==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER FOUR HELIX BUNDLE 07-AUG-04 1W5J . COMPND 2 MOLECULE: GENERAL CONTROL PROTEIN GCN4; . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.K.YADAV,L.J.LEMAN,C.D.STOUT,M.R.GHADIRI . 132 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10638.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 91.7 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 . 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 85.6 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 2 A R > 0 0 149 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 146.6 13.8 8.1 43.1 2 3 A M H > + 0 0 58 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.845 360.0 60.2 -53.2 -36.4 13.3 4.7 42.0 3 4 A R H > S+ 0 0 153 98,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.950 104.0 51.3 -61.9 -37.9 9.7 5.8 40.9 4 5 A Q H > S+ 0 0 107 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.860 109.6 48.6 -63.4 -44.4 11.4 8.2 38.5 5 6 A I H X S+ 0 0 11 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.886 109.5 52.5 -60.5 -43.5 13.6 5.5 37.0 6 7 A E H X S+ 0 0 80 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.921 110.5 47.1 -67.0 -41.1 10.7 3.2 36.5 7 8 A D H X S+ 0 0 65 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.928 110.3 53.7 -62.3 -38.3 8.7 5.8 34.6 8 9 A R H X S+ 0 0 116 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.948 108.5 49.1 -59.8 -45.2 11.7 6.5 32.6 9 10 A L H X S+ 0 0 70 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.882 110.1 50.6 -58.5 -46.0 12.0 2.9 31.7 10 11 A E H X S+ 0 0 116 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.925 110.8 49.0 -65.8 -38.5 8.4 2.7 30.7 11 12 A E H X S+ 0 0 112 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.871 110.6 52.3 -65.0 -33.1 8.8 5.8 28.5 12 13 A I H X S+ 0 0 12 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.965 109.7 49.4 -64.5 -43.2 11.9 4.2 26.9 13 14 A L H X S+ 0 0 79 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.878 107.2 52.5 -62.7 -43.9 9.9 1.1 26.2 14 15 A S H X S+ 0 0 80 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.962 113.3 46.4 -57.5 -47.8 7.1 3.1 24.6 15 16 A K H X S+ 0 0 81 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.883 111.3 50.0 -63.1 -40.8 9.7 4.7 22.4 16 17 A L H X S+ 0 0 51 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.870 107.5 52.5 -66.2 -39.6 11.4 1.5 21.5 17 18 A Y H X S+ 0 0 158 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.924 112.3 48.7 -64.6 -39.0 8.2 -0.3 20.6 18 19 A H H X S+ 0 0 79 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.894 109.7 49.7 -62.3 -48.2 7.6 2.6 18.3 19 20 A I H X S+ 0 0 7 -4,-2.9 4,-3.0 2,-0.2 -2,-0.2 0.911 110.9 52.1 -53.1 -43.0 11.1 2.5 16.8 20 21 A C H X S+ 0 0 72 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.937 107.9 49.8 -65.1 -45.1 10.5 -1.2 16.2 21 22 A N H X S+ 0 0 110 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.901 111.9 50.0 -54.1 -45.2 7.3 -0.6 14.4 22 23 A E H X S+ 0 0 23 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.894 110.1 49.1 -60.9 -41.8 9.1 2.0 12.3 23 24 A L H X S+ 0 0 70 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.921 108.8 52.5 -67.7 -38.8 11.8 -0.4 11.5 24 25 A A H X S+ 0 0 61 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.901 109.5 50.8 -62.8 -38.8 9.3 -3.1 10.5 25 26 A R H X S+ 0 0 117 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.927 108.3 52.0 -63.2 -42.4 7.6 -0.6 8.1 26 27 A I H X S+ 0 0 8 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.962 108.5 50.8 -57.6 -46.1 11.0 0.3 6.5 27 28 A R H X S+ 0 0 202 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.878 112.1 47.0 -55.4 -46.3 11.7 -3.4 5.9 28 29 A R H X S+ 0 0 68 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.852 110.8 51.3 -68.5 -37.2 8.3 -3.7 4.3 29 30 A L H >< S+ 0 0 31 -4,-2.6 3,-1.3 2,-0.2 4,-0.4 0.935 110.3 50.5 -64.0 -42.8 8.9 -0.6 2.2 30 31 A L H >< S+ 0 0 77 -4,-3.0 3,-1.2 1,-0.3 -2,-0.2 0.909 108.8 52.3 -62.5 -37.5 12.2 -2.1 1.1 31 32 A G H 3< S+ 0 0 67 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.658 105.5 54.9 -73.2 -15.9 10.4 -5.3 0.2 32 33 A E T << 0 0 133 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.360 360.0 360.0-103.9 9.0 7.9 -3.5 -2.0 33 34 A R < 0 0 192 -3,-1.2 -3,-0.0 -4,-0.4 0, 0.0 -0.132 360.0 360.0 -72.2 360.0 10.3 -1.7 -4.2 34 !* 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 35 1 B R > 0 0 110 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -39.1 12.0 7.3 -1.6 36 2 B M H > + 0 0 70 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.943 360.0 52.1 -62.6 -41.1 15.4 5.7 -0.9 37 3 B R H > S+ 0 0 62 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.861 109.4 49.5 -54.5 -38.0 16.5 9.2 0.4 38 4 B Q H > S+ 0 0 127 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.916 109.0 50.7 -72.0 -39.0 13.5 9.4 2.6 39 5 B I H X S+ 0 0 8 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.940 109.5 52.1 -64.1 -41.4 14.2 5.9 4.1 40 6 B E H X S+ 0 0 111 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.886 109.8 48.2 -60.1 -43.5 17.8 7.0 4.8 41 7 B D H X S+ 0 0 101 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.885 110.9 50.6 -63.7 -40.7 16.6 10.1 6.6 42 8 B R H X S+ 0 0 80 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.933 108.7 52.7 -66.1 -38.7 14.1 8.0 8.7 43 9 B L H X S+ 0 0 67 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.953 109.2 50.7 -60.1 -41.9 17.0 5.6 9.6 44 10 B E H X S+ 0 0 125 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.879 108.4 49.0 -63.6 -40.8 18.9 8.6 10.7 45 11 B E H X S+ 0 0 105 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.882 113.1 50.0 -64.8 -39.8 16.0 9.9 12.9 46 12 B I H X S+ 0 0 11 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.977 110.3 49.7 -60.4 -53.3 15.8 6.3 14.4 47 13 B L H X S+ 0 0 80 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.909 110.5 51.1 -42.5 -49.5 19.5 6.2 15.1 48 14 B S H X S+ 0 0 71 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.862 111.9 45.3 -64.6 -46.1 19.3 9.5 16.7 49 15 B K H X S+ 0 0 87 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.883 111.9 50.8 -64.6 -42.9 16.5 8.4 18.9 50 16 B L H X S+ 0 0 54 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.878 108.2 53.2 -60.1 -43.0 18.2 5.0 19.9 51 17 B Y H X S+ 0 0 154 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.964 108.0 51.2 -63.2 -40.4 21.5 6.9 20.8 52 18 B H H X S+ 0 0 51 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.838 109.6 51.8 -58.1 -40.7 19.4 9.1 23.2 53 19 B I H X S+ 0 0 11 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.913 105.5 52.9 -60.0 -44.5 18.0 5.9 24.6 54 20 B C H X S+ 0 0 68 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.922 110.3 49.3 -58.2 -41.9 21.5 4.5 25.2 55 21 B N H X S+ 0 0 104 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.813 111.9 46.4 -66.1 -39.9 22.4 7.7 27.1 56 22 B E H X S+ 0 0 30 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.868 113.7 49.0 -70.4 -37.8 19.3 7.6 29.3 57 23 B L H X S+ 0 0 68 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.887 111.5 49.6 -62.0 -44.8 19.9 3.8 30.0 58 24 B A H X S+ 0 0 37 -4,-2.9 4,-2.8 -5,-0.2 -1,-0.2 0.907 110.2 51.1 -62.7 -44.1 23.5 4.5 30.8 59 25 B R H X S+ 0 0 149 -4,-1.6 4,-2.6 -5,-0.2 -2,-0.2 0.888 110.5 49.3 -60.7 -39.0 22.3 7.3 33.2 60 26 B I H X S+ 0 0 15 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.977 110.0 50.3 -57.5 -54.1 19.9 4.8 34.8 61 27 B R H X S+ 0 0 152 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.901 110.9 49.7 -51.5 -50.8 22.6 2.4 35.2 62 28 B R H X S+ 0 0 141 -4,-2.8 4,-1.0 1,-0.2 -2,-0.2 0.951 112.0 48.1 -58.3 -44.5 24.8 5.1 36.8 63 29 B L H X S+ 0 0 74 -4,-2.6 4,-0.5 1,-0.2 3,-0.5 0.875 108.7 52.1 -59.7 -43.8 22.0 6.2 39.2 64 30 B L H >< S+ 0 0 75 -4,-3.0 3,-1.4 1,-0.2 -1,-0.2 0.916 106.2 57.7 -57.4 -39.1 21.2 2.6 40.3 65 31 B G H 3< S+ 0 0 43 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.725 100.2 56.2 -66.5 -25.7 25.0 2.3 41.0 66 32 B E H 3< 0 0 104 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.598 360.0 360.0 -85.5 -4.9 24.9 5.2 43.5 67 33 B R << 0 0 111 -3,-1.4 -3,-0.0 -4,-0.5 34,-0.0 -0.129 360.0 360.0 -79.3 360.0 22.2 3.5 45.5 68 !* 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 69 1 C R >> 0 0 220 0, 0.0 4,-2.6 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 -55.3 25.6 2.1 94.6 70 2 C M H 3> + 0 0 79 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.930 360.0 50.8 -56.7 -35.0 21.9 3.2 94.0 71 3 C R H 3> S+ 0 0 71 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.807 107.7 51.5 -70.1 -29.7 23.3 6.5 92.7 72 4 C Q H <> S+ 0 0 109 -3,-0.7 4,-2.6 2,-0.2 5,-0.2 0.884 108.1 51.9 -76.1 -38.6 25.6 4.7 90.4 73 5 C I H X S+ 0 0 78 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.942 112.2 46.5 -56.1 -47.6 22.6 2.7 89.1 74 6 C E H X S+ 0 0 36 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.879 110.5 52.6 -60.3 -40.8 20.8 6.0 88.4 75 7 C D H X S+ 0 0 96 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.930 111.0 47.1 -61.6 -51.5 23.8 7.6 86.8 76 8 C R H X S+ 0 0 176 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.842 108.6 55.1 -64.5 -36.1 24.1 4.6 84.4 77 9 C L H X S+ 0 0 24 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.869 106.0 53.4 -59.3 -38.9 20.4 4.7 83.6 78 10 C E H X S+ 0 0 106 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.918 107.6 48.5 -63.1 -43.4 20.8 8.2 82.6 79 11 C E H X S+ 0 0 49 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.872 110.3 53.2 -63.1 -37.6 23.5 7.5 80.2 80 12 C I H X S+ 0 0 66 -4,-1.9 4,-3.2 1,-0.2 5,-0.2 0.966 108.4 49.6 -63.1 -52.7 21.4 4.7 78.7 81 13 C L H X S+ 0 0 15 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.928 110.3 49.7 -49.4 -45.8 18.5 7.0 78.2 82 14 C S H X S+ 0 0 61 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.939 113.9 44.9 -68.9 -42.3 20.7 9.5 76.5 83 15 C K H X S+ 0 0 99 -4,-2.3 4,-2.0 2,-0.2 3,-0.2 0.927 112.2 53.4 -63.8 -46.3 22.2 6.9 74.2 84 16 C L H X S+ 0 0 29 -4,-3.2 4,-2.9 1,-0.2 -2,-0.2 0.914 104.4 55.4 -52.5 -46.3 18.8 5.4 73.5 85 17 C Y H X S+ 0 0 84 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.900 110.0 45.4 -54.9 -36.9 17.4 8.7 72.5 86 18 C H H X S+ 0 0 113 -4,-1.3 4,-2.0 -3,-0.2 -1,-0.2 0.825 108.6 56.0 -80.7 -29.2 20.1 9.1 69.9 87 19 C I H X S+ 0 0 83 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.923 109.3 48.2 -60.4 -43.9 19.6 5.5 68.7 88 20 C C H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.882 109.6 50.3 -59.8 -49.4 16.0 6.4 68.1 89 21 C N H X S+ 0 0 69 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.916 112.1 51.0 -55.8 -43.5 16.9 9.7 66.2 90 22 C E H X S+ 0 0 93 -4,-2.0 4,-3.3 2,-0.2 -2,-0.2 0.949 109.4 47.2 -63.1 -48.3 19.3 7.7 64.1 91 23 C L H X S+ 0 0 35 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.882 112.1 52.0 -58.7 -40.5 16.6 4.9 63.2 92 24 C A H X S+ 0 0 43 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.937 110.8 46.7 -64.6 -39.6 14.2 7.7 62.3 93 25 C R H X S+ 0 0 133 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.917 111.6 52.7 -65.5 -42.4 16.8 9.3 60.0 94 26 C I H X S+ 0 0 68 -4,-3.3 4,-2.5 1,-0.2 5,-0.2 0.928 109.1 47.4 -54.2 -50.3 17.4 5.9 58.5 95 27 C R H X S+ 0 0 79 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.829 109.6 56.2 -58.4 -28.8 13.8 5.4 57.9 96 28 C R H X S+ 0 0 72 -4,-1.8 4,-0.7 -5,-0.2 -2,-0.2 0.968 107.8 47.8 -69.5 -43.8 13.8 9.0 56.3 97 29 C L H >< S+ 0 0 69 -4,-2.6 3,-1.2 2,-0.2 4,-0.2 0.896 109.1 50.8 -64.2 -51.8 16.5 8.0 53.9 98 30 C L H >< S+ 0 0 37 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.933 109.1 55.2 -54.2 -40.8 14.8 4.8 52.8 99 31 C G H 3< S+ 0 0 46 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.731 103.5 54.4 -62.0 -21.7 11.7 6.9 52.2 100 32 C E T << 0 0 140 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.280 360.0 360.0 -96.4 10.5 13.6 9.3 49.9 101 33 C R < 0 0 98 -3,-1.3 -98,-0.3 -4,-0.2 -3,-0.1 -0.307 360.0 360.0-101.2 360.0 14.8 6.5 47.6 102 !* 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 0.0 103 1 D R > 0 0 90 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -90.5 9.5 -4.4 50.0 104 2 D M H > + 0 0 79 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.862 360.0 57.4 -49.4 -44.4 11.2 -1.2 51.1 105 3 D R H > S+ 0 0 57 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.909 107.1 50.5 -55.4 -42.6 7.8 0.2 52.2 106 4 D Q H > S+ 0 0 73 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.975 108.3 50.5 -60.9 -54.5 7.5 -2.9 54.5 107 5 D I H X S+ 0 0 79 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.882 110.4 51.0 -42.2 -52.9 11.0 -2.3 55.9 108 6 D E H X S+ 0 0 42 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.877 111.2 47.7 -59.2 -39.3 10.0 1.4 56.6 109 7 D D H X S+ 0 0 93 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.899 110.6 50.9 -65.7 -40.3 6.9 0.2 58.4 110 8 D R H X S+ 0 0 51 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.892 110.3 49.7 -68.9 -40.9 8.9 -2.4 60.4 111 9 D L H X S+ 0 0 28 -4,-2.4 4,-3.3 2,-0.2 -2,-0.2 0.932 108.8 54.1 -60.6 -42.9 11.4 0.4 61.5 112 10 D E H X S+ 0 0 94 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.912 109.2 46.4 -54.5 -48.5 8.4 2.6 62.5 113 11 D E H X S+ 0 0 106 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.931 112.4 51.1 -61.1 -48.8 7.0 -0.2 64.8 114 12 D I H X S+ 0 0 72 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.937 109.2 52.3 -51.8 -45.0 10.5 -0.7 66.2 115 13 D L H X S+ 0 0 8 -4,-3.3 4,-2.4 1,-0.2 5,-0.2 0.960 107.6 50.1 -51.8 -56.4 10.7 3.0 66.8 116 14 D S H X S+ 0 0 60 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.887 111.8 47.5 -51.2 -42.1 7.4 3.0 68.7 117 15 D K H X S+ 0 0 135 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.925 109.9 54.6 -71.9 -32.3 8.6 0.1 70.9 118 16 D L H X S+ 0 0 36 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.908 108.4 47.2 -64.5 -44.0 12.0 1.9 71.6 119 17 D Y H X S+ 0 0 85 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.907 109.5 53.0 -62.6 -44.4 10.3 5.1 72.8 120 18 D H H X S+ 0 0 116 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.888 110.4 49.0 -60.3 -37.5 8.0 3.2 75.0 121 19 D I H X S+ 0 0 69 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.969 110.6 50.0 -64.6 -46.5 11.1 1.4 76.5 122 20 D C H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.888 110.6 49.6 -55.2 -49.6 12.8 4.8 77.0 123 21 D N H X S+ 0 0 88 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.896 111.3 49.4 -58.7 -39.1 9.8 6.2 78.7 124 22 D E H X S+ 0 0 123 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.907 111.7 49.6 -64.4 -44.2 9.6 3.0 81.0 125 23 D L H X S+ 0 0 40 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.910 109.2 50.7 -63.6 -42.1 13.4 3.4 81.9 126 24 D A H X S+ 0 0 15 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.925 109.9 50.8 -59.1 -45.7 13.1 7.1 82.7 127 25 D R H X S+ 0 0 163 -4,-1.8 4,-2.8 -5,-0.2 5,-0.2 0.959 109.9 49.2 -60.6 -46.3 10.2 6.2 85.0 128 26 D I H X S+ 0 0 79 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.978 109.7 53.2 -58.1 -45.7 12.3 3.5 86.7 129 27 D R H X S+ 0 0 21 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.931 112.1 44.1 -48.8 -51.1 15.1 6.1 87.1 130 28 D R H X S+ 0 0 152 -4,-3.0 4,-1.0 2,-0.2 -1,-0.2 0.922 111.8 53.3 -62.4 -45.5 12.7 8.6 88.8 131 29 D L H >< S+ 0 0 96 -4,-2.8 3,-0.9 1,-0.2 -2,-0.2 0.934 110.8 47.7 -53.2 -48.4 11.2 5.7 91.0 132 30 D L H >< S+ 0 0 36 -4,-2.8 3,-1.9 1,-0.2 -1,-0.2 0.918 105.7 57.1 -56.1 -48.3 14.7 4.9 92.1 133 31 D G H 3< S+ 0 0 51 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.636 105.7 53.3 -65.7 -11.0 15.6 8.5 92.8 134 32 D E T << 0 0 108 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.335 360.0 360.0 -98.7 2.6 12.6 8.6 95.3 135 33 D R < 0 0 246 -3,-1.9 -3,-0.0 -4,-0.2 0, 0.0 -0.349 360.0 360.0 -79.6 360.0 13.6 5.6 97.4