==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 21-DEC-00 1HH8 . COMPND 2 MOLECULE: NEUTROPHIL CYTOSOL FACTOR 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GRIZOT,F.FIESCHI,M.-C.DAGHER,E.PEBAY-PEYROULA . 192 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10535.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 78.6 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 3.1 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 . 11 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 51.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.6 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 1 0 0 0 1 1 0 1 3 2 0 1 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 . 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 0 0 0 ANTIPARALLEL 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 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 S > 0 0 92 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 173.7 16.6 27.5 18.5 2 3 A L H > + 0 0 124 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.912 360.0 54.9 -68.7 -43.4 15.1 26.9 15.0 3 4 A V H > S+ 0 0 90 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.920 110.2 45.8 -56.0 -46.3 17.5 29.4 13.4 4 5 A E H > S+ 0 0 119 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.917 114.0 47.7 -64.8 -44.7 20.5 27.5 14.8 5 6 A A H X S+ 0 0 37 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.937 114.4 45.0 -63.1 -49.5 19.2 24.0 13.9 6 7 A I H X S+ 0 0 7 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.901 112.8 52.8 -62.3 -41.0 18.3 25.0 10.3 7 8 A S H X S+ 0 0 45 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.927 114.0 41.1 -60.7 -46.6 21.6 26.8 9.9 8 9 A L H X S+ 0 0 38 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.884 114.8 51.6 -68.8 -40.0 23.7 23.8 11.0 9 10 A W H X S+ 0 0 19 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.925 113.4 44.5 -62.7 -46.4 21.5 21.4 9.1 10 11 A N H X S+ 0 0 37 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.921 111.9 53.4 -64.1 -44.4 21.9 23.4 5.9 11 12 A E H X S+ 0 0 107 -4,-2.3 4,-1.7 -5,-0.3 -2,-0.2 0.905 109.4 50.3 -57.1 -43.0 25.7 23.8 6.5 12 13 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.898 110.8 44.7 -65.4 -44.6 26.0 20.1 6.8 13 14 A V H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.836 112.1 53.6 -71.5 -29.9 24.2 19.1 3.6 14 15 A L H X S+ 0 0 65 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.871 109.3 49.1 -69.8 -35.5 26.1 21.8 1.7 15 16 A A H ><>S+ 0 0 13 -4,-1.7 5,-2.6 -5,-0.2 3,-0.7 0.914 110.0 51.2 -67.6 -43.3 29.4 20.3 3.0 16 17 A A H ><5S+ 0 0 3 -4,-2.1 3,-1.9 1,-0.2 -2,-0.2 0.874 102.8 59.7 -61.2 -37.7 28.3 16.9 2.0 17 18 A D H 3<5S+ 0 0 83 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.823 106.8 47.5 -59.4 -31.1 27.4 18.2 -1.5 18 19 A K T <<5S- 0 0 149 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.318 119.7-113.1 -91.2 5.8 31.1 19.2 -1.8 19 20 A K T < 5S+ 0 0 158 -3,-1.9 2,-1.5 1,-0.2 -3,-0.2 0.687 72.8 140.8 68.5 19.0 32.2 15.7 -0.5 20 21 A D >< + 0 0 82 -5,-2.6 4,-1.9 1,-0.2 -1,-0.2 -0.681 20.8 169.8 -91.5 79.4 33.5 17.4 2.7 21 22 A W H > S+ 0 0 54 -2,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.861 71.8 52.2 -61.7 -40.1 32.3 14.5 4.9 22 23 A K H > S+ 0 0 147 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.918 110.6 48.0 -64.4 -43.3 34.1 15.7 8.0 23 24 A G H > S+ 0 0 14 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.861 112.0 49.9 -64.9 -36.1 32.7 19.2 7.7 24 25 A A H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.933 112.0 47.7 -67.0 -46.2 29.2 17.7 7.2 25 26 A L H X S+ 0 0 16 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.913 110.5 52.2 -60.6 -44.4 29.6 15.5 10.2 26 27 A D H X S+ 0 0 106 -4,-2.7 4,-0.6 1,-0.2 -1,-0.2 0.911 112.3 45.5 -59.4 -43.5 30.9 18.4 12.3 27 28 A A H >< S+ 0 0 3 -4,-2.0 3,-0.9 2,-0.2 4,-0.5 0.938 114.9 45.6 -67.0 -48.0 27.9 20.5 11.3 28 29 A F H >< S+ 0 0 0 -4,-2.8 3,-1.3 1,-0.2 -2,-0.2 0.904 110.6 54.5 -62.1 -41.5 25.3 17.8 12.0 29 30 A S H 3< S+ 0 0 62 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.637 98.4 64.5 -67.9 -14.3 26.9 16.9 15.3 30 31 A A T << S+ 0 0 58 -3,-0.9 -1,-0.3 -4,-0.6 2,-0.2 0.638 76.1 108.0 -83.3 -16.0 26.6 20.5 16.5 31 32 A V S < S- 0 0 18 -3,-1.3 2,-0.3 -4,-0.5 -26,-0.1 -0.444 72.8-127.6 -64.8 130.4 22.9 20.3 16.4 32 33 A Q S S- 0 0 168 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 -0.642 83.9 -1.2 -83.0 135.3 21.5 20.2 19.9 33 34 A D S S- 0 0 92 -2,-0.3 -1,-0.3 1,-0.1 -2,-0.0 0.945 88.9-152.7 53.0 56.0 19.1 17.4 20.7 34 35 A P - 0 0 35 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.265 5.9-149.7 -60.6 142.7 19.1 16.0 17.2 35 36 A H > - 0 0 107 31,-0.0 4,-2.4 30,-0.0 5,-0.3 -0.317 41.4 -67.4-100.9-170.5 16.0 14.1 16.1 36 37 A S H > S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.819 127.0 49.1 -49.4 -44.5 15.7 11.2 13.6 37 38 A R H > S+ 0 0 87 2,-0.2 4,-2.2 1,-0.2 145,-0.3 0.922 114.0 43.0 -67.6 -44.5 16.7 13.0 10.4 38 39 A I H > S+ 0 0 15 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.894 114.2 52.3 -68.6 -36.5 19.9 14.6 11.7 39 40 A C H X S+ 0 0 6 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.899 109.0 51.3 -63.1 -38.5 20.8 11.4 13.5 40 41 A F H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.928 109.9 48.8 -62.6 -46.3 20.3 9.6 10.2 41 42 A N H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.874 109.8 52.0 -62.2 -38.1 22.6 12.1 8.4 42 43 A I H X S+ 0 0 19 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.899 107.8 52.6 -64.9 -40.0 25.2 11.6 11.1 43 44 A G H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.897 108.2 50.8 -62.4 -39.8 25.0 7.9 10.6 44 45 A C H X S+ 0 0 16 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.881 110.4 48.8 -65.6 -39.1 25.6 8.3 6.8 45 46 A M H X S+ 0 0 2 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.921 110.5 49.1 -69.5 -42.5 28.6 10.5 7.4 46 47 A Y H <>S+ 0 0 58 -4,-2.5 5,-3.0 1,-0.2 -1,-0.2 0.845 108.5 57.0 -64.1 -31.3 30.2 8.1 9.9 47 48 A T H ><5S+ 0 0 18 -4,-1.7 3,-1.3 -5,-0.2 -2,-0.2 0.946 109.5 42.1 -64.2 -48.8 29.6 5.3 7.3 48 49 A I H 3<5S+ 0 0 49 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.819 112.3 55.1 -67.7 -29.7 31.5 7.1 4.6 49 50 A L T 3<5S- 0 0 59 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.395 118.0-117.5 -83.1 3.1 34.2 8.0 7.1 50 51 A K T < 5S+ 0 0 150 -3,-1.3 2,-0.9 1,-0.2 -3,-0.2 0.731 71.4 132.9 69.7 27.6 34.4 4.3 7.9 51 52 A N >< + 0 0 63 -5,-3.0 4,-2.0 1,-0.2 5,-0.2 -0.798 25.9 175.8-108.4 89.2 33.4 4.3 11.6 52 53 A M H > S+ 0 0 45 -2,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.826 75.0 54.2 -61.5 -36.2 30.9 1.4 11.6 53 54 A T H > S+ 0 0 98 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.938 111.7 41.6 -66.9 -47.9 30.3 1.6 15.3 54 55 A E H > S+ 0 0 56 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.847 113.3 55.0 -69.6 -31.8 29.4 5.3 15.5 55 56 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.954 108.9 48.0 -63.8 -47.0 27.3 4.9 12.3 56 57 A E H X S+ 0 0 68 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.918 110.0 52.2 -58.5 -44.9 25.3 2.1 14.0 57 58 A K H X S+ 0 0 126 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.915 110.1 49.0 -57.8 -45.3 24.9 4.2 17.1 58 59 A A H X S+ 0 0 11 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.905 112.6 45.8 -62.7 -45.2 23.5 7.1 15.1 59 60 A F H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.862 111.2 54.0 -68.0 -33.5 21.0 5.0 13.1 60 61 A T H X S+ 0 0 39 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.894 109.6 47.2 -66.6 -38.1 19.9 3.3 16.3 61 62 A R H X S+ 0 0 115 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.878 109.8 54.1 -69.4 -36.8 19.3 6.7 17.8 62 63 A S H X S+ 0 0 0 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.940 111.2 45.5 -61.2 -46.4 17.4 7.7 14.7 63 64 A I H >< S+ 0 0 7 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.909 110.5 52.6 -64.2 -43.5 15.2 4.6 15.0 64 65 A N H 3< S+ 0 0 101 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.812 108.9 51.4 -64.2 -27.5 14.6 5.2 18.7 65 66 A R H 3< S+ 0 0 73 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.628 129.8 16.1 -82.9 -16.7 13.5 8.7 18.0 66 67 A D X< - 0 0 53 -3,-0.8 3,-2.0 -4,-0.8 -1,-0.3 -0.585 65.6-174.4-158.0 87.5 11.0 7.6 15.3 67 68 A K T 3 S+ 0 0 100 -3,-0.4 -3,-0.1 1,-0.3 -4,-0.1 0.512 85.9 54.8 -64.0 -6.7 10.2 3.9 15.5 68 69 A H T 3 S+ 0 0 120 -5,-0.1 2,-1.6 1,-0.0 -1,-0.3 0.324 70.9 115.3-110.0 6.9 8.1 4.1 12.3 69 70 A L X> - 0 0 5 -3,-2.0 3,-1.7 -6,-0.2 4,-1.1 -0.602 46.7-170.6 -80.4 89.0 10.8 5.7 10.1 70 71 A A H 3> S+ 0 0 0 -2,-1.6 4,-2.1 1,-0.3 3,-0.4 0.840 79.3 56.8 -48.9 -45.1 11.1 2.8 7.6 71 72 A V H 3> S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.729 99.5 60.7 -65.1 -20.8 14.2 4.2 5.8 72 73 A A H <> S+ 0 0 0 -3,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.908 107.6 44.2 -71.8 -40.5 16.1 4.3 9.1 73 74 A Y H X S+ 0 0 22 -4,-1.1 4,-2.3 -3,-0.4 -2,-0.2 0.902 113.5 51.9 -67.2 -41.8 15.7 0.6 9.5 74 75 A F H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.937 111.5 46.1 -60.0 -47.5 16.6 0.1 5.9 75 76 A Q H X S+ 0 0 29 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.889 113.0 48.1 -65.8 -41.3 19.8 2.2 6.2 76 77 A R H X S+ 0 0 34 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.885 111.1 53.3 -67.3 -34.3 20.9 0.5 9.4 77 78 A G H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.924 108.2 48.3 -64.5 -43.2 20.3 -2.8 7.8 78 79 A M H X S+ 0 0 8 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.727 108.7 55.7 -69.8 -20.4 22.4 -1.9 4.8 79 80 A L H X S+ 0 0 6 -4,-1.2 4,-0.9 2,-0.2 3,-0.3 0.904 104.7 51.6 -75.2 -43.5 25.1 -0.8 7.3 80 81 A Y H ><>S+ 0 0 15 -4,-2.2 5,-2.9 1,-0.2 3,-0.7 0.854 104.8 58.5 -59.8 -33.5 25.1 -4.3 8.9 81 82 A Y H ><5S+ 0 0 57 -4,-1.6 3,-2.1 1,-0.2 -1,-0.2 0.901 98.2 59.2 -62.3 -40.6 25.5 -5.7 5.4 82 83 A Q H 3<5S+ 0 0 99 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.762 108.7 43.8 -60.5 -26.3 28.7 -3.7 5.1 83 84 A T T <<5S- 0 0 42 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.149 119.4-111.7-103.5 17.2 30.2 -5.5 8.1 84 85 A E T < 5S+ 0 0 137 -3,-2.1 2,-1.5 1,-0.2 -3,-0.2 0.706 71.2 142.6 60.9 24.5 28.8 -8.8 6.8 85 86 A K >< + 0 0 92 -5,-2.9 4,-2.0 1,-0.2 -1,-0.2 -0.617 19.6 168.5 -93.2 74.9 26.3 -9.1 9.6 86 87 A Y H > + 0 0 45 -2,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.812 68.0 52.4 -60.0 -38.0 23.7 -10.6 7.3 87 88 A D H > S+ 0 0 105 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.901 111.6 46.1 -68.6 -40.1 21.2 -11.7 10.0 88 89 A L H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.885 112.1 53.3 -67.2 -36.8 21.1 -8.3 11.6 89 90 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.940 109.9 47.0 -61.5 -47.7 20.7 -6.9 8.1 90 91 A I H X S+ 0 0 9 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.901 109.0 54.7 -61.3 -42.7 17.7 -9.1 7.4 91 92 A K H X S+ 0 0 137 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.931 112.9 42.3 -58.2 -46.4 16.1 -8.3 10.7 92 93 A D H X S+ 0 0 4 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.891 113.7 50.8 -68.7 -40.7 16.3 -4.5 9.9 93 94 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.872 110.1 50.5 -65.6 -36.5 15.2 -4.9 6.3 94 95 A K H X S+ 0 0 85 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.854 111.5 48.1 -69.4 -33.3 12.2 -7.0 7.4 95 96 A E H X S+ 0 0 63 -4,-1.5 4,-2.4 -5,-0.2 -2,-0.2 0.874 107.7 55.7 -73.3 -35.9 11.3 -4.3 10.0 96 97 A A H < S+ 0 0 0 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.924 108.9 47.8 -60.2 -42.5 11.7 -1.7 7.3 97 98 A L H ><>S+ 0 0 48 -4,-2.0 3,-1.3 1,-0.2 5,-0.5 0.902 108.7 54.0 -64.4 -41.8 9.1 -3.6 5.2 98 99 A I H ><5S+ 0 0 105 -4,-1.9 3,-1.5 1,-0.3 -1,-0.2 0.901 104.8 55.4 -58.2 -41.5 6.8 -3.9 8.2 99 100 A Q T 3<5S+ 0 0 19 -4,-2.4 -29,-0.3 1,-0.3 -1,-0.3 0.571 92.9 68.1 -71.2 -9.2 6.9 -0.1 8.6 100 101 A L T X 5S- 0 0 1 -3,-1.3 3,-1.6 -4,-0.4 -1,-0.3 0.643 95.7-146.3 -80.9 -14.7 5.8 0.4 5.0 101 102 A R T < 5 - 0 0 167 -3,-1.5 -3,-0.1 -4,-0.4 -2,-0.1 0.859 62.5 -50.2 51.3 47.2 2.5 -1.0 6.2 102 103 A G T 3 > + 0 0 9 7,-2.4 5,-2.0 -2,-0.5 3,-1.6 0.299 59.9 108.5 -95.1 12.4 10.5 10.9 1.6 109 110 A K G > 5S+ 0 0 165 1,-0.3 3,-1.8 3,-0.2 -1,-0.2 0.894 74.9 58.9 -53.9 -41.0 10.3 14.2 -0.2 110 111 A I G 3 5S+ 0 0 153 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.751 107.6 46.5 -62.6 -23.2 8.1 15.6 2.5 111 112 A L G < 5S- 0 0 54 -3,-1.6 -1,-0.3 2,-0.2 -2,-0.2 0.376 124.7-102.1 -98.2 2.5 10.8 14.9 5.0 112 113 A G T < 5S+ 0 0 24 -3,-1.8 71,-1.9 -4,-0.4 2,-0.6 0.542 84.9 119.6 92.1 6.6 13.5 16.5 2.8 113 114 A L B < -B 182 0B 0 -5,-2.0 2,-2.4 69,-0.2 -5,-0.2 -0.934 58.9-142.5-110.5 117.7 15.1 13.3 1.5 114 115 A Q + 0 0 138 -2,-0.6 2,-0.3 67,-0.5 68,-0.0 -0.449 64.5 106.5 -75.4 70.2 15.0 12.8 -2.3 115 116 A F - 0 0 27 -2,-2.4 -7,-2.4 61,-0.1 2,-0.5 -0.987 56.0-149.9-154.0 140.9 14.4 9.1 -2.1 116 117 A K E -A 107 0A 90 -2,-0.3 2,-0.8 -9,-0.2 -9,-0.2 -0.954 13.7-152.5-112.3 120.6 11.6 6.6 -2.7 117 118 A L E -A 106 0A 1 -11,-2.6 -11,-1.5 -2,-0.5 2,-0.4 -0.844 16.4-160.7 -95.7 106.9 11.7 3.4 -0.6 118 119 A F E > -A 105 0A 8 -2,-0.8 4,-1.8 -13,-0.2 3,-0.5 -0.716 21.1-139.5 -91.6 137.6 10.0 0.7 -2.6 119 120 A A H > S+ 0 0 0 -15,-2.3 4,-2.5 -2,-0.4 5,-0.2 0.883 105.3 57.2 -59.3 -38.6 8.7 -2.4 -0.9 120 121 A C H > S+ 0 0 0 -16,-0.5 4,-1.8 29,-0.5 -1,-0.2 0.847 107.2 47.4 -63.4 -33.0 9.9 -4.4 -3.9 121 122 A E H > S+ 0 0 13 -3,-0.5 4,-2.0 2,-0.2 53,-0.3 0.812 109.0 53.4 -78.2 -29.5 13.4 -3.2 -3.5 122 123 A V H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.934 112.5 44.9 -67.7 -43.5 13.3 -3.9 0.3 123 124 A L H X S+ 0 0 4 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.882 109.5 57.0 -63.9 -38.7 12.3 -7.5 -0.6 124 125 A Y H X S+ 0 0 15 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.880 110.8 43.3 -58.8 -40.3 15.0 -7.4 -3.3 125 126 A N H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.842 110.3 54.2 -76.5 -34.1 17.6 -6.6 -0.6 126 127 A I H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.936 110.2 48.2 -64.0 -43.8 16.2 -9.2 1.9 127 128 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.885 107.6 56.9 -62.2 -38.8 16.5 -11.8 -0.8 128 129 A F H X S+ 0 0 4 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.904 104.7 50.5 -59.9 -43.8 20.1 -10.6 -1.5 129 130 A M H X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.905 110.6 49.5 -62.5 -41.3 21.1 -11.2 2.2 130 131 A Y H <>S+ 0 0 20 -4,-1.9 5,-2.9 1,-0.2 3,-0.4 0.912 109.2 52.3 -63.4 -40.6 19.7 -14.7 2.0 131 132 A A H ><5S+ 0 0 2 -4,-2.5 3,-1.6 1,-0.3 -2,-0.2 0.886 106.0 54.3 -61.2 -38.8 21.6 -15.3 -1.2 132 133 A K H 3<5S+ 0 0 63 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.800 107.8 50.1 -64.8 -28.1 24.8 -14.1 0.6 133 134 A K T 3<5S- 0 0 69 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.337 118.2-117.1 -90.3 5.6 24.0 -16.7 3.2 134 135 A E T < 5S+ 0 0 155 -3,-1.6 2,-0.9 1,-0.2 -3,-0.2 0.781 73.7 136.3 62.5 28.7 23.6 -19.3 0.4 135 136 A E >< + 0 0 57 -5,-2.9 4,-1.7 1,-0.2 -1,-0.2 -0.691 22.0 167.1-104.1 74.8 20.0 -19.8 1.4 136 137 A W H > + 0 0 41 -2,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.749 67.7 58.7 -64.1 -28.5 18.7 -19.7 -2.2 137 138 A K H > S+ 0 0 151 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.966 110.0 42.7 -66.5 -50.7 15.2 -21.1 -1.4 138 139 A K H > S+ 0 0 87 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.844 112.4 55.4 -63.8 -32.5 14.5 -18.2 1.0 139 140 A A H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.931 108.9 46.9 -65.2 -45.1 16.1 -15.8 -1.5 140 141 A E H X S+ 0 0 92 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.894 108.5 56.1 -63.4 -40.5 13.7 -17.0 -4.2 141 142 A E H X S+ 0 0 82 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.907 109.1 45.7 -59.7 -42.7 10.7 -16.7 -1.9 142 143 A Q H X S+ 0 0 29 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.906 113.4 48.9 -68.6 -40.9 11.4 -13.1 -1.2 143 144 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.847 104.3 60.5 -66.6 -33.1 12.0 -12.2 -4.8 144 145 A A H X S+ 0 0 44 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.932 107.6 44.9 -59.3 -44.7 8.7 -14.0 -5.8 145 146 A L H >< S+ 0 0 102 -4,-1.5 3,-1.0 1,-0.2 -1,-0.2 0.900 110.4 55.9 -64.2 -41.3 6.8 -11.6 -3.6 146 147 A A H >< S+ 0 0 0 -4,-1.9 3,-2.3 1,-0.2 -2,-0.2 0.846 95.3 64.6 -61.1 -36.6 8.8 -8.7 -5.0 147 148 A T H >< S+ 0 0 47 -4,-2.2 3,-0.7 1,-0.3 -1,-0.2 0.809 99.7 54.2 -59.3 -28.0 7.8 -9.5 -8.6 148 149 A S T << S+ 0 0 105 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.352 107.3 52.3 -87.4 6.6 4.2 -8.8 -7.7 149 150 A M T < S+ 0 0 41 -3,-2.3 -29,-0.5 6,-0.1 -1,-0.2 0.113 72.5 138.6-128.4 21.6 5.2 -5.3 -6.4 150 151 A K < + 0 0 86 -3,-0.7 -3,-0.0 1,-0.1 6,-0.0 -0.335 13.9 161.5 -66.9 150.6 7.1 -3.8 -9.3 151 152 A S + 0 0 75 1,-0.3 -1,-0.1 -47,-0.0 -47,-0.0 0.569 52.2 46.0-137.3 -42.8 6.4 -0.1 -10.1 152 153 A E S > S- 0 0 59 1,-0.1 3,-1.1 0, 0.0 -1,-0.3 -0.645 80.9-109.8-109.6 165.5 9.2 1.5 -12.2 153 154 A P G > S+ 0 0 118 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.775 118.4 61.1 -61.6 -26.2 11.2 0.5 -15.3 154 155 A R G > S+ 0 0 184 1,-0.3 3,-2.2 2,-0.1 4,-0.1 0.781 84.3 77.4 -70.6 -28.1 14.2 0.1 -13.0 155 156 A H G X + 0 0 1 -3,-1.1 3,-1.7 1,-0.3 4,-0.5 0.446 66.1 90.5 -63.8 2.2 12.4 -2.6 -11.1 156 157 A S G <> + 0 0 65 -3,-1.0 4,-1.7 1,-0.3 3,-0.4 0.654 69.3 77.9 -70.5 -13.1 13.2 -4.9 -14.0 157 158 A K H <> S+ 0 0 61 -3,-2.2 4,-2.2 1,-0.2 -1,-0.3 0.779 82.0 65.1 -64.4 -25.8 16.2 -5.5 -11.8 158 159 A I H <> S+ 0 0 0 -3,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.929 101.6 47.1 -61.8 -45.5 13.9 -7.7 -9.8 159 160 A D H > S+ 0 0 65 -4,-0.5 4,-2.3 -3,-0.4 -2,-0.2 0.905 110.5 51.9 -62.9 -42.4 13.6 -10.0 -12.8 160 161 A K H X S+ 0 0 130 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.876 108.3 52.3 -63.1 -36.2 17.3 -10.1 -13.3 161 162 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.893 107.8 50.9 -67.1 -39.4 17.8 -11.0 -9.6 162 163 A M H X S+ 0 0 21 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.943 109.1 51.1 -62.9 -45.5 15.3 -13.9 -10.0 163 164 A E H X S+ 0 0 74 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.871 110.4 50.2 -59.5 -36.3 17.3 -15.1 -13.0 164 165 A C H ><>S+ 0 0 24 -4,-1.8 5,-2.6 1,-0.2 3,-0.9 0.923 109.3 50.0 -67.6 -43.9 20.5 -14.9 -10.9 165 166 A V H ><5S+ 0 0 7 -4,-2.6 3,-1.8 1,-0.3 -2,-0.2 0.860 100.3 65.0 -63.0 -34.6 18.9 -16.9 -8.1 166 167 A W H 3<5S+ 0 0 176 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.820 113.4 33.8 -56.9 -31.5 17.8 -19.6 -10.6 167 168 A K T <<5S- 0 0 124 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.152 117.5-111.0-110.7 19.4 21.5 -20.2 -11.2 168 169 A Q T < 5S+ 0 0 125 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.909 70.9 141.2 51.1 50.6 22.6 -19.5 -7.6 169 170 A K < - 0 0 128 -5,-2.6 -1,-0.2 -8,-0.2 2,-0.1 -0.875 48.1-119.5-118.8 151.2 24.4 -16.3 -8.6 170 171 A L - 0 0 84 -2,-0.3 2,-0.3 -39,-0.0 -42,-0.0 -0.421 24.7-167.7 -88.0 165.7 24.6 -13.1 -6.8 171 172 A Y - 0 0 21 -2,-0.1 -10,-0.0 -43,-0.1 -40,-0.0 -0.837 34.4 -77.2-141.1 176.6 23.4 -9.6 -7.9 172 173 A E - 0 0 153 -2,-0.3 -11,-0.1 1,-0.0 -44,-0.0 -0.695 42.7-135.9 -87.5 125.2 23.8 -6.0 -6.8 173 174 A P - 0 0 16 0, 0.0 2,-0.4 0, 0.0 -48,-0.1 -0.287 24.9-104.6 -72.9 162.2 21.8 -4.8 -3.8 174 175 A V + 0 0 12 -53,-0.3 2,-0.3 -52,-0.0 -49,-0.0 -0.718 43.5 175.2 -88.7 136.0 20.0 -1.5 -3.8 175 176 A V - 0 0 84 -2,-0.4 -100,-0.0 3,-0.0 3,-0.0 -0.962 37.8-105.3-138.0 155.9 21.5 1.3 -1.7 176 177 A I - 0 0 10 -2,-0.3 3,-0.1 1,-0.1 -61,-0.1 -0.688 52.6-103.6 -78.7 129.5 20.8 4.9 -1.1 177 178 A P > - 0 0 56 0, 0.0 3,-2.0 0, 0.0 2,-0.1 -0.239 38.1-102.5 -55.2 139.8 23.4 6.9 -3.0 178 179 A V T 3 S+ 0 0 103 1,-0.3 3,-0.1 -3,-0.0 -133,-0.0 -0.439 111.2 32.1 -62.8 133.7 26.2 8.4 -0.9 179 180 A G T 3 S+ 0 0 23 1,-0.3 2,-1.0 -2,-0.1 -1,-0.3 0.223 84.0 120.6 102.2 -16.0 25.4 12.1 -0.4 180 181 A R < + 0 0 77 -3,-2.0 -1,-0.3 -67,-0.1 2,-0.2 -0.752 43.1 155.3 -85.3 104.9 21.6 11.7 -0.6 181 182 A L - 0 0 4 -2,-1.0 -67,-0.5 -69,-0.1 2,-0.4 -0.734 52.8 -84.1-127.5 173.9 20.5 13.1 2.8 182 183 A F B -B 113 0B 0 -145,-0.3 -69,-0.2 -2,-0.2 -70,-0.2 -0.688 53.9-168.0 -76.4 128.6 17.6 14.6 4.6 183 184 A R - 0 0 82 -71,-1.9 -173,-0.1 -2,-0.4 3,-0.1 -0.888 22.0-110.5-121.6 151.6 17.8 18.3 3.8 184 185 A P - 0 0 15 0, 0.0 2,-0.2 0, 0.0 -73,-0.0 -0.354 48.2 -90.7 -73.6 162.7 16.0 21.4 5.3 185 186 A N >> - 0 0 87 1,-0.1 4,-2.0 -2,-0.0 3,-0.7 -0.507 25.7-125.0 -78.5 144.6 13.5 23.1 3.1 186 187 A E H 3> S+ 0 0 163 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.851 110.9 57.2 -53.5 -37.5 14.6 26.0 0.8 187 188 A R H 3> S+ 0 0 171 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.880 106.9 48.3 -63.7 -37.6 12.0 28.3 2.4 188 189 A Q H <4 S+ 0 0 78 -3,-0.7 4,-0.3 2,-0.2 3,-0.3 0.898 112.2 47.8 -69.3 -42.4 13.4 27.7 5.9 189 190 A V H >< S+ 0 0 36 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.887 109.7 53.9 -66.0 -38.0 16.9 28.4 4.8 190 191 A A H 3< S+ 0 0 72 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.750 100.3 61.0 -68.5 -23.9 15.8 31.5 3.0 191 192 A Q T 3< 0 0 142 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.566 360.0 360.0 -80.1 -7.4 14.2 32.8 6.1 192 193 A L < 0 0 93 -3,-1.3 -3,-0.0 -4,-0.3 -189,-0.0 -0.365 360.0 360.0 -67.6 360.0 17.6 32.8 7.9