==== 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 METAL BINDING PROTEIN 07-DEC-05 2D8N . COMPND 2 MOLECULE: RECOVERIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.KAMO,S.KISHISHITA,K.MURAYAMA,M.SHIROUZU,S.YOKOYAMA,RIKEN S . 197 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11150.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 65.5 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 . 7 3.6 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 . 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 . 1 0.5 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 . 9 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 45.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 1 0 3 3 0 0 2 0 0 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 . 0 1 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 . 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 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 1 A X > 0 0 190 0, 0.0 3,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 55.2 -31.4 6.6 -5.5 2 2 A G T 3 + 0 0 64 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.245 360.0 60.6 -65.2 159.4 -27.7 6.2 -5.0 3 3 A N T 3 S+ 0 0 178 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.226 104.4 65.9 100.1 -2.0 -25.2 8.7 -6.5 4 4 A S < + 0 0 69 -3,-0.6 2,-0.4 3,-0.0 3,-0.1 -0.813 57.9 160.9-152.4 101.8 -27.0 11.3 -4.3 5 5 A K > + 0 0 119 -2,-0.3 3,-1.2 1,-0.1 -3,-0.0 -0.892 24.9 179.7-137.6 114.1 -26.9 11.3 -0.5 6 6 A S T 3 S+ 0 0 120 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 0.777 99.1 50.9 -70.2 -23.1 -27.7 14.1 1.8 7 7 A G T 3 S+ 0 0 15 -3,-0.1 -1,-0.3 29,-0.0 2,-0.2 0.285 85.4 115.6 -99.7 12.1 -26.9 11.5 4.4 8 8 A A < - 0 0 40 -3,-1.2 -3,-0.0 1,-0.1 21,-0.0 -0.571 55.4-147.6 -84.0 144.0 -23.6 10.4 3.0 9 9 A L - 0 0 21 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 0.993 31.7-115.9 -72.9 -76.5 -20.5 10.9 5.0 10 10 A S > - 0 0 35 2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.468 9.4-116.9 142.1 146.9 -17.5 11.5 2.6 11 11 A K H > S+ 0 0 146 2,-0.2 4,-1.1 -2,-0.2 5,-0.1 0.797 112.0 51.7 -85.2 -22.9 -14.4 9.6 2.0 12 12 A E H > S+ 0 0 149 2,-0.2 4,-2.6 3,-0.1 5,-0.2 0.951 116.1 40.6 -72.6 -47.5 -12.0 12.3 3.1 13 13 A I H > S+ 0 0 40 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.934 112.7 54.5 -63.0 -49.4 -13.8 12.7 6.5 14 14 A L H X S+ 0 0 6 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.854 112.6 46.0 -54.7 -33.5 -14.3 9.0 6.9 15 15 A E H X S+ 0 0 115 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.939 109.4 50.2 -78.3 -49.1 -10.6 8.6 6.5 16 16 A E H X S+ 0 0 84 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.933 114.7 48.1 -53.4 -45.3 -9.5 11.3 8.8 17 17 A L H X S+ 0 0 0 -4,-2.8 4,-0.7 1,-0.2 6,-0.3 0.873 107.7 52.4 -66.0 -39.2 -11.8 9.8 11.4 18 18 A Q H < S+ 0 0 78 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.818 110.3 51.8 -68.1 -24.8 -10.6 6.2 10.9 19 19 A L H < S+ 0 0 125 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.931 114.8 38.2 -74.0 -49.0 -7.1 7.5 11.4 20 20 A N H < S+ 0 0 63 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.2 0.308 119.3 42.1 -86.8 5.5 -7.7 9.3 14.7 21 21 A T S < S- 0 0 13 -4,-0.7 67,-0.0 -3,-0.2 75,-0.0 -0.831 74.7-120.7-141.8-178.7 -10.1 6.9 16.2 22 22 A K S S+ 0 0 167 -2,-0.3 2,-0.3 2,-0.1 -4,-0.1 0.129 73.9 118.7-108.4 13.8 -10.8 3.1 16.8 23 23 A F - 0 0 67 -6,-0.3 -2,-0.2 1,-0.1 2,-0.1 -0.611 60.7-129.5 -86.2 142.5 -14.1 3.3 15.0 24 24 A S > - 0 0 52 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.410 26.0-108.8 -84.0 165.1 -14.8 1.3 11.9 25 25 A E H > S+ 0 0 107 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.878 122.6 49.8 -58.8 -40.2 -16.3 2.9 8.7 26 26 A E H > S+ 0 0 164 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.866 109.7 51.2 -68.5 -36.2 -19.5 1.1 9.4 27 27 A E H > S+ 0 0 95 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.929 111.9 46.6 -67.4 -43.5 -19.6 2.4 13.0 28 28 A L H X S+ 0 0 0 -4,-2.5 4,-3.6 2,-0.2 5,-0.2 0.943 112.6 48.8 -62.5 -49.7 -19.0 6.0 11.9 29 29 A C H X S+ 0 0 41 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.908 112.9 47.7 -60.8 -42.2 -21.6 5.9 9.1 30 30 A S H X S+ 0 0 78 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.906 114.5 46.4 -66.4 -37.5 -24.2 4.5 11.5 31 31 A W H X S+ 0 0 56 -4,-2.1 4,-2.9 2,-0.2 3,-0.2 0.956 111.0 53.8 -66.1 -46.9 -23.3 7.1 14.2 32 32 A Y H X S+ 0 0 29 -4,-3.6 4,-2.3 1,-0.2 -2,-0.2 0.896 103.8 55.5 -54.9 -42.2 -23.4 9.8 11.5 33 33 A Q H X S+ 0 0 83 -4,-2.2 4,-0.7 1,-0.2 -1,-0.2 0.918 111.8 42.0 -61.8 -41.8 -26.9 8.8 10.4 34 34 A S H >X S+ 0 0 71 -4,-1.5 4,-1.1 -3,-0.2 3,-0.7 0.870 110.0 57.2 -70.5 -40.5 -28.2 9.2 14.0 35 35 A F H 3X S+ 0 0 10 -4,-2.9 4,-1.9 1,-0.2 3,-0.5 0.901 102.6 56.7 -56.6 -39.4 -26.3 12.4 14.5 36 36 A L H 3< S+ 0 0 22 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.753 99.8 60.3 -63.9 -24.0 -28.2 13.9 11.4 37 37 A K H << S+ 0 0 136 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.835 115.4 30.8 -75.3 -36.1 -31.5 13.1 13.1 38 38 A D H < S+ 0 0 130 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.667 132.6 36.7 -93.7 -13.2 -30.8 15.4 16.1 39 39 A C >< + 0 0 9 -4,-1.9 3,-2.9 -5,-0.2 -1,-0.2 -0.571 68.1 174.1-135.9 69.5 -28.6 17.8 14.0 40 40 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.653 78.6 58.3 -52.6 -22.8 -30.2 18.0 10.5 41 41 A T T 3 S- 0 0 114 2,-0.3 3,-0.1 41,-0.0 -5,-0.1 0.655 113.6-119.2 -80.9 -13.0 -27.8 20.8 9.3 42 42 A G S < S+ 0 0 8 -3,-2.9 41,-0.8 1,-0.3 2,-0.4 0.577 84.1 100.8 83.8 11.3 -25.0 18.3 10.0 43 43 A R E -A 82 0A 103 39,-0.2 2,-0.4 -4,-0.1 -2,-0.3 -0.982 60.6-147.3-129.9 141.1 -23.5 20.8 12.6 44 44 A I E -A 81 0A 6 37,-3.1 37,-2.1 -2,-0.4 2,-0.2 -0.844 18.3-128.9-110.4 146.2 -23.9 20.7 16.4 45 45 A T E > -A 80 0A 53 -2,-0.4 4,-2.8 35,-0.2 5,-0.2 -0.490 20.7-111.2 -91.8 164.7 -24.0 23.8 18.6 46 46 A Q H > S+ 0 0 35 33,-1.2 4,-2.8 1,-0.2 5,-0.2 0.913 120.0 51.4 -50.3 -52.6 -22.1 24.9 21.7 47 47 A Q H > S+ 0 0 137 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.904 111.9 45.2 -59.1 -43.4 -25.2 24.5 23.7 48 48 A Q H > S+ 0 0 63 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.903 112.5 51.1 -69.1 -38.6 -25.9 20.9 22.5 49 49 A F H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 3,-0.3 0.947 110.6 48.7 -63.3 -46.2 -22.3 19.9 22.9 50 50 A Q H X S+ 0 0 38 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.855 107.2 56.7 -59.3 -36.0 -22.3 21.1 26.5 51 51 A S H X S+ 0 0 53 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.845 99.8 59.5 -67.0 -32.4 -25.6 19.3 27.1 52 52 A I H X S+ 0 0 36 -4,-1.7 4,-1.0 -3,-0.3 -1,-0.2 0.944 110.9 40.4 -61.0 -47.6 -24.0 16.1 26.1 53 53 A Y H < S+ 0 0 8 -4,-1.5 4,-0.5 1,-0.2 -1,-0.2 0.845 110.8 56.2 -70.0 -33.4 -21.4 16.4 28.9 54 54 A A H >< S+ 0 0 37 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.866 106.7 52.0 -68.3 -32.4 -23.8 17.7 31.4 55 55 A K H 3< S+ 0 0 152 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.786 111.5 44.8 -73.2 -26.5 -25.9 14.6 31.0 56 56 A F T 3< S+ 0 0 136 -4,-1.0 -1,-0.2 -3,-0.2 -2,-0.2 0.277 102.8 65.6-101.8 8.4 -23.1 12.1 31.5 57 57 A F X + 0 0 61 -3,-0.7 3,-0.7 -4,-0.5 -1,-0.2 -0.782 60.1 172.0-128.9 80.2 -21.4 13.8 34.5 58 58 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.790 75.5 37.7 -62.7 -34.9 -24.1 13.4 37.3 59 59 A D T 3 S+ 0 0 135 73,-0.1 2,-0.2 75,-0.0 74,-0.0 0.391 117.2 40.0-101.7 1.6 -22.1 14.6 40.2 60 60 A T S < S- 0 0 35 -3,-0.7 72,-0.2 -6,-0.1 -3,-0.1 -0.756 77.2-106.5-140.4-175.1 -20.1 17.4 38.7 61 61 A D + 0 0 62 70,-2.6 3,-0.4 -2,-0.2 4,-0.3 -0.766 34.9 161.9-124.6 89.5 -20.2 20.3 36.3 62 62 A P > + 0 0 1 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.376 47.6 102.1 -86.5 7.3 -18.3 19.7 33.0 63 63 A K H > S+ 0 0 79 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.916 80.6 46.3 -59.5 -47.5 -20.0 22.6 31.1 64 64 A A H > S+ 0 0 32 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.903 115.8 48.3 -61.7 -41.0 -17.1 25.1 31.2 65 65 A Y H > S+ 0 0 0 63,-0.4 4,-2.6 -4,-0.3 -1,-0.2 0.961 111.0 49.9 -63.4 -48.6 -14.7 22.4 30.2 66 66 A A H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.875 108.5 53.9 -56.6 -38.5 -17.0 21.3 27.4 67 67 A Q H X S+ 0 0 68 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.898 109.5 47.1 -63.0 -41.0 -17.2 24.9 26.2 68 68 A H H X S+ 0 0 6 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.884 112.2 50.0 -67.0 -38.8 -13.4 25.2 26.0 69 69 A V H X S+ 0 0 0 -4,-2.6 4,-0.8 2,-0.2 -2,-0.2 0.951 112.1 46.7 -62.4 -51.6 -13.1 21.9 24.2 70 70 A F H >X S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.2 4,-1.1 0.957 111.5 53.0 -54.3 -53.1 -15.8 23.0 21.6 71 71 A R H >< S+ 0 0 34 -4,-2.9 3,-1.0 1,-0.3 -1,-0.2 0.899 102.5 58.4 -50.3 -44.8 -14.0 26.4 21.3 72 72 A S H 3< S+ 0 0 19 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.669 113.3 38.5 -61.0 -21.3 -10.7 24.6 20.5 73 73 A F H << S+ 0 0 32 -3,-1.8 2,-1.7 -4,-0.8 -1,-0.3 0.483 90.0 96.7-105.8 -7.5 -12.2 22.8 17.5 74 74 A D X< + 0 0 11 -4,-1.1 3,-0.7 -3,-1.0 -1,-0.1 -0.605 48.9 171.9 -87.0 80.1 -14.4 25.7 16.3 75 75 A S T 3 S+ 0 0 111 -2,-1.7 -1,-0.2 1,-0.3 6,-0.1 0.904 79.0 36.8 -51.7 -57.3 -12.0 27.1 13.6 76 76 A N T 3 S- 0 0 89 4,-0.2 -1,-0.3 1,-0.0 -2,-0.1 0.365 109.6-124.6 -81.2 1.2 -14.2 29.6 12.0 77 77 A L < + 0 0 128 -3,-0.7 -2,-0.1 -6,-0.2 -3,-0.1 0.845 61.3 146.5 56.7 36.2 -15.6 30.3 15.4 78 78 A D - 0 0 96 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.765 67.2-116.7 -67.4 -34.9 -19.2 29.7 14.3 79 79 A G S S+ 0 0 24 1,-0.4 -33,-1.2 -9,-0.1 2,-0.3 0.630 88.6 95.5 92.9 20.0 -20.3 28.2 17.6 80 80 A T E -A 45 0A 27 -35,-0.2 -1,-0.4 -34,-0.1 2,-0.4 -0.994 56.6-159.5-142.4 151.8 -20.8 25.0 15.5 81 81 A L E -A 44 0A 0 -37,-2.1 -37,-3.1 -2,-0.3 2,-0.1 -0.970 18.7-132.3-126.9 143.3 -18.8 21.8 14.8 82 82 A D E > -A 43 0A 38 -2,-0.4 4,-2.2 -39,-0.2 3,-0.3 -0.359 42.6 -88.4 -84.2 174.1 -19.4 19.5 11.9 83 83 A F H > S+ 0 0 6 -41,-0.8 4,-3.0 1,-0.2 5,-0.2 0.907 125.7 52.3 -49.9 -51.0 -19.6 15.7 12.6 84 84 A K H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.894 111.7 44.7 -55.6 -47.0 -15.9 15.1 12.2 85 85 A E H > S+ 0 0 26 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.836 113.3 51.4 -69.4 -31.0 -14.9 17.8 14.6 86 86 A Y H X S+ 0 0 25 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.932 110.5 48.7 -73.5 -39.0 -17.5 16.7 17.1 87 87 A V H X S+ 0 0 0 -4,-3.0 4,-0.9 -5,-0.2 -2,-0.2 0.954 114.9 44.2 -63.9 -47.1 -16.3 13.1 16.9 88 88 A I H X S+ 0 0 15 -4,-2.2 4,-1.8 -5,-0.2 3,-0.4 0.892 111.1 54.7 -62.9 -39.3 -12.7 14.1 17.4 89 89 A A H X S+ 0 0 0 -4,-2.1 4,-1.1 1,-0.3 3,-0.3 0.926 104.2 53.9 -61.3 -41.5 -13.6 16.5 20.2 90 90 A L H X S+ 0 0 41 -4,-2.2 4,-0.7 1,-0.2 -1,-0.3 0.751 108.5 53.2 -64.5 -23.2 -15.4 13.7 22.1 91 91 A H H < S+ 0 0 45 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.841 94.6 65.8 -81.9 -32.1 -12.1 11.8 21.8 92 92 A X H < S+ 0 0 16 -4,-1.8 3,-0.2 -3,-0.3 -2,-0.2 0.916 96.3 60.1 -57.4 -39.3 -9.8 14.5 23.3 93 93 A T H < S+ 0 0 14 -4,-1.1 2,-1.2 1,-0.2 -1,-0.2 0.959 105.4 40.5 -51.7 -75.2 -11.5 14.1 26.6 94 94 A T S < S- 0 0 108 -4,-0.7 -1,-0.2 1,-0.1 95,-0.0 -0.643 95.8-122.7 -85.2 93.7 -10.8 10.5 27.5 95 95 A A + 0 0 43 -2,-1.2 -1,-0.1 -3,-0.2 0, 0.0 0.381 50.4 153.1 9.8-106.0 -7.3 9.7 26.4 96 96 A G S S+ 0 0 52 -3,-0.1 -1,-0.2 -75,-0.0 2,-0.2 0.602 86.3 32.4 66.5 8.5 -7.5 6.8 23.9 97 97 A K S S- 0 0 123 -5,-0.1 3,-0.4 -6,-0.1 2,-0.3 -0.514 80.2-156.5 168.7 115.6 -4.3 8.5 22.7 98 98 A T S S+ 0 0 72 1,-0.2 3,-0.2 -2,-0.2 4,-0.1 -0.791 89.2 30.3-105.6 154.4 -1.8 10.3 24.9 99 99 A N S > S+ 0 0 72 1,-0.3 2,-1.0 -2,-0.3 3,-0.5 0.724 98.3 177.9 62.3 17.6 0.7 13.0 23.5 100 100 A Q T 3 - 0 0 15 -3,-0.4 5,-0.3 1,-0.3 -1,-0.3 -0.411 61.1 -33.5 -57.3 92.8 -2.6 12.8 21.7 101 101 A K T >> - 0 0 91 -2,-1.0 4,-1.4 -3,-0.2 3,-0.6 0.915 59.5-155.2 47.9 93.5 -2.1 15.6 19.2 102 102 A L H <> S+ 0 0 23 -3,-0.5 4,-2.1 1,-0.2 5,-0.2 0.780 95.7 73.9 -64.8 -20.5 -0.0 18.0 21.3 103 103 A E H 3> S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.890 95.6 42.9 -54.4 -49.2 -1.7 20.2 18.6 104 104 A W H <> S+ 0 0 18 -3,-0.6 4,-2.3 -4,-0.2 -1,-0.2 0.891 109.4 56.3 -67.8 -41.9 -5.1 19.9 20.4 105 105 A A H X S+ 0 0 13 -4,-1.4 4,-2.3 -5,-0.3 -2,-0.2 0.906 109.5 48.4 -59.0 -38.3 -3.7 20.4 23.9 106 106 A F H X S+ 0 0 7 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.960 110.8 49.2 -67.6 -47.6 -2.2 23.8 22.6 107 107 A S H < S+ 0 0 44 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.865 110.7 52.0 -59.9 -34.6 -5.4 24.9 21.0 108 108 A L H < S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.963 112.8 42.7 -67.2 -47.8 -7.3 24.1 24.2 109 109 A Y H < S+ 0 0 5 -4,-2.3 2,-1.7 1,-0.2 9,-0.3 0.704 96.3 77.9 -72.7 -23.1 -4.9 26.1 26.4 110 110 A D >< + 0 0 11 -4,-2.1 3,-1.2 1,-0.2 -1,-0.2 -0.591 63.1 171.2 -85.5 75.5 -4.7 29.1 23.9 111 111 A V T 3 S+ 0 0 31 -2,-1.7 -1,-0.2 1,-0.3 6,-0.1 0.922 73.2 46.6 -53.0 -51.0 -8.1 30.4 25.1 112 112 A D T 3 S- 0 0 122 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.580 103.1-133.0 -68.2 -16.3 -7.9 33.7 23.2 113 113 A G < + 0 0 57 -3,-1.2 -2,-0.1 3,-0.2 -1,-0.1 0.680 64.8 132.8 67.8 19.7 -6.8 31.9 20.2 114 114 A N S S- 0 0 89 2,-0.3 3,-0.1 1,-0.0 -1,-0.1 0.454 79.7-100.4 -82.4 -3.6 -4.0 34.5 19.8 115 115 A G S S+ 0 0 39 1,-0.3 54,-0.6 -5,-0.1 2,-0.3 0.412 94.2 65.6 103.2 -6.6 -1.2 32.0 19.2 116 116 A T E S-B 168 0B 34 52,-0.2 2,-0.5 53,-0.1 -1,-0.3 -0.912 75.1-118.0-138.1 171.5 0.5 31.8 22.6 117 117 A I E -B 167 0B 2 50,-3.3 50,-3.0 -2,-0.3 2,-0.2 -0.941 23.1-165.7-115.1 135.0 -0.5 30.7 26.0 118 118 A S > - 0 0 21 -2,-0.5 4,-1.8 -9,-0.3 3,-0.2 -0.689 34.8-110.8-108.5 167.6 -0.5 33.1 29.0 119 119 A K H > S+ 0 0 30 44,-0.5 4,-2.6 46,-0.4 5,-0.2 0.812 118.0 58.4 -70.0 -30.1 -0.7 32.0 32.6 120 120 A N H > S+ 0 0 129 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.850 105.2 50.8 -66.4 -37.5 -4.2 33.3 33.0 121 121 A E H > S+ 0 0 7 2,-0.2 4,-2.3 -3,-0.2 5,-0.2 0.913 109.4 51.1 -66.2 -41.2 -5.3 30.9 30.1 122 122 A V H X S+ 0 0 3 -4,-1.8 4,-2.4 1,-0.2 5,-0.2 0.975 111.5 46.2 -58.0 -56.4 -3.7 28.0 31.9 123 123 A L H X S+ 0 0 40 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.913 109.8 55.9 -52.5 -44.5 -5.5 28.8 35.1 124 124 A E H X S+ 0 0 83 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.931 110.6 43.4 -56.5 -44.9 -8.8 29.2 33.2 125 125 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.918 113.1 51.0 -69.3 -43.5 -8.5 25.7 31.7 126 126 A V H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.864 108.1 53.6 -63.7 -35.5 -7.4 24.1 35.0 127 127 A X H X S+ 0 0 84 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.896 107.3 51.3 -64.8 -39.7 -10.4 25.7 36.7 128 128 A A H X S+ 0 0 3 -4,-1.7 4,-0.6 -5,-0.2 -63,-0.4 0.904 109.5 50.4 -63.5 -39.1 -12.8 24.2 34.2 129 129 A I H >X S+ 0 0 2 -4,-2.1 3,-1.0 1,-0.2 4,-0.5 0.877 105.9 54.3 -65.8 -40.8 -11.2 20.8 34.8 130 130 A F H >< S+ 0 0 28 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.860 100.4 61.9 -61.0 -33.8 -11.6 21.0 38.6 131 131 A K H 3< S+ 0 0 108 -4,-1.5 -70,-2.6 1,-0.2 -1,-0.2 0.778 102.6 53.0 -66.5 -18.2 -15.3 21.8 38.1 132 132 A X H << S+ 0 0 7 -3,-1.0 -1,-0.2 -4,-0.6 2,-0.2 0.600 102.4 62.8 -95.7 -7.8 -15.6 18.3 36.5 133 133 A I S << S- 0 0 12 -3,-1.1 -72,-0.2 -4,-0.5 58,-0.0 -0.694 83.6-109.2-113.3 167.3 -14.0 16.2 39.2 134 134 A T > - 0 0 33 -2,-0.2 4,-2.0 1,-0.1 3,-0.3 -0.506 24.2-111.5 -95.8 160.3 -15.2 15.6 42.8 135 135 A P H > S+ 0 0 99 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.796 121.3 56.5 -59.1 -28.3 -13.8 16.8 46.1 136 136 A E H > S+ 0 0 129 2,-0.2 4,-0.6 1,-0.2 3,-0.2 0.918 105.0 49.8 -71.8 -39.5 -13.0 13.2 46.8 137 137 A D H >4 S+ 0 0 14 -3,-0.3 3,-1.1 1,-0.2 4,-0.2 0.877 108.0 55.4 -61.8 -39.5 -10.9 13.0 43.5 138 138 A V H >< S+ 0 0 34 -4,-2.0 3,-1.7 1,-0.3 -1,-0.2 0.834 95.9 64.4 -63.5 -33.3 -9.1 16.3 44.6 139 139 A K H 3< S+ 0 0 158 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.733 98.5 59.1 -59.5 -23.7 -8.1 14.6 47.9 140 140 A L T << S+ 0 0 86 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.543 85.0 97.8 -84.6 -12.4 -6.1 12.3 45.7 141 141 A L S < S- 0 0 10 -3,-1.7 5,-0.2 -4,-0.2 53,-0.1 -0.436 89.0 -86.9 -81.5 156.0 -3.8 14.9 44.1 142 142 A P >> - 0 0 31 0, 0.0 3,-2.4 0, 0.0 4,-0.7 -0.300 44.9-116.1 -54.2 141.2 -0.2 15.8 45.1 143 143 A D T 34 S+ 0 0 128 1,-0.3 3,-0.3 2,-0.2 -2,-0.1 0.759 115.4 51.6 -58.5 -24.0 -0.6 18.4 47.8 144 144 A D T 34 S+ 0 0 82 1,-0.2 -1,-0.3 2,-0.1 10,-0.2 0.407 112.9 45.7 -92.4 4.5 1.2 21.0 45.6 145 145 A E T <4 S+ 0 0 0 -3,-2.4 6,-0.3 1,-0.1 -2,-0.2 0.368 81.2 103.4-123.7 2.9 -1.1 20.3 42.7 146 146 A N S < S+ 0 0 28 -4,-0.7 -3,-0.1 -3,-0.3 -2,-0.1 0.217 75.0 47.1 -81.4 15.1 -4.5 20.3 44.4 147 147 A T S > S- 0 0 39 1,-0.1 4,-2.8 -3,-0.1 5,-0.3 -0.988 82.7-115.4-146.3 155.9 -5.9 23.6 43.4 148 148 A P H > S+ 0 0 18 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.919 118.5 50.1 -54.0 -47.8 -6.2 25.5 40.1 149 149 A E H > S+ 0 0 107 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.912 113.2 46.4 -58.4 -45.2 -3.9 28.2 41.4 150 150 A K H > S+ 0 0 78 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.950 113.7 46.7 -66.1 -51.7 -1.3 25.6 42.6 151 151 A R H X S+ 0 0 0 -4,-2.8 4,-2.9 -6,-0.3 5,-0.2 0.945 115.3 46.3 -53.9 -52.4 -1.4 23.5 39.3 152 152 A A H X S+ 0 0 0 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.865 112.3 49.7 -61.3 -39.7 -1.1 26.6 37.1 153 153 A E H X S+ 0 0 91 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.942 114.2 46.5 -61.5 -47.9 1.7 28.2 39.2 154 154 A K H X S+ 0 0 19 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.913 111.6 50.1 -63.3 -43.0 3.5 24.9 39.0 155 155 A I H X S+ 0 0 3 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.893 112.2 48.4 -61.9 -39.9 2.9 24.5 35.2 156 156 A W H <>S+ 0 0 2 -4,-2.2 5,-2.4 -5,-0.2 -1,-0.2 0.894 109.1 53.1 -68.2 -37.9 4.2 28.0 34.7 157 157 A K H ><5S+ 0 0 150 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.891 109.7 48.6 -61.8 -42.5 7.3 27.3 36.8 158 158 A Y H 3<5S+ 0 0 81 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.819 106.8 54.0 -69.1 -33.4 8.1 24.2 34.7 159 159 A F T 3<5S- 0 0 23 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.398 114.1-125.6 -80.8 6.9 7.7 26.0 31.5 160 160 A G T < 5 + 0 0 62 -3,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.779 59.7 144.7 56.4 34.8 10.3 28.5 33.1 161 161 A K < - 0 0 46 -5,-2.4 2,-0.2 4,-0.1 -1,-0.2 -0.745 47.8-132.9-108.6 148.3 8.1 31.5 32.6 162 162 A N > - 0 0 126 -2,-0.3 3,-2.4 4,-0.1 -43,-0.1 -0.653 43.9 -93.8 -90.9 156.8 7.5 34.6 34.7 163 163 A D T 3 S+ 0 0 92 1,-0.3 -44,-0.5 -2,-0.2 -43,-0.2 0.654 121.5 41.7 -42.6 -32.8 3.9 35.6 35.3 164 164 A D T 3 S+ 0 0 140 -46,-0.1 -1,-0.3 -45,-0.1 2,-0.2 0.237 91.0 105.6-106.5 16.3 3.6 38.1 32.4 165 165 A D < - 0 0 57 -3,-2.4 -46,-0.4 1,-0.0 2,-0.3 -0.579 63.7-132.2 -90.9 157.0 5.5 36.1 29.7 166 166 A K - 0 0 102 -2,-0.2 2,-0.5 -48,-0.1 -48,-0.2 -0.812 12.5-135.6-107.5 151.2 3.7 34.3 26.9 167 167 A L E -B 117 0B 1 -50,-3.0 -50,-3.3 -2,-0.3 2,-0.2 -0.925 18.0-147.6-109.4 129.1 4.4 30.7 25.9 168 168 A T E > -B 116 0B 55 -2,-0.5 4,-2.2 -52,-0.2 -52,-0.2 -0.525 25.8-110.5 -91.3 164.7 4.7 29.9 22.2 169 169 A E H > S+ 0 0 80 -54,-0.6 4,-2.7 1,-0.2 5,-0.2 0.909 117.8 55.6 -62.9 -43.1 3.7 26.7 20.6 170 170 A K H > S+ 0 0 136 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.906 110.7 46.2 -56.7 -41.2 7.3 25.7 19.9 171 171 A E H > S+ 0 0 59 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.874 110.0 54.0 -67.0 -38.6 8.1 26.1 23.6 172 172 A F H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.941 112.5 43.2 -59.7 -48.8 5.0 24.1 24.5 173 173 A I H X S+ 0 0 66 -4,-2.7 4,-2.1 2,-0.2 5,-0.3 0.955 115.0 48.5 -62.4 -54.0 6.1 21.2 22.3 174 174 A E H X S+ 0 0 107 -4,-2.7 4,-3.8 -5,-0.2 5,-0.3 0.923 113.0 48.7 -55.4 -46.3 9.7 21.3 23.5 175 175 A G H X S+ 0 0 11 -4,-2.7 4,-2.8 1,-0.2 7,-0.3 0.914 110.5 48.3 -61.1 -49.5 8.7 21.4 27.1 176 176 A T H < S+ 0 0 3 -4,-2.3 7,-0.4 -5,-0.2 -1,-0.2 0.819 119.0 40.7 -63.9 -32.3 6.2 18.6 27.0 177 177 A L H < S+ 0 0 113 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.905 116.7 47.6 -79.7 -45.3 8.8 16.4 25.1 178 178 A A H < S+ 0 0 90 -4,-3.8 2,-0.6 -5,-0.3 -2,-0.2 0.911 118.4 37.8 -65.4 -43.3 11.8 17.4 27.2 179 179 A N >X - 0 0 64 -4,-2.8 4,-1.5 -5,-0.3 3,-0.8 -0.919 60.4-163.4-117.6 114.2 10.2 17.0 30.6 180 180 A K H 3> S+ 0 0 119 -2,-0.6 4,-2.4 1,-0.2 5,-0.2 0.861 92.8 63.5 -58.4 -33.8 7.7 14.2 31.3 181 181 A E H 3> S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.899 102.3 51.3 -57.5 -37.2 6.5 16.1 34.4 182 182 A I H <> S+ 0 0 8 -3,-0.8 4,-2.8 -7,-0.3 -1,-0.2 0.941 107.9 49.7 -68.8 -44.9 5.3 18.9 32.1 183 183 A L H X S+ 0 0 21 -4,-1.5 4,-2.9 -7,-0.4 -2,-0.2 0.964 111.6 49.9 -58.4 -51.0 3.3 16.5 29.8 184 184 A R H < S+ 0 0 5 -4,-2.4 5,-0.3 1,-0.2 -1,-0.2 0.909 112.0 47.1 -52.2 -47.5 1.7 14.9 32.9 185 185 A L H < S+ 0 0 1 -4,-2.2 3,-0.3 -5,-0.2 -1,-0.2 0.932 113.9 49.4 -63.2 -43.3 0.7 18.3 34.3 186 186 A I H < S+ 0 0 5 -4,-2.8 2,-2.2 1,-0.3 -2,-0.2 0.909 104.9 52.8 -64.1 -50.3 -0.6 19.5 31.0 187 187 A Q S < S- 0 0 45 -4,-2.9 2,-1.1 -5,-0.2 -1,-0.3 -0.538 82.3-173.8 -90.8 71.3 -2.8 16.6 30.0 188 188 A F + 0 0 0 -2,-2.2 -3,-0.1 -3,-0.3 -2,-0.1 -0.550 33.0 129.1 -66.9 96.1 -4.5 16.9 33.4 189 189 A E + 0 0 51 -2,-1.1 2,-1.4 -5,-0.3 -1,-0.2 0.016 11.8 126.6-146.0 34.6 -6.7 13.8 33.3 190 190 A P + 0 0 2 0, 0.0 2,-1.8 0, 0.0 -2,-0.1 -0.534 37.3 179.7 -92.8 67.8 -6.2 11.8 36.4 191 191 A Q S S- 0 0 63 -2,-1.4 3,-0.1 1,-0.2 -53,-0.1 -0.483 79.1 -18.5 -75.7 76.0 -10.0 11.8 37.1 192 192 A K S S+ 0 0 132 -2,-1.8 -1,-0.2 1,-0.5 2,-0.2 0.049 132.2 85.3 108.8 -13.9 -10.2 9.8 40.4 193 193 A V - 0 0 86 -4,-0.1 -1,-0.5 0, 0.0 2,-0.3 -0.605 63.1-151.3-110.0 169.5 -6.7 8.4 39.6 194 194 A K + 0 0 45 -2,-0.2 3,-0.1 -3,-0.1 -53,-0.0 -0.879 14.5 177.4-148.6 110.0 -3.1 9.7 40.2 195 195 A E + 0 0 72 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 0.105 54.3 88.9 -88.3-153.2 -0.2 8.8 38.0 196 196 A K 0 0 98 1,-0.0 -1,-0.1 -2,-0.0 -15,-0.0 0.500 360.0 360.0 71.8 1.5 3.4 10.1 38.5 197 197 A X 0 0 227 -3,-0.1 -2,-0.1 0, 0.0 -1,-0.0 0.677 360.0 360.0 -19.4 360.0 3.6 7.0 40.7