==== 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 UNKNOWN FUNCTION 21-JUL-06 2HSB . COMPND 2 MOLECULE: HYPOTHETICAL UPF0332 PROTEIN AF0298; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 126 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7206.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 97 77.0 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 . 0 0.0 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 . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 4.0 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 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 2 1 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 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 0 A G 0 0 82 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-172.5 53.3 16.4 35.7 2 1 A X + 0 0 168 4,-0.1 2,-0.1 5,-0.0 0, 0.0 0.058 360.0 128.5 -97.5 21.4 52.9 19.0 38.4 3 2 A D S > S- 0 0 75 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.407 73.1-109.8 -75.5 159.6 54.6 21.7 36.3 4 3 A E H > S+ 0 0 90 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.824 113.8 56.4 -61.0 -38.0 53.0 25.1 35.8 5 4 A L H > S+ 0 0 36 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.953 112.0 41.6 -62.1 -47.8 52.1 24.5 32.1 6 5 A E H > S+ 0 0 52 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.938 115.4 49.6 -64.2 -47.3 50.1 21.4 32.8 7 6 A L H X S+ 0 0 72 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.837 109.3 52.4 -66.5 -35.2 48.4 22.7 35.9 8 7 A R H X S+ 0 0 50 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.900 111.9 45.1 -62.0 -47.1 47.4 25.9 34.1 9 8 A I H X S+ 0 0 2 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.935 113.7 50.0 -65.7 -43.2 45.8 24.0 31.3 10 9 A R H X S+ 0 0 154 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.930 110.8 49.8 -60.4 -44.1 44.1 21.7 33.7 11 10 A K H X S+ 0 0 101 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.936 110.6 50.1 -58.3 -45.2 42.8 24.7 35.7 12 11 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.927 111.3 49.0 -59.5 -44.7 41.4 26.2 32.5 13 12 A E H X S+ 0 0 52 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.897 111.9 48.0 -62.6 -46.5 39.7 22.9 31.6 14 13 A K H X S+ 0 0 104 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.901 109.8 52.7 -59.8 -44.1 38.1 22.6 35.1 15 14 A L H X S+ 0 0 21 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.896 105.6 54.6 -62.6 -38.8 36.9 26.2 35.0 16 15 A V H X S+ 0 0 9 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.943 111.1 45.6 -60.8 -44.5 35.2 25.6 31.6 17 16 A Q H X S+ 0 0 98 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.917 111.8 51.3 -64.5 -43.0 33.3 22.7 33.1 18 17 A D H X S+ 0 0 47 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.903 109.6 50.9 -56.9 -44.4 32.4 24.8 36.2 19 18 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.871 106.2 54.7 -62.6 -40.6 31.1 27.6 34.0 20 19 A K H X S+ 0 0 59 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.929 110.1 47.0 -57.5 -44.1 28.9 25.1 32.1 21 20 A K H X S+ 0 0 123 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.854 110.3 51.4 -67.6 -40.0 27.4 24.0 35.4 22 21 A E H <>S+ 0 0 40 -4,-2.2 5,-2.5 2,-0.2 4,-0.5 0.927 108.8 53.2 -59.1 -45.1 26.8 27.6 36.5 23 22 A F H ><5S+ 0 0 32 -4,-2.7 3,-1.6 1,-0.2 -2,-0.2 0.932 107.4 50.0 -55.6 -46.8 25.1 28.2 33.2 24 23 A E H 3<5S+ 0 0 156 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.832 108.0 53.1 -65.3 -31.1 22.7 25.3 33.7 25 24 A X T 3<5S- 0 0 134 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.487 119.9-111.2 -78.8 -4.7 21.8 26.5 37.2 26 25 A G T < 5S+ 0 0 31 -3,-1.6 2,-1.5 -4,-0.5 3,-0.2 0.644 73.4 140.0 81.5 15.7 21.0 29.9 35.7 27 26 A L >< + 0 0 77 -5,-2.5 4,-2.4 1,-0.2 -1,-0.2 -0.617 19.3 165.2 -90.3 77.1 23.9 31.7 37.4 28 27 A Y H > + 0 0 65 -2,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.878 69.8 46.7 -70.9 -39.6 24.7 33.8 34.3 29 28 A E H > S+ 0 0 51 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.905 113.5 49.2 -64.8 -42.6 27.0 36.3 35.9 30 29 A R H > S+ 0 0 89 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.920 108.4 55.1 -65.8 -41.1 29.0 33.6 37.7 31 30 A C H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.917 107.7 48.9 -52.0 -50.6 29.3 31.7 34.4 32 31 A C H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.905 111.8 48.2 -60.3 -44.8 30.8 34.8 32.7 33 32 A S H X S+ 0 0 8 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.957 114.5 45.8 -61.9 -47.9 33.3 35.3 35.5 34 33 A T H X S+ 0 0 16 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.883 110.7 53.3 -62.0 -43.3 34.4 31.6 35.5 35 34 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.867 107.9 51.1 -59.2 -41.1 34.6 31.5 31.7 36 35 A Y H X S+ 0 0 1 -4,-2.0 4,-2.8 -5,-0.2 -2,-0.2 0.929 108.1 52.3 -63.4 -44.9 37.0 34.5 31.8 37 36 A Y H X S+ 0 0 62 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.900 105.9 54.2 -57.3 -38.5 39.1 32.8 34.4 38 37 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.952 111.3 45.3 -59.8 -46.9 39.4 29.7 32.2 39 38 A X H X S+ 0 0 0 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.864 108.9 56.7 -65.6 -39.4 40.6 31.9 29.4 40 39 A F H X S+ 0 0 34 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.945 109.6 44.2 -53.1 -53.6 43.0 33.7 31.7 41 40 A H H X S+ 0 0 33 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.880 113.0 52.0 -63.6 -36.9 44.8 30.5 32.7 42 41 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.924 110.8 48.4 -63.8 -43.4 44.8 29.3 29.1 43 42 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.937 110.6 50.4 -59.7 -48.8 46.4 32.7 28.1 44 43 A K H X S+ 0 0 21 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.864 109.0 53.1 -58.2 -37.0 49.0 32.4 30.9 45 44 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.925 109.6 47.6 -64.3 -44.7 49.8 28.8 29.7 46 45 A X H X S+ 0 0 0 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.888 113.3 47.8 -64.0 -41.0 50.4 30.1 26.1 47 46 A L H <>S+ 0 0 2 -4,-2.4 5,-3.1 2,-0.2 -2,-0.2 0.903 112.6 49.4 -66.7 -40.7 52.6 32.9 27.4 48 47 A L H ><5S+ 0 0 65 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.964 109.9 50.3 -59.1 -54.1 54.6 30.5 29.6 49 48 A G H 3<5S+ 0 0 45 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.731 113.6 47.1 -59.3 -27.2 55.1 28.0 26.8 50 49 A Y T 3<5S- 0 0 102 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 -0.220 119.1-106.2-110.9 38.5 56.4 30.8 24.6 51 50 A G T < 5S+ 0 0 76 -3,-1.7 2,-0.2 1,-0.1 -3,-0.2 0.574 81.0 119.9 54.8 18.1 58.8 32.4 27.1 52 51 A R < - 0 0 114 -5,-3.1 2,-0.3 -6,-0.2 -1,-0.1 -0.685 40.7-166.5-104.9 162.9 56.6 35.5 27.8 53 52 A D - 0 0 109 -2,-0.2 2,-0.3 -3,-0.1 -9,-0.0 -0.991 6.4-171.5-149.5 156.5 55.2 36.6 31.2 54 53 A S - 0 0 9 -2,-0.3 3,-0.1 -10,-0.0 4,-0.0 -0.917 17.8-165.6-141.0 162.1 52.6 39.0 32.6 55 54 A K S S+ 0 0 193 -2,-0.3 2,-0.3 1,-0.1 3,-0.1 0.275 74.2 50.1-132.5 6.6 51.4 40.3 36.0 56 55 A T S > S- 0 0 82 1,-0.1 4,-2.7 0, 0.0 5,-0.2 -0.969 77.5-120.1-142.5 156.2 48.1 42.0 35.1 57 56 A H H > S+ 0 0 50 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.938 117.9 45.0 -58.0 -49.9 44.9 41.1 33.1 58 57 A R H > S+ 0 0 154 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.946 112.8 51.2 -64.6 -44.5 45.4 44.0 30.7 59 58 A G H > S+ 0 0 27 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.924 111.4 48.0 -55.6 -46.2 49.1 43.1 30.4 60 59 A T H X S+ 0 0 3 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.931 111.1 50.6 -59.2 -47.3 48.2 39.4 29.6 61 60 A I H X S+ 0 0 10 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.913 111.4 47.3 -60.6 -43.6 45.6 40.5 27.1 62 61 A Y H X S+ 0 0 133 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.889 110.4 52.2 -70.0 -35.0 47.9 42.8 25.2 63 62 A L H X S+ 0 0 25 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.899 108.2 51.5 -64.6 -41.7 50.8 40.2 25.1 64 63 A I H < S+ 0 0 0 -4,-2.3 4,-0.3 2,-0.2 -2,-0.2 0.941 111.4 48.1 -58.0 -47.2 48.3 37.6 23.6 65 64 A W H >< S+ 0 0 60 -4,-2.2 3,-1.6 1,-0.2 4,-0.3 0.968 112.7 48.3 -53.7 -54.1 47.4 40.2 21.0 66 65 A E H 3< S+ 0 0 123 -4,-2.9 3,-0.3 1,-0.3 -2,-0.2 0.869 118.6 39.5 -57.0 -42.1 51.1 40.9 20.3 67 66 A C T 3X S+ 0 0 6 -4,-2.8 4,-1.8 1,-0.2 -1,-0.3 0.207 80.8 115.4 -92.2 16.3 52.0 37.2 20.0 68 67 A R H <>>S+ 0 0 67 -3,-1.6 5,-2.2 -4,-0.3 4,-1.1 0.864 72.4 52.5 -60.3 -40.7 48.9 36.1 18.1 69 68 A E H >45S+ 0 0 149 -3,-0.3 3,-1.0 -4,-0.3 -1,-0.2 0.958 112.7 44.6 -60.7 -51.3 50.5 35.0 14.9 70 69 A E H 345S+ 0 0 112 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.791 114.6 50.6 -60.5 -32.8 53.0 32.8 16.7 71 70 A L H 3<5S- 0 0 8 -4,-1.8 -1,-0.2 -7,-0.2 -2,-0.2 0.579 110.3-119.3 -84.9 -11.3 50.3 31.4 18.9 72 71 A G T <<5 + 0 0 52 -4,-1.1 2,-0.4 -3,-1.0 -3,-0.2 0.735 64.7 143.3 77.3 23.8 47.9 30.5 16.0 73 72 A L < - 0 0 9 -5,-2.2 -1,-0.3 -6,-0.2 -2,-0.1 -0.807 43.3-137.4 -98.2 135.8 45.2 32.8 17.3 74 73 A S > - 0 0 48 -2,-0.4 4,-2.0 -3,-0.1 5,-0.2 -0.387 31.0-105.0 -77.1 165.8 43.0 34.9 15.0 75 74 A D H > S+ 0 0 85 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.901 125.0 54.4 -55.6 -40.8 42.1 38.4 15.7 76 75 A D H > S+ 0 0 97 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.923 104.2 54.0 -61.6 -44.2 38.6 37.2 16.8 77 76 A D H > S+ 0 0 4 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.889 109.8 47.6 -54.3 -40.8 40.3 34.8 19.2 78 77 A C H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.888 110.5 51.6 -71.1 -36.4 42.1 37.7 20.8 79 78 A S H X S+ 0 0 51 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.813 100.0 64.0 -66.0 -31.6 38.9 39.7 20.9 80 79 A K H X S+ 0 0 14 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.932 106.3 44.8 -52.9 -47.0 37.2 36.7 22.7 81 80 A L H X S+ 0 0 2 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.904 113.1 48.8 -67.1 -43.8 39.6 37.3 25.6 82 81 A S H X S+ 0 0 33 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.956 115.4 44.5 -62.3 -48.0 39.2 41.1 25.7 83 82 A R H X S+ 0 0 96 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.877 110.6 52.9 -66.7 -42.0 35.5 40.9 25.6 84 83 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.874 110.0 50.6 -60.2 -38.3 35.3 38.1 28.2 85 84 A F H X S+ 0 0 20 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.946 110.0 48.5 -63.1 -48.0 37.4 40.3 30.5 86 85 A D H X S+ 0 0 106 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.883 114.6 46.1 -60.1 -38.7 35.2 43.3 30.1 87 86 A L H X S+ 0 0 20 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.821 109.3 54.0 -75.1 -34.0 32.1 41.1 30.8 88 87 A R H X S+ 0 0 15 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.878 105.4 55.3 -62.9 -37.3 33.7 39.5 33.8 89 88 A E H X>S+ 0 0 66 -4,-2.2 4,-2.7 1,-0.2 5,-0.7 0.927 111.1 44.1 -62.9 -42.4 34.3 43.0 35.1 90 89 A E H X5S+ 0 0 55 -4,-1.6 4,-1.2 3,-0.2 -2,-0.2 0.913 114.2 49.7 -64.8 -45.1 30.6 43.8 34.8 91 90 A S H <5S+ 0 0 5 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.927 124.4 28.3 -60.4 -46.0 29.6 40.4 36.3 92 91 A D H <5S+ 0 0 45 -4,-2.9 -2,-0.2 -5,-0.1 -3,-0.2 0.838 137.4 20.9 -86.8 -34.2 32.0 40.7 39.3 93 92 A Y H <5S+ 0 0 154 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.583 97.4 95.8-117.1 -16.5 32.2 44.5 39.8 94 93 A G << - 0 0 23 -4,-1.2 -4,-0.0 -5,-0.7 0, 0.0 -0.453 42.0-176.6 -78.7 151.4 29.2 46.1 38.1 95 94 A I S S+ 0 0 139 -2,-0.1 -1,-0.1 3,-0.0 -5,-0.0 0.476 73.6 48.1-126.8 -5.5 26.0 46.9 40.1 96 95 A Y S S+ 0 0 207 1,-0.1 2,-0.2 -6,-0.1 -2,-0.0 0.877 96.9 61.7-100.4 -58.2 23.5 48.1 37.5 97 96 A K - 0 0 95 -7,-0.0 2,-0.3 1,-0.0 -1,-0.1 -0.465 63.2-152.4 -79.7 141.8 23.5 45.7 34.6 98 97 A E - 0 0 175 -2,-0.2 2,-0.4 -3,-0.0 -7,-0.1 -0.849 22.3-119.0-104.5 151.4 22.5 42.1 34.8 99 98 A V - 0 0 13 -2,-0.3 -70,-0.2 -8,-0.1 -71,-0.2 -0.759 26.3-135.8 -94.9 131.7 23.9 39.5 32.3 100 99 A S > - 0 0 59 -2,-0.4 4,-2.0 -72,-0.1 5,-0.2 -0.350 21.9-111.9 -81.8 163.5 21.4 37.7 30.1 101 100 A K H > S+ 0 0 117 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.885 118.9 55.2 -54.5 -41.4 21.4 34.0 29.3 102 101 A D H > S+ 0 0 120 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.871 107.5 47.0 -70.5 -35.7 22.4 34.9 25.7 103 102 A L H > S+ 0 0 59 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 112.2 51.0 -64.4 -44.7 25.5 36.8 26.8 104 103 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.890 108.2 50.7 -65.0 -41.0 26.6 34.1 29.1 105 104 A I H X S+ 0 0 50 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.899 108.6 53.9 -63.9 -37.3 26.2 31.4 26.4 106 105 A K H X S+ 0 0 113 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.919 111.8 43.4 -59.4 -47.7 28.3 33.6 24.0 107 106 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.884 111.8 54.5 -70.0 -36.4 31.2 33.9 26.5 108 107 A L H X S+ 0 0 12 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.932 109.7 45.9 -61.6 -44.6 31.0 30.2 27.4 109 108 A K H X S+ 0 0 116 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.906 111.3 53.3 -67.5 -38.6 31.3 29.1 23.8 110 109 A D H X S+ 0 0 20 -4,-2.1 4,-3.1 -5,-0.2 -1,-0.2 0.898 107.8 51.2 -57.8 -43.5 34.2 31.6 23.4 111 110 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.905 108.3 51.7 -62.7 -43.4 36.0 30.1 26.4 112 111 A E H X S+ 0 0 86 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.915 115.4 41.7 -58.6 -43.9 35.6 26.6 25.0 113 112 A I H X S+ 0 0 79 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.925 116.4 48.1 -69.4 -45.8 37.1 27.7 21.7 114 113 A F H X S+ 0 0 0 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.921 112.1 48.2 -64.2 -44.2 39.9 29.8 23.3 115 114 A V H X S+ 0 0 7 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.903 111.4 50.6 -67.1 -39.2 40.9 27.1 25.8 116 115 A Q H X S+ 0 0 83 -4,-1.6 4,-2.5 -5,-0.3 -1,-0.2 0.943 110.3 49.8 -61.1 -45.6 41.1 24.4 23.0 117 116 A K H X S+ 0 0 63 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.854 109.6 51.5 -62.0 -33.6 43.2 26.8 20.9 118 117 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.918 108.3 51.3 -67.3 -44.1 45.5 27.3 23.8 119 118 A K H <>S+ 0 0 32 -4,-2.4 5,-3.1 1,-0.2 6,-0.7 0.919 110.0 50.3 -58.8 -43.2 45.8 23.5 24.3 120 119 A N H ><5S+ 0 0 71 -4,-2.5 3,-1.4 4,-0.2 -1,-0.2 0.952 109.4 51.2 -57.7 -48.6 46.7 23.2 20.6 121 120 A A H 3<5S+ 0 0 12 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.810 115.9 39.1 -62.3 -35.7 49.4 26.0 20.9 122 121 A V T 3<5S- 0 0 11 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.189 113.7-112.2-103.6 15.7 51.2 24.4 23.9 123 122 A N T < 5S+ 0 0 114 -3,-1.4 -3,-0.2 -4,-0.3 3,-0.1 0.859 81.9 123.0 57.2 42.1 50.8 20.8 22.7 124 123 A K < + 0 0 50 -5,-3.1 -4,-0.2 -6,-0.2 -5,-0.1 0.104 36.9 98.9-115.0 18.7 48.4 19.8 25.5 125 124 A N 0 0 83 -6,-0.7 -1,-0.1 -5,-0.2 -5,-0.1 0.179 360.0 360.0 -85.7 27.0 45.6 18.7 23.2 126 125 A R 0 0 251 -7,-0.1 -6,-0.0 -3,-0.1 -7,-0.0 -0.469 360.0 360.0 -88.5 360.0 47.0 15.2 24.0