 68 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.799 97.9 61.7 -65.6 -28.4 4.7 6.7 43.2 17 18 A L H 3< S+ 0 0 114 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.872 114.1 35.4 -63.4 -36.6 1.8 6.1 40.8 18 19 A F H << S+ 0 0 53 -4,-1.0 2,-2.2 -3,-0.6 -2,-0.2 0.890 104.5 72.6 -81.0 -43.2 1.3 2.7 42.5 19 20 A D >< + 0 0 13 -4,-2.9 3,-1.3 1,-0.2 -1,-0.2 -0.462 63.4 173.9 -77.1 75.5 2.2 3.9 46.1 20 21 A K T 3 S+ 0 0 114 -2,-2.2 -1,-0.2 1,-0.3 6,-0.1 0.832 75.5 37.8 -56.8 -41.1 -1.0 5.9 46.5 21 22 A D T 3 S- 0 0 115 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.386 103.4-126.3 -97.4 5.2 -0.4 6.8 50.2 22 23 A G < + 0 0 57 -3,-1.3 -2,-0.1 -6,-0.2 4,-0.1 0.690 67.0 132.5 64.0 24.9 3.3 7.3 49.9 23 24 A D S S- 0 0 88 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.498 79.9-106.4 -84.1 -5.4 4.3 4.9 52.7 24 25 A G S S+ 0 0 32 1,-0.3 40,-0.5 -5,-0.1 2,-0.3 0.565 90.0 89.3 89.7 9.9 6.9 3.3 50.5 25 26 A T - 0 0 31 38,-0.1 2,-0.5 39,-0.1 -2,-0.3 -0.964 64.8-139.0-134.4 155.9 5.0 0.0 49.9 26 27 A I B -A 62 0A 3 36,-1.8 36,-2.4 -2,-0.3 2,-0.2 -0.973 23.9-166.4-115.0 119.4 2.5 -1.2 47.3 27 28 A T > - 0 0 44 -2,-0.5 4,-2.3 34,-0.2 5,-0.2 -0.528 37.3-103.7 -96.6 166.1 -0.4 -3.2 48.6 28 29 A T H > S+ 0 0 16 32,-0.3 4,-1.9 1,-0.2 5,-0.1 0.882 122.2 53.8 -53.5 -40.0 -2.9 -5.4 46.7 29 30 A K H > S+ 0 0 157 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.902 107.4 47.9 -66.1 -42.3 -5.5 -2.6 47.3 30 31 A E H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.906 111.3 52.6 -65.0 -38.9 -3.3 0.1 45.7 31 32 A L H X S+ 0 0 18 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.861 105.7 54.0 -63.6 -36.9 -2.6 -2.2 42.8 32 33 A G H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.923 106.2 52.9 -60.9 -44.2 -6.4 -2.7 42.3 33 34 A T H X S+ 0 0 64 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.931 111.9 44.6 -57.7 -48.3 -6.8 1.1 42.1 34 35 A V H X S+ 0 0 16 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.919 112.4 51.5 -64.2 -43.0 -4.2 1.4 39.4 35 36 A M H ><>S+ 0 0 12 -4,-2.5 5,-2.3 1,-0.2 3,-0.6 0.882 107.9 52.1 -65.7 -35.1 -5.5 -1.6 37.4 36 37 A R H ><5S+ 0 0 118 -4,-2.5 3,-2.0 1,-0.2 -1,-0.2 0.892 103.1 58.1 -66.0 -37.1 -9.0 -0.3 37.4 37 38 A S H 3<5S+ 0 0 95 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.725 103.4 54.6 -64.6 -19.8 -7.7 3.0 36.1 38 39 A L T <<5S- 0 0 124 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.424 127.8-102.5 -90.9 -1.5 -6.4 1.0 33.1 39 40 A G T < 5S+ 0 0 70 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.562 83.9 120.4 93.4 10.9 -9.9 -0.4 32.6 40 41 A Q < - 0 0 107 -5,-2.3 -1,-0.3 -6,-0.1 -2,-0.1 -0.535 48.2-156.3 -97.2 170.4 -9.3 -3.8 34.2 41 42 A N - 0 0 131 -2,-0.2 -9,-0.1 -3,-0.1 -5,-0.1 -0.346 19.3-175.7-143.8 60.1 -11.3 -5.2 37.1 42 43 A P - 0 0 13 0, 0.0 2,-0.1 0, 0.0 -6,-0.0 -0.172 23.0-123.5 -62.6 150.7 -9.1 -7.8 38.9 43 44 A T > - 0 0 75 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.382 31.7-103.4 -79.2 169.7 -10.5 -9.9 41.8 44 45 A E H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.886 123.9 54.4 -64.5 -37.6 -8.6 -9.9 45.1 45 46 A A H > S+ 0 0 65 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.908 108.9 48.3 -60.2 -42.1 -7.2 -13.3 44.3 46 47 A E H > S+ 0 0 96 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.899 111.0 50.5 -65.2 -40.1 -5.9 -12.0 41.0 47 48 A L H X S+ 0 0 5 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.892 108.0 53.0 -63.7 -40.0 -4.3 -9.0 42.7 48 49 A Q H X S+ 0 0 64 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.853 106.5 52.8 -65.6 -34.7 -2.6 -11.2 45.3 49 50 A D H X S+ 0 0 103 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.875 109.9 49.2 -66.4 -39.5 -1.1 -13.3 42.5 50 51 A M H X S+ 0 0 58 -4,-1.7 4,-0.8 2,-0.2 -2,-0.2 0.930 114.6 43.6 -65.6 -47.8 0.3 -10.2 40.9 51 52 A I H >X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 3,-1.1 0.947 110.9 56.8 -60.5 -47.6 1.8 -8.9 44.2 52 53 A N H 3< S+ 0 0 88 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.859 102.7 52.8 -55.3 -39.9 3.1 -12.4 45.0 53 54 A E H 3< S+ 0 0 141 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.740 117.7 37.5 -73.2 -18.0 5.2 -12.7 41.9 54 55 A V H << S+ 0 0 25 -3,-1.1 2,-2.0 -4,-0.8 -2,-0.2 0.656 93.1 94.2 -96.2 -24.2 6.9 -9.4 42.5 55 56 A D >< + 0 0 14 -4,-2.2 3,-1.7 1,-0.2 5,-0.1 -0.447 48.8 173.9 -79.5 77.2 7.1 -9.8 46.3 56 57 A A T 3 S+ 0 0 94 -2,-2.0 -1,-0.2 1,-0.3 6,-0.1 0.772 77.4 41.7 -58.5 -32.5 10.6 -11.3 46.6 57 58 A D T 3 S- 0 0 91 4,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.410 102.0-130.2 -98.6 2.0 10.8 -11.2 50.4 58 59 A G < + 0 0 58 -3,-1.7 -2,-0.1 -6,-0.1 4,-0.1 0.705 64.9 132.1 61.7 26.1 7.2 -12.5 50.9 59 60 A N S S- 0 0 100 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.443 78.4-108.1 -88.6 1.9 6.2 -9.8 53.4 60 61 A G S S+ 0 0 30 1,-0.2 -32,-0.3 -5,-0.1 2,-0.3 0.245 89.4 71.5 98.1 -13.1 3.0 -9.1 51.5 61 62 A T S S- 0 0 29 -34,-0.1 2,-0.6 -33,-0.1 -2,-0.3 -0.885 77.3-113.4-131.5 165.7 3.7 -5.7 50.0 62 63 A I B -A 26 0A 11 -36,-2.4 -36,-1.8 -2,-0.3 2,-0.1 -0.884 28.0-166.9-104.8 119.7 6.0 -4.4 47.2 63 64 A D > - 0 0 44 -2,-0.6 4,-2.5 -38,-0.2 5,-0.2 -0.441 39.3 -94.5 -94.0 173.3 8.9 -2.1 48.2 64 65 A F H > S+ 0 0 53 -40,-0.5 4,-3.5 1,-0.2 5,-0.3 0.919 122.5 50.8 -58.7 -49.4 11.0 0.1 45.8 65 66 A P H > S+ 0 0 79 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.922 113.8 46.2 -56.2 -44.1 13.8 -2.4 45.3 66 67 A E H > S+ 0 0 15 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.911 115.4 47.4 -60.8 -43.1 11.3 -5.2 44.5 67 68 A F H X S+ 0 0 20 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.943 113.7 45.2 -64.3 -50.8 9.4 -2.8 42.2 68 69 A L H X S+ 0 0 26 -4,-3.5 4,-2.7 1,-0.2 5,-0.2 0.889 111.3 54.1 -61.8 -40.5 12.5 -1.6 40.3 69 70 A T H X S+ 0 0 83 -4,-2.3 4,-1.4 -5,-0.3 -1,-0.2 0.898 113.9 41.0 -62.1 -42.6 13.9 -5.1 39.9 70 71 A M H X S+ 0 0 38 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.931 115.4 49.8 -70.6 -47.2 10.6 -6.4 38.3 71 72 A M H X S+ 0 0 57 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.884 109.7 51.0 -60.7 -41.8 10.1 -3.3 36.2 72 73 A A H X S+ 0 0 21 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.902 111.2 48.4 -64.2 -41.1 13.7 -3.4 34.8 73 74 A R H X S+ 0 0 126 -4,-1.4 4,-2.0 -5,-0.2 -2,-0.2 0.912 112.3 48.6 -63.2 -43.3 13.3 -7.1 33.9 74 75 A K H X S+ 0 0 126 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.867 108.9 54.0 -62.6 -39.6 9.9 -6.4 32.2 75 76 A M H X S+ 0 0 102 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.887 108.0 49.8 -62.6 -39.7 11.5 -3.4 30.3 76 77 A K H X S+ 0 0 144 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.903 111.4 48.3 -67.0 -40.5 14.2 -5.7 29.0 77 78 A D H X S+ 0 0 105 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.885 112.5 48.9 -62.4 -41.8 11.7 -8.3 27.8 78 79 A T H X S+ 0 0 98 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.873 111.9 48.3 -66.6 -40.2 9.6 -5.6 26.1 79 80 A D H X S+ 0 0 100 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.931 113.6 47.7 -62.3 -48.3 12.7 -4.2 24.4 80 81 A S H X S+ 0 0 64 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.924 111.8 49.2 -61.9 -47.0 13.7 -7.7 23.2 81 82 A E H X S+ 0 0 64 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.855 108.5 53.9 -58.5 -40.7 10.2 -8.5 22.0 82 83 A E H X S+ 0 0 71 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.848 105.7 53.1 -64.3 -36.0 10.1 -5.2 20.1 83 84 A E H X S+ 0 0 70 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.883 111.3 46.7 -66.1 -36.4 13.4 -6.1 18.3 84 85 A I H X S+ 0 0 5 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.887 111.1 51.0 -70.6 -41.9 11.8 -9.4 17.3 85 86 A R H X S+ 0 0 119 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.867 108.5 52.5 -61.5 -39.6 8.6 -7.7 16.1 86 87 A E H X S+ 0 0 52 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.934 109.5 48.4 -64.0 -46.1 10.6 -5.3 14.0 87 88 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.891 110.3 52.9 -57.7 -43.2 12.5 -8.2 12.3 88 89 A F H X S+ 0 0 13 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.923 108.0 49.3 -60.6 -46.2 9.2 -9.9 11.7 89 90 A R H < S+ 0 0 142 -4,-2.3 -1,-0.2 2,-0.2 6,-0.2 0.857 111.9 50.0 -60.9 -36.8 7.7 -6.8 10.0 90 91 A V H < S+ 0 0 78 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.946 114.1 43.7 -67.3 -45.5 10.8 -6.5 7.8 91 92 A F H < S+ 0 0 6 -4,-2.7 2,-1.8 1,-0.2 -2,-0.2 0.854 100.9 71.7 -67.2 -34.6 10.6 -10.2 6.8 92 93 A D >< + 0 0 9 -4,-2.6 3,-1.8 1,-0.2 -1,-0.2 -0.556 68.7 178.6 -83.5 79.3 6.9 -10.0 6.2 93 94 A K T 3 S+ 0 0 126 -2,-1.8 -1,-0.2 1,-0.3 6,-0.1 0.818 74.6 44.2 -61.4 -37.5 7.2 -8.0 3.0 94 95 A D T 3 S- 0 0 101 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.454 104.0-128.8 -88.4 1.1 3.5 -7.7 2.1 95 96 A G < + 0 0 59 -3,-1.8 -2,-0.1 -6,-0.2 4,-0.1 0.631 67.2 131.1 68.7 16.0 2.6 -6.9 5.7 96 97 A N S S- 0 0 80 2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.463 79.1-105.4 -86.1 0.2 -0.1 -9.6 5.9 97 98 A G S S+ 0 0 29 1,-0.2 40,-0.6 -5,-0.1 2,-0.4 0.429 92.0 85.3 96.4 0.2 1.1 -11.2 9.2 98 99 A Y E S-B 136 0B 85 38,-0.2 2,-0.7 39,-0.1 -2,-0.3 -0.988 70.1-134.4-131.3 142.3 2.6 -14.3 7.7 99 100 A I E -B 135 0B 0 36,-2.9 36,-2.5 -2,-0.4 2,-0.1 -0.872 29.2-156.7 -92.8 118.7 6.1 -14.9 6.3 100 101 A S > - 0 0 28 -2,-0.7 4,-2.8 34,-0.2 5,-0.2 -0.478 28.9-109.5 -89.2 166.1 5.7 -16.9 3.1 101 102 A A H > S+ 0 0 22 32,-0.4 4,-2.7 2,-0.2 5,-0.2 0.903 121.8 50.1 -56.5 -43.3 8.3 -19.1 1.5 102 103 A A H > S+ 0 0 48 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.922 111.0 48.0 -64.2 -44.4 8.7 -16.6 -1.3 103 104 A E H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.925 112.6 49.2 -60.7 -44.8 9.1 -13.7 1.2 104 105 A L H X S+ 0 0 1 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.900 110.2 51.3 -62.6 -40.6 11.7 -15.8 3.1 105 106 A R H X S+ 0 0 84 -4,-2.7 4,-2.2 2,-0.2 10,-0.3 0.898 110.8 47.5 -64.2 -39.1 13.5 -16.6 -0.1 106 107 A H H X S+ 0 0 90 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.915 110.0 53.7 -67.6 -40.9 13.7 -12.9 -1.0 107 108 A V H X S+ 0 0 15 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.934 109.0 48.5 -54.8 -50.4 14.9 -12.1 2.5 108 109 A M H ><>S+ 0 0 7 -4,-2.4 5,-2.8 1,-0.2 3,-0.7 0.925 108.7 54.1 -57.6 -46.1 17.7 -14.6 2.2 109 110 A T H ><5S+ 0 0 58 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.920 106.6 51.3 -54.3 -46.4 18.6 -13.1 -1.2 110 111 A N H 3<5S+ 0 0 108 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.734 107.7 53.3 -65.5 -22.2 18.9 -9.6 0.3 111 112 A L T <<5S- 0 0 50 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.227 127.9 -98.6 -96.3 10.7 21.2 -11.0 3.0 112 113 A G T < 5S+ 0 0 68 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.591 85.6 120.3 89.5 13.7 23.5 -12.5 0.3 113 114 A E < - 0 0 99 -5,-2.8 2,-0.7 -6,-0.2 -1,-0.2 -0.938 48.2-154.1-119.2 126.2 22.2 -16.1 0.4 114 115 A K + 0 0 166 -2,-0.5 2,-0.4 -3,-0.1 -8,-0.1 -0.859 20.5 178.2-100.3 111.2 20.7 -17.9 -2.6 115 116 A L - 0 0 12 -2,-0.7 2,-0.1 -10,-0.3 -6,-0.1 -0.875 24.1-127.8-107.9 144.9 18.2 -20.7 -1.5 116 117 A T > - 0 0 73 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.375 33.1-105.0 -75.7 165.4 16.2 -23.0 -3.7 117 118 A D H > S+ 0 0 97 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.893 123.8 57.8 -55.4 -40.5 12.4 -23.3 -3.2 118 119 A E H > S+ 0 0 105 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.915 107.4 45.4 -54.8 -47.7 13.2 -26.7 -1.7 119 120 A E H > S+ 0 0 39 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.912 115.0 45.7 -68.5 -43.8 15.5 -25.1 1.0 120 121 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.871 109.9 55.5 -66.0 -37.8 13.1 -22.3 1.9 121 122 A D H X S+ 0 0 69 -4,-2.7 4,-2.8 -5,-0.2 -2,-0.2 0.910 106.4 51.5 -61.2 -42.2 10.2 -24.8 2.0 122 123 A E H X S+ 0 0 89 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.923 109.4 49.6 -56.4 -48.3 12.1 -26.8 4.6 123 124 A M H X S+ 0 0 5 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.873 111.3 49.5 -61.4 -39.1 12.7 -23.7 6.7 124 125 A I H X S+ 0 0 6 -4,-2.2 4,-1.9 2,-0.2 3,-0.5 0.946 110.5 48.8 -65.7 -49.0 9.1 -22.9 6.6 125 126 A R H < S+ 0 0 151 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.884 105.1 60.1 -58.1 -39.0 8.0 -26.4 7.6 126 127 A E H < S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.903 118.2 29.1 -53.1 -42.2 10.5 -26.3 10.4 127 128 A A H < S+ 0 0 2 -4,-1.3 2,-2.2 -3,-0.5 -1,-0.2 0.584 93.0 100.9 -95.1 -15.1 8.7 -23.2 11.9 128 129 A D >< + 0 0 22 -4,-1.9 3,-1.3 1,-0.2 5,-0.1 -0.421 38.6 163.9 -80.1 72.3 5.1 -23.9 10.7 129 130 A I T 3 S+ 0 0 120 -2,-2.2 -1,-0.2 1,-0.3 6,-0.1 0.886 74.8 45.2 -56.4 -42.1 3.6 -25.3 13.8 130 131 A D T 3 S- 0 0 89 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.392 103.5-127.6 -90.6 3.3 -0.0 -24.9 12.7 131 132 A G < + 0 0 57 -3,-1.3 -2,-0.1 -6,-0.1 4,-0.1 0.654 67.5 130.1 66.6 20.4 0.5 -26.3 9.2 132 133 A D S S- 0 0 70 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.532 80.0-109.0 -85.8 -1.7 -1.0 -23.4 7.2 133 134 A G S S+ 0 0 45 1,-0.3 -32,-0.4 -5,-0.1 2,-0.3 0.485 89.7 68.8 91.5 3.6 2.1 -23.2 5.0 134 135 A Q S S- 0 0 54 -34,-0.1 2,-0.6 -10,-0.1 -2,-0.3 -0.921 80.9-106.6-145.9 172.9 3.5 -20.0 6.3 135 136 A V E -B 99 0B 0 -36,-2.5 -36,-2.9 -2,-0.3 -7,-0.1 -0.891 30.6-166.9-110.3 113.1 5.1 -18.6 9.5 136 137 A N E > -B 98 0B 31 -2,-0.6 4,-2.4 -38,-0.2 5,-0.2 -0.326 40.7 -93.1 -87.1 176.3 3.1 -16.2 11.7 137 138 A Y H > S+ 0 0 34 -40,-0.6 4,-3.0 1,-0.2 5,-0.2 0.904 124.1 52.0 -58.0 -45.4 4.5 -14.1 14.5 138 139 A E H > S+ 0 0 132 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.921 111.9 47.2 -56.7 -44.9 3.9 -16.6 17.3 139 140 A E H > S+ 0 0 7 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.902 112.2 50.6 -63.8 -41.0 5.7 -19.3 15.2 140 141 A F H >X S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.2 4,-0.6 0.941 110.3 48.8 -59.3 -51.0 8.6 -16.8 14.5 141 142 A V H >X S+ 0 0 25 -4,-3.0 4,-1.2 1,-0.3 3,-1.2 0.870 104.4 59.5 -61.7 -39.3 8.9 -15.9 18.2 142 143 A Q H 3< S+ 0 0 119 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.818 104.0 51.8 -55.3 -34.3 9.0 -19.6 19.2 143 144 A M H << S+ 0 0 55 -4,-1.1 12,-0.3 -3,-0.8 -1,-0.3 0.611 111.5 47.0 -78.9 -13.7 12.1 -20.0 16.9 144 145 A M H << 0 0 14 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.2 0.573 360.0 360.0 -97.8 -17.1 13.8 -17.1 18.7 145 146 A T < 0 0 124 -4,-1.2 -3,-0.1 -5,-0.2 10,-0.1 -0.130 360.0 360.0-136.4 360.0 12.9 -18.3 22.2 146 !* 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 0.0 147 69 G H 0 0 240 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.4 27.4 -34.8 0.3 148 70 G S - 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