==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM BINDING PROTEIN 11-MAY-88 3CLN . COMPND 2 MOLECULE: CALMODULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS RATTUS; . AUTHOR Y.S.BABU,C.E.BUGG,W.J.COOK . 143 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10019.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 76.9 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 . 6 4.2 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 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 51.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.1 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 0 0 0 0 1 0 2 3 0 1 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 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 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 5 A T >> 0 0 140 0, 0.0 4,-3.1 0, 0.0 3,-1.2 0.000 360.0 360.0 360.0 -36.9 -22.1 30.5 31.5 2 6 A E H 3> + 0 0 174 1,-0.3 4,-1.4 2,-0.2 5,-0.1 0.890 360.0 40.5 -47.0 -51.1 -23.2 32.6 34.6 3 7 A E H 3> S+ 0 0 157 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.602 113.5 58.7 -75.3 -12.9 -19.9 31.9 36.3 4 8 A Q H <> S+ 0 0 107 -3,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.890 104.1 46.6 -84.4 -44.0 -18.2 32.4 32.9 5 9 A I H X S+ 0 0 67 -4,-3.1 4,-3.7 1,-0.2 -2,-0.2 0.891 109.8 56.6 -65.1 -35.8 -19.5 36.0 32.4 6 10 A A H X S+ 0 0 45 -4,-1.4 4,-2.3 -5,-0.3 -1,-0.2 0.942 107.4 47.5 -57.7 -50.5 -18.5 36.8 36.0 7 11 A E H X S+ 0 0 110 -4,-1.1 4,-1.8 1,-0.2 -2,-0.2 0.953 114.5 46.6 -57.3 -49.0 -14.9 35.7 35.2 8 12 A F H X S+ 0 0 47 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.894 108.9 56.0 -60.0 -42.7 -15.0 37.8 32.0 9 13 A K H X S+ 0 0 102 -4,-3.7 4,-2.4 1,-0.2 -1,-0.2 0.892 105.4 51.9 -55.1 -42.9 -16.5 40.7 34.0 10 14 A E H X S+ 0 0 143 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.884 109.7 48.5 -61.0 -45.1 -13.5 40.5 36.4 11 15 A A H >X S+ 0 0 40 -4,-1.8 3,-1.3 1,-0.2 4,-0.8 0.942 110.0 52.8 -64.6 -44.1 -11.1 40.7 33.4 12 16 A F H >X S+ 0 0 12 -4,-2.6 4,-2.2 1,-0.3 3,-0.7 0.852 101.7 60.3 -56.7 -44.2 -13.0 43.7 32.0 13 17 A S H 3< S+ 0 0 67 -4,-2.4 -1,-0.3 1,-0.2 6,-0.2 0.729 94.1 62.2 -61.7 -27.2 -12.8 45.6 35.2 14 18 A L H << S+ 0 0 102 -3,-1.3 -1,-0.2 -4,-0.7 -2,-0.2 0.854 112.4 38.4 -63.4 -38.5 -9.0 45.6 35.2 15 19 A F H << S+ 0 0 48 -4,-0.8 2,-1.9 -3,-0.7 -2,-0.2 0.861 103.5 71.6 -73.4 -46.9 -9.2 47.6 32.0 16 20 A D >< + 0 0 13 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 -0.526 61.9 171.2 -76.4 73.4 -12.2 49.8 33.0 17 21 A K T 3 S+ 0 0 104 -2,-1.9 -1,-0.2 1,-0.3 6,-0.1 0.716 76.6 37.6 -55.9 -36.6 -10.3 51.9 35.5 18 22 A D T 3 S- 0 0 113 4,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.285 103.4-129.9-100.7 5.5 -13.1 54.5 36.1 19 23 A G < + 0 0 56 -3,-1.5 -2,-0.1 -6,-0.2 4,-0.1 0.682 62.9 136.1 52.1 35.5 -15.8 51.8 35.9 20 24 A D S S- 0 0 96 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.419 79.7-101.2 -86.7 0.3 -18.0 53.7 33.4 21 25 A G S S+ 0 0 32 1,-0.2 40,-0.5 -5,-0.1 2,-0.3 0.591 91.0 82.2 93.6 9.0 -18.6 50.5 31.3 22 26 A T E -A 60 0A 27 38,-0.2 2,-0.5 39,-0.1 -2,-0.3 -0.990 67.0-130.0-145.3 158.5 -16.1 51.1 28.5 23 27 A I E -A 59 0A 7 36,-3.0 36,-2.2 -2,-0.3 2,-0.2 -0.934 26.0-166.9-115.2 128.3 -12.5 50.8 27.7 24 28 A T > - 0 0 29 -2,-0.5 4,-2.9 -9,-0.2 5,-0.2 -0.576 38.2-105.9-102.1 160.6 -10.7 53.8 26.2 25 29 A T H > S+ 0 0 2 32,-0.3 4,-1.7 1,-0.2 -1,-0.1 0.799 122.8 53.1 -63.7 -30.1 -7.4 54.1 24.5 26 30 A K H > S+ 0 0 120 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 110.0 44.7 -72.2 -39.8 -6.1 55.8 27.7 27 31 A E H > S+ 0 0 17 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.948 114.5 49.0 -68.3 -44.1 -7.3 53.0 30.0 28 32 A L H X S+ 0 0 20 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.896 109.5 56.3 -58.2 -39.9 -5.9 50.4 27.7 29 33 A G H X S+ 0 0 0 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.867 104.0 50.1 -59.1 -47.3 -2.8 52.5 27.7 30 34 A T H X S+ 0 0 57 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.825 111.7 48.1 -70.4 -29.2 -2.4 52.4 31.6 31 35 A V H X S+ 0 0 5 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.856 109.8 51.3 -70.3 -46.9 -2.7 48.6 31.7 32 36 A M H <>S+ 0 0 33 -4,-2.3 5,-1.6 1,-0.2 3,-0.4 0.909 114.5 46.3 -57.9 -45.2 -0.2 48.1 28.8 33 37 A R H ><5S+ 0 0 111 -4,-2.0 3,-2.6 1,-0.2 -2,-0.2 0.865 104.1 57.3 -61.6 -44.9 2.2 50.4 30.8 34 38 A S H 3<5S+ 0 0 90 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.773 107.5 54.6 -62.8 -16.8 1.6 48.6 34.2 35 39 A L T 3<5S- 0 0 125 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.319 126.3-101.9 -95.4 3.8 2.8 45.6 32.1 36 40 A G T < 5S+ 0 0 67 -3,-2.6 2,-0.4 1,-0.2 -3,-0.2 0.722 87.4 112.9 80.0 30.0 6.1 47.3 31.0 37 41 A Q < - 0 0 115 -5,-1.6 -2,-0.3 -8,-0.1 -1,-0.2 -0.999 47.2-163.8-133.2 127.5 5.0 48.2 27.5 38 42 A N - 0 0 125 -2,-0.4 -9,-0.1 -3,-0.1 -8,-0.1 -0.712 16.4-173.5-116.9 76.1 4.6 51.9 26.4 39 43 A P - 0 0 17 0, 0.0 2,-0.1 0, 0.0 -6,-0.1 -0.251 24.5-114.9 -64.2 157.9 2.6 51.8 23.2 40 44 A T > - 0 0 82 1,-0.1 4,-2.1 4,-0.0 3,-0.1 -0.418 30.6-104.5 -86.4 168.3 2.0 55.1 21.3 41 45 A E H > S+ 0 0 113 1,-0.2 4,-3.4 2,-0.2 5,-0.1 0.850 122.4 56.8 -59.6 -35.5 -1.5 56.5 20.9 42 46 A A H > S+ 0 0 66 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.850 108.4 44.8 -65.6 -40.7 -1.5 55.2 17.3 43 47 A E H > S+ 0 0 98 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.870 113.2 51.3 -70.6 -36.7 -0.8 51.6 18.4 44 48 A L H >X S+ 0 0 4 -4,-2.1 4,-2.2 1,-0.2 3,-0.5 0.968 107.8 53.5 -63.9 -51.3 -3.5 52.0 21.2 45 49 A Q H 3X S+ 0 0 66 -4,-3.4 4,-2.5 1,-0.3 -2,-0.2 0.854 108.0 49.3 -53.0 -41.5 -5.9 53.3 18.5 46 50 A D H 3X S+ 0 0 113 -4,-1.7 4,-1.4 2,-0.2 -1,-0.3 0.844 107.7 54.9 -66.5 -36.7 -5.3 50.2 16.4 47 51 A M H X S+ 0 0 3 -4,-2.2 4,-3.6 1,-0.2 3,-1.0 0.912 109.0 56.4 -63.7 -47.5 -9.3 49.5 20.1 49 53 A N H 3< S+ 0 0 86 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.803 100.2 59.4 -54.4 -38.6 -10.4 49.5 16.4 50 54 A E H 3< S+ 0 0 169 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.875 118.8 28.5 -59.0 -37.0 -9.9 45.8 16.1 51 55 A V H << S+ 0 0 34 -3,-1.0 2,-1.0 -4,-0.8 -2,-0.2 0.781 92.8 100.0 -98.3 -32.1 -12.5 45.1 18.9 52 56 A D < + 0 0 16 -4,-3.6 3,-0.5 1,-0.2 7,-0.1 -0.256 47.5 178.1 -56.6 94.2 -14.7 48.2 18.6 53 57 A A S S+ 0 0 86 -2,-1.0 -1,-0.2 1,-0.2 6,-0.1 0.844 75.8 37.8 -72.8 -33.3 -17.7 46.6 16.7 54 58 A D S S- 0 0 100 4,-0.3 -1,-0.2 0, 0.0 -2,-0.1 0.252 102.5-123.6-100.8 2.6 -20.0 49.6 16.5 55 59 A G + 0 0 60 -3,-0.5 4,-0.1 1,-0.1 -2,-0.1 0.625 69.0 131.5 65.0 22.0 -17.3 52.3 15.9 56 60 A N S S- 0 0 99 2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.585 79.8-111.7 -75.4 -8.9 -18.2 54.6 18.9 57 61 A G S S+ 0 0 29 1,-0.3 2,-0.3 -9,-0.1 -32,-0.3 0.393 86.8 75.7 97.5 -2.7 -14.4 54.5 19.6 58 62 A T S S- 0 0 28 -34,-0.1 2,-0.5 -10,-0.1 -2,-0.3 -0.938 74.3-117.4-138.7 163.9 -14.6 52.5 22.8 59 63 A I E -A 23 0A 7 -36,-2.2 -36,-3.0 -2,-0.3 2,-0.2 -0.892 25.5-170.9-112.1 129.2 -15.1 49.0 23.9 60 64 A D E > -A 22 0A 43 -2,-0.5 4,-2.4 -38,-0.2 3,-0.3 -0.542 41.8 -88.6-102.2 174.2 -18.0 47.8 26.1 61 65 A F H > S+ 0 0 44 -40,-0.5 4,-3.4 1,-0.2 5,-0.3 0.908 123.0 50.1 -54.6 -55.1 -18.6 44.5 27.8 62 66 A P H > S+ 0 0 77 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.872 113.6 47.5 -53.1 -40.1 -20.4 42.7 25.0 63 67 A E H > S+ 0 0 13 -3,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.931 116.3 43.4 -67.8 -49.5 -17.6 43.7 22.5 64 68 A F H X S+ 0 0 11 -4,-2.4 4,-3.3 2,-0.2 5,-0.2 0.949 113.5 51.9 -55.1 -55.3 -14.8 42.6 24.9 65 69 A L H X S+ 0 0 42 -4,-3.4 4,-2.1 1,-0.3 -1,-0.2 0.850 112.5 45.2 -52.4 -45.3 -16.6 39.4 25.8 66 70 A T H X S+ 0 0 63 -4,-1.8 4,-1.2 -5,-0.3 -1,-0.3 0.817 113.7 48.5 -74.4 -34.1 -17.0 38.5 22.1 67 71 A M H X S+ 0 0 52 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.956 114.6 48.0 -64.1 -51.8 -13.4 39.4 21.3 68 72 A M H X S+ 0 0 43 -4,-3.3 4,-1.0 2,-0.2 -2,-0.2 0.833 107.0 55.4 -55.0 -47.1 -12.3 37.3 24.3 69 73 A A H >X S+ 0 0 43 -4,-2.1 3,-2.3 2,-0.2 4,-1.1 0.987 110.9 42.2 -54.3 -72.9 -14.5 34.2 23.4 70 74 A R H >X S+ 0 0 158 -4,-1.2 4,-1.1 1,-0.3 3,-0.7 0.828 115.3 50.4 -38.8 -54.1 -13.1 33.7 19.9 71 75 A K H 3< S+ 0 0 117 -4,-2.0 4,-0.4 1,-0.2 -1,-0.3 0.643 100.6 62.6 -67.3 -18.3 -9.5 34.4 21.0 72 76 A M H << S+ 0 0 91 -3,-2.3 4,-0.4 -4,-1.0 3,-0.4 0.824 102.3 53.3 -77.8 -26.4 -9.7 31.9 23.9 73 77 A K H X< S+ 0 0 144 -4,-1.1 3,-0.8 -3,-0.7 4,-0.2 0.895 105.8 51.6 -66.9 -46.7 -10.3 29.1 21.2 74 78 A D T 3X S+ 0 0 111 -4,-1.1 4,-1.6 1,-0.2 -1,-0.2 0.520 107.6 51.9 -68.3 -14.6 -7.2 30.0 19.2 75 79 A T T 34 S+ 0 0 51 -4,-0.4 4,-0.3 -3,-0.4 -1,-0.2 0.514 106.1 54.3 -99.5 -11.5 -4.9 29.9 22.2 76 80 A D T <4 S+ 0 0 89 -3,-0.8 4,-0.3 -4,-0.4 -2,-0.2 0.425 112.2 47.4 -95.5 -8.9 -6.3 26.4 23.1 77 81 A S T >> S+ 0 0 60 -4,-0.2 4,-2.5 2,-0.2 3,-0.8 0.839 108.1 49.2 -93.6 -63.1 -5.3 25.5 19.5 78 82 A E H 3X S+ 0 0 68 -4,-1.6 4,-1.6 1,-0.3 -2,-0.1 0.773 112.7 54.3 -51.0 -27.3 -1.8 27.0 19.5 79 83 A E H 3> S+ 0 0 118 -4,-0.3 4,-1.0 2,-0.2 -1,-0.3 0.868 105.7 47.9 -81.1 -33.2 -1.4 25.0 22.7 80 84 A E H <> S+ 0 0 128 -3,-0.8 4,-2.1 -4,-0.3 3,-0.5 0.943 116.8 45.3 -67.5 -46.4 -2.4 21.6 21.3 81 85 A I H X S+ 0 0 34 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.832 108.0 56.3 -66.5 -35.2 -0.1 22.2 18.5 82 86 A R H X S+ 0 0 110 -4,-1.6 4,-0.9 -5,-0.3 -1,-0.2 0.743 108.8 51.6 -69.1 -21.0 2.7 23.4 20.8 83 87 A E H >X S+ 0 0 123 -4,-1.0 4,-1.4 -3,-0.5 3,-0.8 0.967 105.5 48.8 -74.3 -61.1 2.2 20.0 22.5 84 88 A A H >X S+ 0 0 36 -4,-2.1 4,-2.9 1,-0.3 3,-0.7 0.897 107.7 59.1 -48.4 -44.2 2.5 17.7 19.6 85 89 A F H 3X S+ 0 0 20 -4,-1.8 4,-3.1 1,-0.3 -1,-0.3 0.897 104.8 49.8 -51.9 -45.9 5.7 19.7 18.7 86 90 A R H << S+ 0 0 169 -4,-0.9 -1,-0.3 -3,-0.8 6,-0.3 0.771 110.3 47.7 -67.7 -33.9 7.2 18.7 22.0 87 91 A V H << S+ 0 0 101 -4,-1.4 3,-0.2 -3,-0.7 -2,-0.2 0.901 114.9 47.4 -76.8 -39.2 6.5 15.0 21.7 88 92 A F H < S+ 0 0 29 -4,-2.9 2,-2.4 1,-0.2 -2,-0.2 0.936 101.2 68.1 -63.4 -48.1 7.9 15.1 18.2 89 93 A D >< + 0 0 11 -4,-3.1 3,-2.3 -5,-0.2 -1,-0.2 -0.358 65.8 175.6 -75.8 64.0 11.0 17.0 19.3 90 94 A K T 3 S+ 0 0 156 -2,-2.4 -1,-0.2 1,-0.3 6,-0.1 0.645 75.9 45.3 -41.9 -33.7 12.5 14.2 21.4 91 95 A D T 3 S- 0 0 91 4,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 -0.045 100.8-128.9-105.5 28.9 15.7 16.1 22.2 92 96 A G < + 0 0 70 -3,-2.3 -2,-0.1 -6,-0.3 4,-0.1 0.759 68.3 130.6 23.1 56.9 14.1 19.4 23.1 93 97 A N S S- 0 0 75 2,-0.3 -1,-0.2 -4,-0.1 3,-0.1 0.460 80.8-105.0-112.1 -0.6 16.4 21.2 20.7 94 98 A G S S+ 0 0 34 -5,-0.2 40,-0.6 1,-0.2 2,-0.4 0.155 91.8 87.1 98.8 -12.5 13.8 23.2 18.8 95 99 A Y E -B 133 0B 90 38,-0.2 2,-0.8 39,-0.1 -2,-0.3 -0.964 65.2-143.0-127.9 139.2 13.9 21.0 15.7 96 100 A I E -B 132 0B 2 36,-3.6 36,-1.8 -2,-0.4 -7,-0.1 -0.883 29.6-169.6 -93.7 105.9 12.3 17.9 14.4 97 101 A S > - 0 0 29 -2,-0.8 4,-2.3 34,-0.2 5,-0.2 -0.291 37.7-100.1 -93.3 172.3 14.9 15.9 12.5 98 102 A A H > S+ 0 0 18 32,-0.3 4,-2.1 1,-0.2 5,-0.2 0.865 122.7 55.6 -59.4 -40.3 14.3 12.8 10.3 99 103 A A H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.878 110.7 46.6 -58.4 -43.8 15.5 10.4 13.1 100 104 A E H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.905 112.5 45.9 -68.9 -49.0 12.8 12.0 15.4 101 105 A L H X S+ 0 0 17 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.801 113.6 52.0 -64.9 -33.7 9.9 11.9 13.0 102 106 A R H X S+ 0 0 105 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.966 109.1 49.0 -68.9 -52.6 10.8 8.4 12.1 103 107 A H H X S+ 0 0 97 -4,-2.3 4,-1.4 1,-0.2 3,-0.5 0.957 117.6 39.5 -49.5 -61.2 10.9 7.2 15.8 104 108 A V H X S+ 0 0 15 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.857 110.3 59.6 -61.7 -32.1 7.5 8.8 16.6 105 109 A M H ><>S+ 0 0 41 -4,-1.9 5,-2.5 -5,-0.3 3,-0.6 0.892 104.3 52.6 -63.5 -32.2 6.0 7.7 13.2 106 110 A T H ><5S+ 0 0 60 -4,-2.0 3,-1.5 -3,-0.5 -1,-0.2 0.899 104.5 53.9 -70.5 -34.3 6.8 4.2 14.3 107 111 A N H 3<5S+ 0 0 113 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.613 103.2 57.9 -70.2 -18.8 4.9 4.6 17.6 108 112 A L T <<5S- 0 0 116 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.335 129.8 -99.3 -89.7 -0.8 1.9 5.8 15.6 109 113 A G T < 5S+ 0 0 61 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.524 88.9 114.1 93.1 16.3 2.0 2.4 13.8 110 114 A E < - 0 0 111 -5,-2.5 2,-0.9 -6,-0.2 -2,-0.2 -0.959 47.3-160.3-121.2 116.5 3.8 3.4 10.6 111 115 A K - 0 0 187 -2,-0.5 2,-0.3 -5,-0.1 -8,-0.1 -0.813 22.5-178.4 -99.3 103.4 7.3 2.0 9.8 112 116 A L - 0 0 28 -2,-0.9 -6,-0.1 -10,-0.2 2,-0.1 -0.843 24.5-120.6-100.5 140.9 8.6 4.4 7.2 113 117 A T > - 0 0 82 -2,-0.3 4,-1.7 1,-0.1 3,-0.5 -0.324 34.8-101.8 -79.2 169.3 12.1 4.1 5.5 114 118 A D H > S+ 0 0 88 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.759 123.6 56.7 -58.6 -30.5 14.6 6.9 5.8 115 119 A E H > S+ 0 0 149 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.830 104.7 48.3 -70.4 -41.0 13.5 7.9 2.2 116 120 A E H > S+ 0 0 92 -3,-0.5 4,-0.9 2,-0.2 -2,-0.2 0.844 113.8 47.6 -69.7 -32.8 9.8 8.3 3.0 117 121 A V H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.838 107.3 56.4 -74.2 -38.1 10.7 10.4 6.1 118 122 A D H X S+ 0 0 58 -4,-1.6 4,-2.7 1,-0.2 -1,-0.2 0.889 105.2 52.4 -57.4 -44.8 13.1 12.6 4.1 119 123 A E H X S+ 0 0 104 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.797 107.5 52.5 -63.1 -36.6 10.2 13.3 1.7 120 124 A M H X S+ 0 0 80 -4,-0.9 4,-1.1 2,-0.2 -2,-0.2 0.911 111.1 45.4 -65.4 -53.3 8.1 14.4 4.7 121 125 A I H >X S+ 0 0 5 -4,-2.4 4,-1.7 2,-0.2 3,-1.6 0.984 112.6 52.3 -53.8 -60.2 10.8 16.8 6.0 122 126 A R H >< S+ 0 0 169 -4,-2.7 3,-0.9 1,-0.3 -2,-0.2 0.880 104.1 55.6 -41.0 -61.3 11.4 18.2 2.5 123 127 A E H 3< S+ 0 0 145 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.786 120.6 30.4 -45.6 -36.0 7.7 19.0 1.9 124 128 A A H << S+ 0 0 8 -3,-1.6 2,-0.8 -4,-1.1 -1,-0.3 0.514 91.9 106.0-104.7 -10.1 7.6 21.1 5.0 125 129 A N << + 0 0 31 -4,-1.7 7,-0.1 -3,-0.9 -4,-0.0 -0.678 33.6 163.2 -81.6 106.9 11.1 22.5 5.2 126 130 A I S S+ 0 0 118 -2,-0.8 -1,-0.2 1,-0.1 6,-0.1 0.945 73.4 46.7 -86.8 -60.4 11.2 26.2 4.2 127 131 A D S S- 0 0 91 1,-0.1 -1,-0.1 4,-0.1 -2,-0.1 0.408 106.8-126.6 -67.5 3.0 14.5 27.6 5.5 128 132 A G + 0 0 57 -6,-0.1 -1,-0.1 1,-0.1 -3,-0.0 0.753 69.1 132.2 54.0 40.7 16.1 24.5 4.0 129 133 A D S S- 0 0 64 2,-0.4 3,-0.1 0, 0.0 -1,-0.1 0.523 76.2-116.4 -92.5 -2.9 18.0 23.2 7.0 130 134 A G S S+ 0 0 41 1,-0.3 -32,-0.3 -9,-0.1 2,-0.3 0.564 87.9 94.8 79.0 12.6 16.6 19.7 6.4 131 135 A Q S S- 0 0 56 -34,-0.1 2,-0.6 -10,-0.1 -2,-0.4 -0.864 74.2-124.3-131.3 160.3 14.8 20.0 9.8 132 136 A V E -B 96 0B 10 -36,-1.8 -36,-3.6 -2,-0.3 2,-0.2 -0.959 27.1-170.1-117.7 121.8 11.3 21.1 10.9 133 137 A N E > -B 95 0B 30 -2,-0.6 4,-3.7 -38,-0.2 -38,-0.2 -0.505 42.2 -92.2-100.1 174.2 11.0 23.9 13.3 134 138 A Y H > S+ 0 0 47 -40,-0.6 4,-2.8 1,-0.2 5,-0.2 0.899 126.1 51.6 -51.6 -48.5 7.9 25.1 15.2 135 139 A E H > S+ 0 0 131 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.944 114.0 41.7 -55.1 -54.9 7.2 27.6 12.4 136 140 A E H > S+ 0 0 4 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.941 113.5 57.3 -62.5 -40.5 7.4 25.0 9.6 137 141 A F H X S+ 0 0 10 -4,-3.7 4,-2.5 1,-0.2 3,-0.4 0.900 105.5 46.4 -55.0 -51.1 5.5 22.6 11.9 138 142 A V H X>S+ 0 0 33 -4,-2.8 4,-2.3 1,-0.3 5,-0.8 0.854 111.4 51.4 -63.0 -38.8 2.4 24.8 12.4 139 143 A Q H <5S+ 0 0 80 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.753 113.5 47.7 -67.7 -25.7 2.1 25.7 8.7 140 144 A M H <5S+ 0 0 81 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.838 117.5 40.3 -82.9 -37.3 2.3 21.9 8.1 141 145 A M H <5S+ 0 0 105 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.991 130.7 23.2 -68.9 -67.3 -0.3 21.1 10.8 142 146 A T T <5 0 0 91 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.1 0.865 360.0 360.0 -69.0 -51.5 -2.8 23.9 10.2 143 147 A A < 0 0 104 -5,-0.8 -3,-0.3 -4,-0.1 -4,-0.2 0.744 360.0 360.0-114.8 360.0 -2.1 24.8 6.6