==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN/DNA 08-JUN-07 2Z3X . COMPND 2 MOLECULE: SMALL, ACID-SOLUBLE SPORE PROTEIN C; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR K.S.LEE,M.J.JEDRZEJAS . 168 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11199.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 130 77.4 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 . 2 1.2 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 . 6 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 57.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 0 0 0 0 0 0 0 3 0 0 0 0 0 3 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 . 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 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 2 A A 0 0 149 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 35.4 -13.2 33.1 83.1 2 3 A K - 0 0 173 1,-0.1 2,-0.1 2,-0.0 3,-0.0 -0.486 360.0-141.0 -69.1 131.6 -11.2 30.7 85.2 3 4 A L - 0 0 48 -2,-0.2 4,-0.1 1,-0.1 -1,-0.1 -0.452 23.0-110.5 -88.8 165.6 -8.2 29.2 83.4 4 5 A L S S+ 0 0 74 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.928 119.4 25.3 -59.6 -44.4 -7.0 25.6 83.6 5 6 A I S > S- 0 0 17 1,-0.1 3,-2.8 2,-0.0 -1,-0.3 -0.805 71.8-175.5-121.9 87.0 -4.0 26.9 85.5 6 7 A P G > S+ 0 0 52 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.713 80.3 73.7 -55.6 -19.7 -5.0 30.3 87.1 7 8 A Q G 3 S+ 0 0 147 1,-0.3 3,-0.3 2,-0.1 4,-0.2 0.680 94.3 54.2 -67.2 -15.1 -1.4 30.6 88.3 8 9 A A G X> S+ 0 0 0 -3,-2.8 4,-2.7 1,-0.2 3,-0.9 0.480 74.3 108.5 -95.7 -5.5 -0.6 31.4 84.6 9 10 A A H <> S+ 0 0 41 -3,-1.4 4,-2.4 -4,-0.3 -1,-0.2 0.831 79.7 47.9 -37.8 -50.6 -3.2 34.2 84.4 10 11 A S H 3> S+ 0 0 76 -4,-0.3 4,-2.0 -3,-0.3 -1,-0.3 0.883 112.8 48.7 -63.5 -39.1 -0.6 36.9 84.3 11 12 A A H <> S+ 0 0 26 -3,-0.9 4,-1.7 2,-0.2 -2,-0.2 0.905 113.7 45.4 -68.9 -41.4 1.4 35.1 81.6 12 13 A I H X S+ 0 0 28 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.867 109.9 55.8 -72.4 -31.2 -1.7 34.5 79.4 13 14 A E H X S+ 0 0 88 -4,-2.4 4,-2.7 -5,-0.4 5,-0.2 0.949 108.2 46.6 -63.7 -47.4 -2.8 38.1 79.9 14 15 A Q H X S+ 0 0 97 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.862 112.6 51.9 -61.8 -34.6 0.5 39.4 78.6 15 16 A M H X S+ 0 0 24 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.932 109.3 50.1 -65.9 -43.2 0.2 36.9 75.7 16 17 A K H X S+ 0 0 79 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.927 112.8 44.9 -59.2 -50.2 -3.3 38.2 75.0 17 18 A L H X S+ 0 0 81 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.865 113.9 49.7 -64.3 -37.7 -2.2 41.9 75.0 18 19 A E H X S+ 0 0 98 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.855 112.0 47.5 -71.5 -35.6 0.8 41.1 72.8 19 20 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 6,-0.3 0.862 107.5 57.0 -72.0 -35.7 -1.3 39.2 70.3 20 21 A A H X>S+ 0 0 8 -4,-2.2 5,-1.5 -5,-0.2 4,-1.3 0.935 110.0 45.0 -60.3 -44.5 -3.8 41.9 70.2 21 22 A S H ><5S+ 0 0 87 -4,-1.8 3,-0.6 2,-0.2 -2,-0.2 0.950 112.3 49.9 -63.8 -49.8 -1.1 44.4 69.2 22 23 A E H 3<5S+ 0 0 104 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.817 115.7 45.3 -59.0 -29.5 0.4 42.0 66.6 23 24 A F H 3<5S- 0 0 88 -4,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.653 106.2-128.3 -88.2 -17.8 -3.1 41.5 65.2 24 25 A G T <<5 + 0 0 68 -4,-1.3 2,-0.3 -3,-0.6 -3,-0.2 0.596 63.1 135.6 80.3 9.1 -4.0 45.2 65.2 25 26 A V < - 0 0 26 -5,-1.5 2,-0.8 -6,-0.3 -1,-0.3 -0.721 49.8-144.2 -94.6 143.2 -7.2 44.5 67.1 26 27 A Q - 0 0 164 -2,-0.3 10,-0.1 -3,-0.1 9,-0.1 -0.887 23.6-130.8-107.0 102.3 -8.3 46.6 70.1 27 28 A L + 0 0 60 -2,-0.8 2,-0.3 8,-0.1 3,-0.1 -0.220 54.3 107.5 -51.8 130.3 -9.9 44.4 72.6 28 29 A G S > S- 0 0 34 4,-0.1 3,-1.7 1,-0.1 62,-0.4 -0.912 78.6 -86.2 168.4 165.0 -13.3 45.8 73.8 29 30 A A T 3 S+ 0 0 41 -2,-0.3 62,-1.9 1,-0.3 61,-0.5 0.867 121.4 51.6 -57.0 -38.9 -17.0 45.8 73.9 30 31 A E T 3 S+ 0 0 122 60,-0.2 -1,-0.3 59,-0.2 2,-0.3 0.391 90.4 97.1 -84.7 6.8 -17.2 47.9 70.8 31 32 A T S < S- 0 0 27 -3,-1.7 59,-2.2 1,-0.1 60,-0.2 -0.660 88.0 -94.9 -92.8 150.1 -15.0 45.6 68.8 32 33 A T B > -A 89 0A 37 -2,-0.3 4,-2.4 57,-0.3 57,-0.3 -0.279 29.0-121.3 -62.3 151.3 -16.5 43.0 66.5 33 34 A S H > S+ 0 0 37 55,-2.4 4,-2.6 52,-0.4 54,-0.2 0.816 113.2 56.8 -62.3 -30.1 -16.9 39.6 68.0 34 35 A R H > S+ 0 0 142 52,-2.3 4,-2.3 54,-0.2 -1,-0.2 0.940 107.8 44.8 -67.1 -48.7 -14.7 38.2 65.2 35 36 A A H > S+ 0 0 24 51,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.955 117.3 44.4 -60.6 -51.1 -11.8 40.6 65.9 36 37 A N H >X S+ 0 0 30 -4,-2.4 4,-1.1 1,-0.2 3,-0.7 0.941 113.5 53.2 -57.9 -46.7 -12.0 39.9 69.7 37 38 A G H 3X S+ 0 0 45 -4,-2.6 4,-1.7 -5,-0.2 3,-0.2 0.844 98.2 63.1 -58.2 -37.9 -12.4 36.2 69.0 38 39 A S H 3X S+ 0 0 43 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.872 98.5 55.2 -58.2 -38.8 -9.3 36.0 66.8 39 40 A V H X S+ 0 0 7 -4,-2.4 4,-3.1 1,-0.2 3,-0.6 0.901 115.2 49.0 -58.7 -42.6 3.5 19.8 71.3 53 54 A Q H 3< S+ 0 0 97 -4,-2.7 2,-2.6 1,-0.3 -2,-0.2 0.989 109.7 48.4 -61.0 -63.0 7.0 21.2 70.9 54 55 A N T 3< S+ 0 0 115 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.1 -0.303 125.1 32.0 -77.2 57.0 8.1 20.9 74.5 55 56 A M T <4 0 0 80 -2,-2.6 -1,-0.2 -3,-0.6 -2,-0.2 0.122 360.0 360.0-172.1 -48.4 6.8 17.3 74.6 56 57 A G < 0 0 38 -4,-3.1 -2,-0.1 -5,-0.2 67,-0.1 -0.426 360.0 360.0-136.1 360.0 7.3 15.7 71.2 57 !* 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 58 2 B A 0 0 147 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -16.4 -22.8 26.6 72.8 59 3 B K - 0 0 149 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.203 360.0-139.0 -46.7 104.9 -24.2 23.4 74.2 60 4 B L - 0 0 61 -2,-0.2 4,-0.1 1,-0.1 -1,-0.1 -0.120 23.4-104.1 -62.3 164.1 -27.1 24.7 76.4 61 5 B L S S+ 0 0 154 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.910 121.0 28.9 -56.9 -42.0 -27.8 23.3 79.8 62 6 B I S > S- 0 0 95 1,-0.1 3,-2.4 2,-0.0 -1,-0.3 -0.880 72.5-167.7-122.6 97.6 -30.7 21.5 78.1 63 7 B P G > S+ 0 0 55 0, 0.0 3,-2.6 0, 0.0 4,-0.2 0.828 85.3 68.4 -52.3 -35.5 -30.0 20.8 74.4 64 8 B Q G 3 S+ 0 0 162 1,-0.3 3,-0.4 2,-0.1 4,-0.3 0.695 92.2 61.7 -58.8 -18.4 -33.7 19.9 73.8 65 9 B A G <> S+ 0 0 32 -3,-2.4 4,-2.8 1,-0.2 3,-0.4 0.547 73.1 104.6 -85.2 -6.5 -34.4 23.5 74.4 66 10 B A H <> S+ 0 0 46 -3,-2.6 4,-2.5 1,-0.3 -1,-0.2 0.866 80.0 46.7 -37.7 -57.1 -32.3 24.5 71.4 67 11 B S H > S+ 0 0 85 -3,-0.4 4,-1.8 -4,-0.2 -1,-0.3 0.897 114.6 46.3 -57.8 -44.9 -35.3 25.2 69.2 68 12 B A H > S+ 0 0 66 -3,-0.4 4,-2.3 -4,-0.3 -2,-0.2 0.927 114.3 45.2 -67.2 -45.7 -37.1 27.3 71.9 69 13 B I H X S+ 0 0 34 -4,-2.8 4,-3.1 1,-0.2 -1,-0.2 0.898 109.2 60.2 -64.8 -35.3 -34.1 29.4 72.9 70 14 B E H X S+ 0 0 67 -4,-2.5 4,-2.2 -5,-0.4 -1,-0.2 0.923 107.7 43.0 -56.0 -47.4 -33.4 29.8 69.1 71 15 B Q H X S+ 0 0 105 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.921 113.5 50.6 -67.7 -43.3 -36.8 31.4 68.6 72 16 B M H X S+ 0 0 38 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.922 109.7 52.9 -58.8 -43.3 -36.5 33.6 71.7 73 17 B K H X S+ 0 0 63 -4,-3.1 4,-2.7 2,-0.2 -2,-0.2 0.941 111.2 44.9 -57.7 -50.3 -33.1 34.7 70.5 74 18 B L H X S+ 0 0 84 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.938 113.3 50.0 -61.5 -46.1 -34.4 35.7 67.1 75 19 B E H X S+ 0 0 68 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.887 112.9 47.4 -61.4 -37.0 -37.4 37.5 68.6 76 20 B I H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 6,-0.2 0.900 108.4 54.4 -70.7 -40.2 -35.1 39.4 71.0 77 21 B A H X>S+ 0 0 10 -4,-2.7 5,-2.2 -5,-0.2 4,-1.5 0.943 110.0 48.2 -58.2 -46.5 -32.7 40.3 68.2 78 22 B S H <5S+ 0 0 82 -4,-2.5 3,-0.4 2,-0.2 -2,-0.2 0.934 110.8 48.9 -59.5 -49.3 -35.6 41.8 66.3 79 23 B E H <5S+ 0 0 119 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.888 116.3 44.5 -58.0 -39.6 -36.9 43.8 69.3 80 24 B F H <5S- 0 0 82 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.690 106.6-128.8 -79.6 -17.6 -33.4 45.1 69.9 81 25 B G T <5 + 0 0 69 -4,-1.5 2,-0.4 -3,-0.4 -3,-0.2 0.785 59.9 144.2 74.5 25.1 -32.8 45.8 66.2 82 26 B V < - 0 0 30 -5,-2.2 2,-0.7 -6,-0.2 -1,-0.3 -0.840 45.2-147.0-103.1 134.8 -29.6 43.8 66.5 83 27 B Q - 0 0 162 -2,-0.4 2,-0.2 -3,-0.1 10,-0.1 -0.890 22.7-134.0 -99.5 113.9 -28.3 41.7 63.6 84 28 B L + 0 0 56 -2,-0.7 2,-0.3 9,-0.1 3,-0.1 -0.476 50.1 112.9 -68.4 130.7 -26.4 38.7 65.1 85 29 B G S > S- 0 0 31 -2,-0.2 3,-1.8 4,-0.2 -52,-0.4 -0.933 75.4 -90.5 173.4 163.2 -23.1 38.0 63.5 86 30 B A T 3 S+ 0 0 36 1,-0.3 -52,-2.3 -2,-0.3 -51,-0.3 0.845 123.0 48.9 -55.3 -37.9 -19.3 37.8 63.5 87 31 B E T 3 S+ 0 0 120 -54,-0.2 2,-0.3 -55,-0.2 -1,-0.3 0.397 92.0 98.8 -86.3 3.6 -19.0 41.4 62.3 88 32 B T S < S- 0 0 28 -3,-1.8 -55,-2.4 1,-0.1 -54,-0.2 -0.666 88.1 -95.0 -88.5 147.3 -21.4 42.6 64.9 89 33 B T B > -A 32 0A 36 -2,-0.3 4,-2.5 -57,-0.3 -57,-0.3 -0.205 26.5-122.0 -58.1 152.6 -19.9 44.2 68.0 90 34 B S H > S+ 0 0 42 -59,-2.2 4,-2.5 -61,-0.5 -60,-0.2 0.813 114.0 54.6 -65.6 -29.8 -19.5 42.0 71.1 91 35 B R H > S+ 0 0 147 -62,-1.9 4,-2.6 -60,-0.2 -1,-0.2 0.941 109.7 44.1 -69.5 -48.2 -21.7 44.4 73.0 92 36 B A H > S+ 0 0 23 -63,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.928 118.2 44.8 -63.0 -44.9 -24.6 44.2 70.5 93 37 B N H >X S+ 0 0 35 -4,-2.5 4,-1.0 1,-0.2 3,-0.5 0.929 115.2 48.8 -63.8 -45.3 -24.3 40.4 70.2 94 38 B G H 3X S+ 0 0 42 -4,-2.5 4,-1.9 -5,-0.2 3,-0.4 0.855 97.7 68.3 -64.1 -36.5 -23.9 40.1 74.0 95 39 B S H 3X S+ 0 0 44 -4,-2.6 4,-1.6 1,-0.3 -1,-0.2 0.870 99.4 52.0 -51.1 -40.3 -27.0 42.3 74.7 96 40 B V H < S+ 0 0 120 -4,-1.8 3,-0.6 1,-0.2 -1,-0.2 0.819 113.4 47.3 -70.5 -30.7 -39.1 32.2 89.3 110 54 B Q H >< S+ 0 0 120 -4,-1.9 3,-2.2 1,-0.2 2,-0.9 0.972 109.8 48.7 -74.3 -55.0 -42.7 32.3 88.2 111 55 B N T 3< S+ 0 0 142 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.018 110.6 57.3 -76.1 34.3 -43.2 28.6 87.5 112 56 B M T < 0 0 147 -2,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.356 360.0 360.0-138.0 -10.0 -41.7 28.1 91.0 113 57 B G < 0 0 106 -3,-2.2 -4,-0.1 -4,-0.2 -2,-0.0 -0.556 360.0 360.0 98.3 360.0 -44.0 30.2 93.0 114 !* 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 2 C A 0 0 145 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 29.4 -5.6 15.8 61.0 116 3 C K - 0 0 179 1,-0.1 2,-0.2 2,-0.0 3,-0.0 -0.204 360.0-141.9 -58.7 150.1 -2.2 17.5 60.5 117 4 C L - 0 0 42 1,-0.1 -1,-0.1 -65,-0.0 4,-0.1 -0.596 23.1-113.1-111.6 172.6 -0.6 19.1 63.6 118 5 C L S S+ 0 0 63 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 0.931 117.8 28.0 -68.1 -43.6 1.3 22.3 64.2 119 6 C I S > S- 0 0 17 1,-0.1 3,-2.1 -3,-0.0 -1,-0.3 -0.902 70.2-169.1-120.7 100.6 4.3 20.1 64.9 120 7 C P G > S+ 0 0 63 0, 0.0 3,-2.7 0, 0.0 4,-0.3 0.819 84.5 71.8 -57.4 -30.8 4.2 16.8 63.0 121 8 C Q G 3 S+ 0 0 140 1,-0.3 3,-0.5 2,-0.1 4,-0.3 0.681 89.3 63.3 -59.0 -16.3 7.1 15.5 65.1 122 9 C A G <> S+ 0 0 0 -3,-2.1 4,-2.0 1,-0.2 5,-0.4 0.461 70.2 102.2 -87.7 -2.2 4.6 15.3 67.9 123 10 C A H <> S+ 0 0 54 -3,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.889 83.6 47.8 -46.4 -46.3 2.5 12.7 66.1 124 11 C S H > S+ 0 0 82 -3,-0.5 4,-1.5 -4,-0.3 -1,-0.2 0.941 111.0 51.2 -61.2 -50.4 4.0 10.0 68.3 125 12 C A H >> S+ 0 0 21 -4,-0.3 4,-1.9 1,-0.2 3,-1.3 0.968 113.3 40.2 -52.2 -68.1 3.4 12.0 71.5 126 13 C I H 3X S+ 0 0 29 -4,-2.0 4,-3.5 1,-0.3 -1,-0.2 0.874 108.1 65.6 -51.3 -39.9 -0.3 12.7 71.0 127 14 C E H 3X S+ 0 0 72 -4,-1.8 4,-1.7 -5,-0.4 -1,-0.3 0.874 105.3 43.7 -50.7 -40.5 -0.7 9.2 69.6 128 15 C Q H S+ 0 0 12 -4,-2.5 5,-2.1 1,-0.2 4,-1.3 0.959 107.0 37.9 -49.4 -62.8 -9.7 6.7 74.9 135 22 C S H <5S+ 0 0 84 -4,-1.8 -1,-0.2 3,-0.2 -2,-0.2 0.850 110.8 62.9 -60.1 -35.0 -9.7 3.9 77.5 136 23 C E H <5S+ 0 0 101 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.934 115.8 29.6 -56.5 -48.4 -10.1 6.4 80.3 137 24 C F H <5S- 0 0 120 -4,-2.4 -1,-0.3 -3,-0.3 -2,-0.2 0.563 115.0-119.9 -86.5 -10.1 -13.5 7.5 79.0 138 25 C G T <5 + 0 0 64 -4,-1.3 2,-0.4 -5,-0.3 -3,-0.2 0.974 59.6 149.1 69.9 56.2 -14.1 4.0 77.5 139 26 C V < - 0 0 23 -5,-2.1 2,-0.8 -6,-0.1 -1,-0.2 -0.955 43.9-142.8-126.3 143.4 -14.4 5.0 73.9 140 27 C Q - 0 0 147 -2,-0.4 2,-1.1 2,-0.1 10,-0.1 -0.854 20.7-139.0-106.2 99.1 -13.5 3.2 70.7 141 28 C L + 0 0 72 -2,-0.8 2,-0.3 8,-0.1 -7,-0.0 -0.386 55.4 123.9 -60.1 95.4 -12.1 5.7 68.1 142 29 C G S > S- 0 0 24 -2,-1.1 3,-3.0 4,-0.2 8,-0.1 -0.990 75.0-114.7-156.8 149.0 -13.8 4.5 65.0 143 30 C A T 3 S+ 0 0 111 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.0 0.668 116.1 65.4 -56.4 -16.1 -16.1 5.7 62.2 144 31 C E T 3 S+ 0 0 191 -4,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.385 92.5 83.2 -87.7 4.1 -18.6 3.2 63.6 145 32 C T S < S- 0 0 38 -3,-3.0 -6,-0.0 1,-0.1 -4,-0.0 -0.687 87.8 -94.9-106.8 161.2 -18.7 5.3 66.8 146 33 C T > - 0 0 92 -2,-0.2 4,-2.0 1,-0.1 -4,-0.2 -0.084 27.4-119.3 -67.1 169.7 -20.8 8.5 67.6 147 34 C S H > S+ 0 0 108 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.910 114.4 57.2 -76.6 -44.3 -19.4 12.0 67.3 148 35 C R H 4 S+ 0 0 216 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.664 112.5 46.4 -60.7 -13.6 -19.8 12.8 71.0 149 36 C A H > S+ 0 0 18 2,-0.2 4,-0.8 3,-0.1 -2,-0.2 0.888 115.3 39.5 -93.3 -52.7 -17.6 9.8 71.5 150 37 C N H X S+ 0 0 48 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.778 119.7 50.2 -68.2 -26.1 -14.8 10.4 68.9 151 38 C G H X S+ 0 0 45 -4,-3.0 4,-2.0 2,-0.2 -1,-0.2 0.821 96.3 65.9 -81.7 -33.1 -14.9 14.1 69.8 152 39 C S H > S+ 0 0 42 -4,-0.5 4,-1.4 -5,-0.3 -1,-0.2 0.827 102.5 52.4 -57.5 -31.5 -14.7 13.7 73.6 153 40 C V H >X S+ 0 0 3 -4,-0.8 4,-2.2 2,-0.2 3,-0.6 0.972 108.3 45.9 -69.0 -57.1 -11.2 12.3 73.0 154 41 C G H 3X S+ 0 0 34 -4,-1.1 4,-1.9 1,-0.3 -2,-0.2 0.792 110.0 59.5 -56.8 -26.6 -9.9 15.2 70.9 155 42 C G H 3X S+ 0 0 44 -4,-2.0 4,-2.1 2,-0.2 -1,-0.3 0.897 107.0 43.2 -69.2 -41.2 -11.5 17.4 73.5 156 43 C E H X S+ 0 0 49 -4,-2.7 4,-2.0 2,-0.2 3,-0.7 0.945 111.4 49.4 -67.5 -47.6 0.6 21.7 80.1 165 52 C A H 3< S+ 0 0 5 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.885 109.8 51.9 -59.4 -38.7 1.5 24.8 78.1 166 53 C Q H >X S+ 0 0 10 -4,-2.8 4,-0.8 1,-0.2 3,-0.7 0.753 107.6 55.0 -69.1 -22.3 -0.1 27.0 80.8 167 54 C Q H << S+ 0 0 91 -4,-0.9 3,-0.5 -3,-0.7 2,-0.4 0.902 102.1 54.2 -76.2 -42.3 2.1 25.1 83.3 168 55 C N T 3< S+ 0 0 105 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.1 -0.064 115.0 41.7 -84.1 35.7 5.4 25.8 81.5 169 56 C M T <4 0 0 71 -3,-0.7 -1,-0.2 -2,-0.4 -2,-0.2 0.357 360.0 360.0-149.5 -20.6 4.6 29.6 81.6 170 57 C G < 0 0 71 -4,-0.8 -162,-0.1 -3,-0.5 -161,-0.1 -0.412 360.0 360.0 -71.1 360.0 3.2 30.1 85.1