==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 12-FEB-03 1O20 . COMPND 2 MOLECULE: GAMMA-GLUTAMYL PHOSPHATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 414 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19826.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 299 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 4.6 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 . 1 0.2 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 . 30 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 2 1 0 0 2 1 1 1 0 1 2 3 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 5 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 PARALLEL BRIDGES PER LADDER . 0 1 0 0 1 0 0 1 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 1 0 1 0 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 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 0 151 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 94.2 -14.2 38.9 46.4 2 3 A E H > + 0 0 55 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.907 360.0 53.0 -61.5 -47.2 -12.8 36.8 49.3 3 4 A L H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.933 111.6 43.9 -56.2 -49.2 -10.9 39.7 50.8 4 5 A L H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.930 113.7 49.4 -67.2 -43.0 -13.8 42.1 50.9 5 6 A E H X S+ 0 0 64 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.915 115.0 44.9 -63.4 -40.3 -16.3 39.6 52.2 6 7 A K H X S+ 0 0 38 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.840 111.2 52.6 -75.7 -31.6 -13.9 38.5 55.0 7 8 A A H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.3 -2,-0.2 0.908 110.1 49.2 -68.0 -36.9 -12.9 42.1 55.9 8 9 A K H X S+ 0 0 98 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.922 110.3 52.9 -66.7 -40.2 -16.6 42.9 56.2 9 10 A K H X S+ 0 0 90 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.899 108.6 46.3 -64.4 -42.8 -17.1 39.9 58.4 10 11 A V H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.844 112.8 51.9 -70.8 -31.7 -14.3 40.7 60.9 11 12 A R H X S+ 0 0 93 -4,-1.7 4,-0.8 2,-0.2 -2,-0.2 0.928 111.8 45.3 -67.3 -43.8 -15.5 44.2 61.1 12 13 A E H >X S+ 0 0 136 -4,-2.6 3,-0.8 1,-0.2 4,-0.5 0.914 112.7 51.0 -66.7 -42.8 -19.1 43.1 61.9 13 14 A A H >X S+ 0 0 5 -4,-2.4 4,-2.4 159,-0.3 3,-1.2 0.844 98.9 66.7 -63.5 -33.2 -17.9 40.5 64.4 14 15 A W H 3X S+ 0 0 33 -4,-1.5 4,-2.7 1,-0.3 -1,-0.2 0.833 87.7 67.2 -55.7 -36.2 -15.8 43.2 66.1 15 16 A D H << S+ 0 0 89 -4,-0.8 -1,-0.3 -3,-0.8 4,-0.2 0.854 111.3 34.9 -54.7 -35.7 -19.1 44.9 67.2 16 17 A V H X< S+ 0 0 75 -3,-1.2 3,-1.2 -4,-0.5 4,-0.4 0.918 118.2 49.2 -80.7 -51.0 -19.7 41.9 69.4 17 18 A L H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.879 98.9 66.1 -61.0 -38.6 -16.1 41.0 70.5 18 19 A R T 3< S+ 0 0 82 -4,-2.7 -1,-0.2 1,-0.3 -3,-0.1 0.738 110.2 38.0 -61.3 -21.9 -15.1 44.6 71.6 19 20 A N T < S+ 0 0 114 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.327 87.2 121.7-113.0 6.7 -17.7 44.4 74.4 20 21 A A < - 0 0 23 -3,-1.9 2,-0.1 -4,-0.4 -3,-0.0 -0.387 67.2-112.1 -62.7 143.0 -17.3 40.8 75.5 21 22 A T > - 0 0 90 1,-0.1 4,-2.1 -2,-0.1 3,-0.2 -0.381 24.7-112.9 -69.9 158.3 -16.3 40.2 79.1 22 23 A T H > S+ 0 0 46 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.864 117.6 62.4 -59.4 -35.9 -12.8 38.9 79.7 23 24 A R H > S+ 0 0 212 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.930 106.3 43.4 -55.5 -47.2 -14.5 35.7 81.0 24 25 A E H > S+ 0 0 28 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 115.2 48.5 -66.1 -39.4 -16.1 35.1 77.6 25 26 A K H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.917 112.5 48.6 -69.3 -42.3 -12.8 35.9 75.7 26 27 A N H X S+ 0 0 40 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.846 109.1 53.8 -61.2 -38.7 -10.8 33.6 78.1 27 28 A K H X S+ 0 0 96 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.940 108.9 48.9 -61.6 -46.8 -13.4 30.8 77.5 28 29 A A H X S+ 0 0 1 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.899 112.7 47.5 -57.0 -44.0 -12.9 31.2 73.7 29 30 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.857 110.9 51.1 -70.8 -36.2 -9.1 31.0 74.2 30 31 A K H X S+ 0 0 95 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.911 110.9 48.3 -64.1 -46.1 -9.4 28.0 76.4 31 32 A K H X S+ 0 0 38 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.816 106.6 57.2 -62.0 -35.5 -11.5 26.3 73.8 32 33 A I H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.956 107.9 47.6 -57.5 -51.3 -9.0 27.3 71.2 33 34 A A H X S+ 0 0 7 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.910 113.5 48.7 -52.4 -44.0 -6.4 25.4 73.3 34 35 A E H X S+ 0 0 76 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.907 111.3 47.4 -67.6 -42.1 -8.8 22.4 73.6 35 36 A K H X S+ 0 0 20 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.880 110.2 52.7 -71.6 -36.4 -9.6 22.2 69.9 36 37 A L H < S+ 0 0 0 -4,-2.6 3,-0.3 2,-0.2 -1,-0.2 0.940 111.3 48.2 -59.5 -45.8 -5.9 22.4 68.9 37 38 A D H >< S+ 0 0 86 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.941 115.6 43.9 -57.4 -49.7 -5.3 19.5 71.3 38 39 A E H 3< S+ 0 0 107 -4,-2.7 3,-0.3 1,-0.2 -1,-0.2 0.696 113.8 49.6 -67.3 -27.1 -8.2 17.6 69.8 39 40 A R T 3X S+ 0 0 82 -4,-1.8 4,-2.8 -3,-0.3 5,-0.3 0.113 71.0 119.0-106.6 21.3 -7.4 18.4 66.1 40 41 A R H <> S+ 0 0 39 -3,-1.0 4,-2.9 1,-0.2 5,-0.2 0.890 75.2 51.8 -47.7 -51.6 -3.7 17.4 66.3 41 42 A K H > S+ 0 0 173 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.920 112.0 44.4 -55.0 -52.7 -4.2 14.7 63.7 42 43 A E H > S+ 0 0 93 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.913 115.1 48.9 -60.6 -44.4 -5.8 17.0 61.2 43 44 A I H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.906 113.4 46.3 -66.0 -41.8 -3.3 19.8 61.8 44 45 A L H X S+ 0 0 44 -4,-2.9 4,-1.8 -5,-0.3 -1,-0.2 0.860 111.5 51.3 -72.2 -33.9 -0.3 17.4 61.4 45 46 A E H X S+ 0 0 96 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.897 112.0 47.1 -66.8 -43.5 -1.7 15.8 58.3 46 47 A A H X S+ 0 0 15 -4,-2.3 4,-1.9 1,-0.2 106,-0.4 0.924 113.3 49.2 -59.1 -43.8 -2.3 19.2 56.7 47 48 A N H X S+ 0 0 7 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.820 102.1 61.5 -68.5 -29.0 1.3 20.1 57.8 48 49 A R H X S+ 0 0 137 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.887 105.2 49.8 -64.5 -35.7 2.7 16.9 56.3 49 50 A I H X S+ 0 0 58 -4,-1.3 4,-2.3 -3,-0.3 -2,-0.2 0.953 110.8 47.1 -67.3 -49.1 1.4 18.2 52.9 50 51 A D H X S+ 0 0 3 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.909 114.8 47.6 -55.3 -46.6 3.0 21.6 53.3 51 52 A V H X S+ 0 0 15 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.913 112.0 47.7 -64.3 -43.5 6.3 20.0 54.4 52 53 A E H X S+ 0 0 39 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.880 111.8 52.4 -70.1 -32.7 6.4 17.4 51.5 53 54 A K H X S+ 0 0 130 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.907 109.6 48.0 -68.1 -41.1 5.6 20.2 49.1 54 55 A A H <>S+ 0 0 2 -4,-2.3 5,-2.5 2,-0.2 -2,-0.2 0.879 112.3 49.0 -66.4 -37.4 8.5 22.4 50.4 55 56 A R H ><5S+ 0 0 130 -4,-2.0 3,-2.4 3,-0.2 -2,-0.2 0.944 105.5 57.3 -69.0 -46.3 10.9 19.4 50.2 56 57 A E H 3<5S+ 0 0 163 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.868 107.6 49.4 -45.6 -43.4 9.8 18.6 46.6 57 58 A R T 3<5S- 0 0 147 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.278 117.7-115.2 -80.7 6.9 10.8 22.2 45.7 58 59 A G T < 5 + 0 0 63 -3,-2.4 2,-0.2 1,-0.2 -3,-0.2 0.799 49.9 171.8 62.4 31.5 14.2 21.8 47.4 59 60 A V < - 0 0 30 -5,-2.5 -1,-0.2 1,-0.1 5,-0.1 -0.566 43.1-104.8 -66.8 137.4 13.6 24.4 50.1 60 61 A K >> - 0 0 136 -2,-0.2 3,-2.1 1,-0.1 4,-1.6 -0.369 26.4-114.4 -75.5 150.7 16.5 24.1 52.4 61 62 A E H 3> S+ 0 0 98 1,-0.3 4,-2.3 2,-0.2 -1,-0.1 0.666 110.7 63.9 -63.0 -24.9 15.8 22.3 55.7 62 63 A S H 34 S+ 0 0 62 2,-0.2 4,-0.4 1,-0.2 -1,-0.3 0.781 110.9 40.5 -67.7 -24.7 16.4 25.3 58.0 63 64 A L H <> S+ 0 0 68 -3,-2.1 4,-0.8 2,-0.2 3,-0.4 0.797 110.6 56.1 -92.0 -33.9 13.4 27.0 56.3 64 65 A V H >X S+ 0 0 1 -4,-1.6 4,-2.0 1,-0.2 3,-1.3 0.924 102.3 59.5 -57.6 -43.4 11.3 23.8 56.2 65 66 A D H 3< S+ 0 0 82 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.784 98.3 57.0 -56.5 -33.9 11.9 23.7 59.9 66 67 A R H 34 S+ 0 0 119 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.2 0.788 114.4 39.7 -62.7 -31.4 10.2 27.1 60.3 67 68 A L H << S+ 0 0 4 -3,-1.3 -2,-0.2 -4,-0.8 -1,-0.2 0.745 95.6 103.6 -90.6 -24.6 7.1 25.6 58.6 68 69 A A < - 0 0 21 -4,-2.0 2,-0.3 -5,-0.1 -20,-0.1 -0.229 48.8-166.6 -74.2 140.1 7.2 22.2 60.2 69 70 A L + 0 0 18 -25,-0.1 2,-0.3 -26,-0.1 -2,-0.0 -0.878 14.3 158.7-118.1 157.3 4.8 21.2 63.0 70 71 A N > - 0 0 66 -2,-0.3 4,-2.0 1,-0.0 3,-0.4 -0.902 58.2 -76.2-156.4-176.4 4.7 18.3 65.5 71 72 A D H > S+ 0 0 85 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.862 126.6 52.9 -57.3 -41.3 3.1 17.6 68.9 72 73 A K H > S+ 0 0 150 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.853 109.3 48.6 -64.3 -38.9 5.6 19.7 70.9 73 74 A R H > S+ 0 0 65 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.869 109.9 51.0 -72.9 -35.0 5.0 22.7 68.7 74 75 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.916 108.1 54.7 -64.6 -38.0 1.2 22.2 69.0 75 76 A D H X S+ 0 0 62 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.871 103.9 53.9 -58.4 -37.9 1.9 22.1 72.8 76 77 A E H X S+ 0 0 125 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.880 107.6 50.9 -64.8 -39.5 3.7 25.5 72.5 77 78 A X H X S+ 0 0 2 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.908 111.4 48.5 -61.4 -40.7 0.6 26.9 70.8 78 79 A I H X S+ 0 0 21 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.925 110.3 49.6 -65.4 -47.6 -1.5 25.5 73.7 79 80 A K H X S+ 0 0 141 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.860 106.6 57.0 -56.8 -41.6 0.9 27.0 76.4 80 81 A A H X S+ 0 0 22 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.934 105.9 50.6 -57.5 -44.5 0.6 30.3 74.5 81 82 A C H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.924 110.4 49.0 -54.9 -45.7 -3.2 30.2 75.0 82 83 A E H X S+ 0 0 101 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.894 110.4 51.2 -67.5 -37.0 -2.7 29.5 78.7 83 84 A T H X S+ 0 0 47 -4,-2.6 4,-0.8 2,-0.2 -2,-0.2 0.965 112.0 46.2 -62.1 -48.6 -0.2 32.4 79.0 84 85 A V H >< S+ 0 0 1 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.895 107.7 56.6 -64.0 -42.9 -2.7 34.8 77.4 85 86 A I H 3< S+ 0 0 41 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.895 108.0 49.8 -54.3 -41.5 -5.6 33.6 79.5 86 87 A G H 3< S+ 0 0 65 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.658 91.7 97.6 -74.9 -15.2 -3.6 34.5 82.6 87 88 A L S << S- 0 0 40 -3,-1.0 2,-0.2 -4,-0.8 290,-0.0 -0.373 85.2-100.5 -72.6 150.3 -2.7 38.0 81.4 88 89 A K - 0 0 78 1,-0.1 -1,-0.1 -2,-0.1 -2,-0.1 -0.508 34.8-118.1 -71.0 136.2 -4.7 41.1 82.6 89 90 A D - 0 0 22 -2,-0.2 48,-0.1 1,-0.2 -1,-0.1 -0.660 19.1-159.3 -72.0 121.3 -7.2 42.3 80.1 90 91 A P > + 0 0 3 0, 0.0 3,-2.0 0, 0.0 20,-0.3 0.724 60.0 108.5 -76.3 -17.8 -6.2 45.9 79.2 91 92 A V T 3 S+ 0 0 37 1,-0.3 20,-0.2 45,-0.2 3,-0.1 -0.386 86.0 13.2 -65.3 132.2 -9.8 46.6 78.0 92 93 A G T 3 S+ 0 0 45 18,-3.0 -1,-0.3 1,-0.3 2,-0.1 0.336 88.4 143.2 82.6 -7.1 -11.6 49.0 80.3 93 94 A E < - 0 0 59 -3,-2.0 17,-2.5 16,-0.1 2,-0.6 -0.432 51.6-126.8 -63.6 139.5 -8.5 50.0 82.3 94 95 A V E -A 109 0A 87 15,-0.2 15,-0.3 1,-0.2 3,-0.1 -0.786 18.7-168.5 -86.2 123.0 -8.5 53.6 83.4 95 96 A I E S- 0 0 62 13,-2.7 2,-0.3 -2,-0.6 -1,-0.2 0.938 73.3 -31.2 -69.9 -52.0 -5.4 55.4 82.2 96 97 A D E -A 108 0A 52 12,-0.9 12,-2.7 -3,-0.1 -1,-0.4 -0.975 60.6-172.9-158.6 164.7 -6.3 58.3 84.4 97 98 A S E +A 107 0A 44 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.917 8.7 167.1-163.2 142.5 -9.4 60.1 85.7 98 99 A W E -A 106 0A 103 8,-2.3 8,-2.9 -2,-0.3 2,-0.5 -0.924 33.4-113.8-149.8 169.1 -10.1 63.3 87.7 99 100 A V E -A 105 0A 77 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.958 32.7-135.6-110.2 124.4 -12.9 65.6 88.7 100 101 A R > - 0 0 106 4,-2.8 3,-2.2 -2,-0.5 0, 0.0 -0.219 34.7 -93.2 -70.1 172.7 -12.7 69.2 87.3 101 102 A E T 3 S+ 0 0 187 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.726 126.6 51.1 -61.6 -25.9 -13.3 72.3 89.5 102 103 A D T 3 S- 0 0 54 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.208 123.3-100.0 -93.7 9.9 -17.0 72.2 88.5 103 104 A G S < S+ 0 0 39 -3,-2.2 2,-0.4 1,-0.3 -2,-0.1 0.406 72.9 145.0 94.9 -6.7 -17.6 68.6 89.4 104 105 A L - 0 0 23 -5,-0.1 -4,-2.8 304,-0.1 2,-0.4 -0.526 42.9-140.3 -69.2 120.5 -17.4 67.2 85.9 105 106 A R E -AB 99 407A 100 302,-2.7 302,-2.2 -2,-0.4 2,-0.4 -0.756 20.8-173.5 -82.3 131.5 -15.7 63.7 86.0 106 107 A I E +AB 98 406A 24 -8,-2.9 -8,-2.3 -2,-0.4 2,-0.3 -0.982 6.2 172.6-123.4 135.4 -13.3 62.9 83.1 107 108 A A E -AB 97 405A 9 298,-2.1 298,-2.7 -2,-0.4 2,-0.5 -0.998 27.6-142.5-138.9 151.1 -11.6 59.6 82.5 108 109 A R E -AB 96 404A 74 -12,-2.7 -13,-2.7 -2,-0.3 -12,-0.9 -0.965 29.3-174.6-110.3 125.7 -9.5 58.1 79.8 109 110 A V E -AB 94 403A 25 294,-2.9 294,-1.7 -2,-0.5 -15,-0.2 -0.970 23.5-117.5-129.1 133.2 -10.4 54.4 79.4 110 111 A R E + B 0 402A 46 -17,-2.5 -18,-3.0 -2,-0.4 292,-0.3 -0.480 35.2 172.4 -73.8 135.5 -8.8 51.8 77.2 111 112 A V E - B 0 401A 30 290,-1.9 290,-2.6 -20,-0.2 -92,-0.1 -0.909 40.6 -78.8-136.1 158.5 -10.8 50.2 74.4 112 113 A P E - B 0 400A 10 0, 0.0 288,-0.2 0, 0.0 26,-0.1 -0.252 30.3-133.8 -58.3 146.3 -9.8 47.8 71.5 113 114 A I - 0 0 27 286,-1.7 287,-0.1 1,-0.2 26,-0.1 0.859 50.6-113.8 -66.8 -31.6 -8.1 49.2 68.5 114 115 A G - 0 0 0 285,-0.3 -1,-0.2 26,-0.1 81,-0.1 -0.788 60.8 -9.0 120.6-175.4 -10.4 47.3 66.0 115 116 A P - 0 0 0 0, 0.0 81,-2.7 0, 0.0 82,-1.1 -0.354 65.1-148.8 -62.0 134.4 -9.9 44.5 63.5 116 117 A I E -cd 141 197B 1 24,-2.6 26,-2.7 79,-0.2 2,-0.5 -0.936 4.4-149.3-108.8 128.2 -6.3 43.6 62.9 117 118 A G E -cd 142 198B 0 80,-2.6 82,-2.5 -2,-0.5 2,-0.6 -0.864 11.6-163.8 -89.3 123.9 -4.9 42.4 59.6 118 119 A I E -cd 143 199B 1 24,-2.5 26,-2.5 -2,-0.5 2,-0.6 -0.941 4.2-171.5-109.6 121.7 -1.9 40.1 60.0 119 120 A I E +cd 144 200B 0 80,-1.3 82,-2.8 -2,-0.6 2,-0.2 -0.952 25.8 150.2-114.9 112.4 0.2 39.5 56.9 120 121 A Y - 0 0 2 24,-2.8 82,-0.2 -2,-0.6 -2,-0.0 -0.777 35.9-133.1-142.0 172.5 2.7 36.8 57.5 121 122 A E - 0 0 80 -2,-0.2 25,-3.0 24,-0.2 -1,-0.2 0.383 62.7 -32.7-103.7-118.5 4.7 34.0 55.8 122 123 A S S S+ 0 0 22 23,-0.2 23,-0.1 26,-0.1 80,-0.0 0.407 88.2 102.8-101.0 -9.8 5.3 30.5 56.7 123 124 A R > - 0 0 115 1,-0.2 3,-1.5 2,-0.0 4,-0.4 -0.695 50.4-162.5 -81.6 107.2 5.4 29.9 60.5 124 125 A P T >> S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 4,-0.6 0.775 82.5 69.3 -64.0 -27.8 2.0 28.3 61.4 125 126 A N H >> S+ 0 0 38 1,-0.3 4,-2.7 2,-0.2 3,-0.6 0.792 86.7 69.4 -54.4 -29.2 2.3 29.1 65.1 126 127 A V H <> S+ 0 0 17 -3,-1.5 4,-2.5 1,-0.3 5,-0.4 0.847 88.7 65.4 -60.0 -33.4 1.9 32.8 64.2 127 128 A T H <> S+ 0 0 0 -3,-1.3 4,-1.2 -4,-0.4 -1,-0.3 0.897 111.0 32.6 -53.7 -50.7 -1.6 31.9 63.3 128 129 A V H S+ 0 0 1 -4,-2.4 5,-3.0 2,-0.2 -2,-0.2 0.946 113.9 46.6 -63.4 -51.8 -6.1 40.0 69.3 135 136 A L H ><5S+ 0 0 2 -4,-3.2 3,-1.8 1,-0.2 -2,-0.2 0.916 110.2 53.4 -59.6 -42.9 -9.1 38.2 70.8 136 137 A K H 3<5S+ 0 0 1 -4,-2.0 -45,-0.2 1,-0.3 -1,-0.2 0.848 109.9 48.8 -61.1 -38.6 -7.9 38.8 74.4 137 138 A S T 3<5S- 0 0 0 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.286 123.5-104.0 -86.0 10.3 -7.6 42.5 73.7 138 139 A G T < 5S+ 0 0 0 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.663 79.1 129.5 77.8 17.5 -11.1 42.7 72.1 139 140 A N < - 0 0 0 -5,-3.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.852 50.9-137.4-105.8 136.1 -9.9 42.8 68.5 140 141 A T - 0 0 0 -2,-0.4 -24,-2.6 -130,-0.2 2,-0.4 -0.402 24.7-139.1 -77.2 170.4 -11.0 40.7 65.5 141 142 A I E -ce 116 174B 0 32,-2.6 34,-2.4 -26,-0.2 2,-0.6 -0.991 18.5-162.1-142.3 135.8 -8.4 39.4 63.1 142 143 A L E -ce 117 175B 0 -26,-2.7 -24,-2.5 -2,-0.4 2,-0.4 -0.961 24.6-156.3-112.8 115.0 -8.0 38.9 59.4 143 144 A L E +ce 118 176B 0 32,-2.9 34,-3.4 -2,-0.6 2,-0.4 -0.805 21.1 172.0-101.3 128.2 -5.2 36.4 58.7 144 145 A R E +c 119 0B 11 -26,-2.5 -24,-2.8 -2,-0.4 2,-0.1 -0.889 17.7 170.0-129.7 99.8 -3.2 36.2 55.5 145 146 A G - 0 0 5 32,-0.4 -24,-0.2 -2,-0.4 -23,-0.2 -0.389 38.5 -66.0 -95.4-171.5 -0.2 33.8 55.8 146 147 A G > - 0 0 8 -25,-3.0 3,-0.8 -2,-0.1 4,-0.3 -0.287 34.0-121.9 -78.8 155.5 2.2 32.3 53.3 147 148 A S G > S+ 0 0 62 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.798 111.2 64.2 -67.2 -23.7 1.3 29.9 50.5 148 149 A D G 3 S+ 0 0 55 1,-0.2 -1,-0.2 2,-0.1 3,-0.2 0.855 109.5 36.7 -66.0 -32.2 3.9 27.4 52.0 149 150 A A G <> S+ 0 0 0 -3,-0.8 4,-3.1 1,-0.2 5,-0.3 0.185 83.2 116.4-104.9 9.1 1.8 27.1 55.2 150 151 A L H <> S+ 0 0 35 -3,-0.8 4,-2.1 -4,-0.3 -1,-0.2 0.849 76.8 43.8 -55.3 -46.0 -1.6 27.2 53.6 151 152 A N H > S+ 0 0 43 -4,-0.3 4,-2.0 -3,-0.2 -1,-0.2 0.944 116.3 48.3 -66.6 -42.6 -2.8 23.7 54.5 152 153 A S H > S+ 0 0 0 -106,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.928 112.6 48.6 -59.5 -47.7 -1.5 24.0 58.0 153 154 A N H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 5,-0.2 0.868 108.2 53.5 -68.7 -34.5 -3.1 27.4 58.5 154 155 A K H X S+ 0 0 79 -4,-2.1 4,-2.4 -5,-0.3 -1,-0.2 0.929 111.0 46.1 -59.8 -49.8 -6.5 26.3 57.2 155 156 A A H X S+ 0 0 20 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.876 114.6 47.1 -62.4 -40.9 -6.6 23.4 59.6 156 157 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.946 113.5 48.3 -65.4 -47.5 -5.5 25.6 62.6 157 158 A V H X S+ 0 0 9 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.884 108.9 54.4 -62.6 -36.3 -8.0 28.3 61.6 158 159 A S H X S+ 0 0 67 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.927 109.3 47.4 -62.2 -45.1 -10.7 25.6 61.3 159 160 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.903 110.6 52.3 -60.9 -43.4 -9.9 24.4 64.9 160 161 A I H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.926 110.8 46.7 -57.4 -49.1 -10.0 28.0 66.2 161 162 A R H X S+ 0 0 58 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.815 106.5 58.2 -68.9 -33.1 -13.4 28.7 64.7 162 163 A E H < S+ 0 0 45 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.2 0.902 109.3 46.3 -58.9 -42.0 -14.8 25.4 66.0 163 164 A A H >< S+ 0 0 0 -4,-1.7 3,-1.6 1,-0.2 -2,-0.2 0.926 110.3 51.7 -65.1 -45.2 -13.8 26.7 69.5 164 165 A L H >< S+ 0 0 0 -4,-2.1 3,-2.2 1,-0.3 5,-0.3 0.855 99.6 64.7 -61.5 -37.9 -15.4 30.1 68.9 165 166 A K T 3< S+ 0 0 150 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.678 95.3 59.6 -58.5 -21.5 -18.6 28.5 67.8 166 167 A E T < S+ 0 0 84 -3,-1.6 -1,-0.3 -4,-0.4 2,-0.2 0.270 108.9 49.8 -92.8 10.4 -19.0 27.1 71.4 167 168 A T S < S- 0 0 23 -3,-2.2 4,-0.1 2,-0.3 -142,-0.0 -0.728 94.7-101.5-128.7-172.9 -19.0 30.6 72.8 168 169 A E S S+ 0 0 153 -2,-0.2 -3,-0.1 2,-0.1 -4,-0.1 0.398 91.2 102.1 -90.1 -5.0 -20.7 34.0 72.2 169 170 A I S S- 0 0 3 -5,-0.3 -2,-0.3 -145,-0.2 4,-0.1 -0.785 85.9-111.7 -80.8 122.9 -17.6 35.3 70.4 170 171 A P > - 0 0 32 0, 0.0 3,-1.8 0, 0.0 4,-0.1 -0.190 9.8-130.6 -61.9 144.7 -18.6 35.1 66.7 171 172 A E G > S+ 0 0 66 1,-0.3 3,-1.6 2,-0.2 -7,-0.1 0.840 107.4 66.4 -60.5 -33.8 -16.8 32.6 64.6 172 173 A S G 3 S+ 0 0 32 1,-0.3 -1,-0.3 -163,-0.1 -159,-0.3 0.377 71.9 91.5 -77.4 5.1 -16.1 35.4 62.1 173 174 A S G < S+ 0 0 0 -3,-1.8 -32,-2.6 1,-0.2 2,-0.4 0.706 93.1 45.1 -62.1 -21.2 -13.9 37.1 64.7 174 175 A V E < S+e 141 0B 0 -3,-1.6 2,-0.3 -34,-0.2 -1,-0.2 -0.954 73.6 170.1-129.4 110.1 -11.2 35.0 62.9 175 176 A E E -e 142 0B 11 -34,-2.4 -32,-2.9 -2,-0.4 2,-0.4 -0.919 15.2-156.2-120.5 153.0 -11.1 35.0 59.1 176 177 A F E -e 143 0B 10 -2,-0.3 2,-0.6 -34,-0.2 -32,-0.2 -0.990 14.2-133.8-138.9 122.3 -8.4 33.6 57.0 177 178 A I - 0 0 4 -34,-3.4 -32,-0.4 -2,-0.4 -174,-0.0 -0.695 18.7-176.6 -80.7 116.6 -7.5 34.5 53.4 178 179 A E + 0 0 88 -2,-0.6 2,-0.8 -34,-0.1 -1,-0.2 0.685 60.4 92.3 -86.4 -24.1 -6.9 31.3 51.4 179 180 A N - 0 0 74 1,-0.2 5,-0.1 2,-0.1 -2,-0.1 -0.637 60.7-166.4 -71.3 111.9 -5.9 33.1 48.2 180 181 A T + 0 0 60 -2,-0.8 -33,-0.2 -33,-0.1 -1,-0.2 0.752 42.2 126.9 -69.8 -29.6 -2.1 33.3 48.5 181 182 A D > - 0 0 89 1,-0.1 3,-1.1 2,-0.1 4,-0.3 -0.027 56.8-142.1 -43.6 132.5 -1.7 35.9 45.7 182 183 A R T >> S+ 0 0 81 1,-0.3 4,-1.1 2,-0.2 3,-0.6 0.625 93.3 76.4 -78.7 -16.0 0.3 38.9 46.9 183 184 A S H 3> S+ 0 0 72 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.800 90.0 63.1 -57.3 -30.4 -1.7 41.4 44.9 184 185 A L H <> S+ 0 0 31 -3,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.810 93.1 60.8 -62.0 -37.3 -4.2 40.8 47.7 185 186 A V H <> S+ 0 0 3 -3,-0.6 4,-2.1 -4,-0.3 -1,-0.2 0.932 101.2 52.7 -55.4 -46.6 -1.8 42.2 50.3 186 187 A L H < S+ 0 0 52 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.894 113.6 43.7 -59.0 -39.9 -1.8 45.5 48.5 187 188 A E H >< S+ 0 0 114 -4,-1.2 3,-1.3 1,-0.2 -1,-0.2 0.861 110.3 56.1 -68.1 -39.0 -5.6 45.7 48.6 188 189 A X H >< S+ 0 0 2 -4,-2.4 3,-1.4 1,-0.3 -2,-0.2 0.892 102.8 53.5 -66.4 -40.6 -5.7 44.5 52.2 189 190 A I T 3< S+ 0 0 0 -4,-2.1 26,-2.4 1,-0.3 27,-2.1 0.386 106.8 53.9 -80.0 2.5 -3.5 47.3 53.6 190 191 A R T < S+ 0 0 106 -3,-1.3 2,-2.0 24,-0.2 -1,-0.3 0.310 75.2 109.9-107.4 3.9 -5.7 49.9 52.0 191 192 A L X> + 0 0 35 -3,-1.4 4,-2.7 -4,-0.2 3,-1.2 -0.448 31.5 157.1 -87.5 74.3 -9.0 48.7 53.6 192 193 A R T 34 + 0 0 185 -2,-2.0 -1,-0.2 1,-0.3 -4,-0.0 0.697 66.2 62.8 -73.6 -21.8 -9.6 51.6 55.9 193 194 A E T 34 S+ 0 0 78 -3,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.652 120.5 22.6 -75.7 -13.3 -13.4 51.0 56.2 194 195 A Y T <4 S+ 0 0 64 -3,-1.2 2,-0.4 1,-0.2 -2,-0.2 0.718 114.0 58.6-121.9 -38.6 -12.7 47.5 57.8 195 196 A L < - 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