==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-JAN-12 3VOJ . COMPND 2 MOLECULE: CELLOBIOHYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: COPRINOPSIS CINEREA; . AUTHOR M.TAMURA,T.MIYAZAKI,Y.TANAKA,M.YOSHIDA,A.NISHIKAWA,T.TONOZUK . 361 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14335.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 243 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.7 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 . 26 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 1 0 0 0 2 0 0 1 0 1 0 0 1 2 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 4 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 PARALLEL BRIDGES PER LADDER . 3 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 1 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 75 A P 0 0 128 0, 0.0 2,-0.2 0, 0.0 209,-0.0 0.000 360.0 360.0 360.0 168.9 12.7 32.3 -10.8 2 76 A S - 0 0 37 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.838 360.0-148.5-172.6 142.1 16.1 34.0 -10.6 3 77 A T S S+ 0 0 146 -2,-0.2 2,-0.1 2,-0.1 -1,-0.1 0.739 84.6 48.1 -79.4 -27.4 19.8 33.1 -10.3 4 78 A G S S- 0 0 32 1,-0.2 298,-0.0 4,-0.0 -2,-0.0 -0.156 106.5 -30.5-107.5-164.6 20.6 36.3 -8.4 5 79 A N > - 0 0 41 1,-0.1 3,-1.1 -2,-0.1 -1,-0.2 -0.295 41.1-159.2 -58.6 114.5 19.5 38.6 -5.5 6 80 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 168,-0.1 0.674 91.2 58.9 -68.0 -18.2 15.7 38.4 -5.0 7 81 A F T > S+ 0 0 6 2,-0.1 3,-1.3 295,-0.0 2,-0.2 0.656 80.3 116.2 -80.1 -17.1 15.7 41.8 -3.1 8 82 A E T < S+ 0 0 129 -3,-1.1 3,-0.1 1,-0.2 -4,-0.0 -0.334 82.6 4.4 -64.4 120.2 17.2 43.5 -6.1 9 83 A G T 3 S+ 0 0 58 1,-0.3 2,-0.4 -2,-0.2 67,-0.2 0.722 103.1 117.3 83.3 24.6 14.9 46.2 -7.7 10 84 A Y < - 0 0 45 -3,-1.3 2,-0.4 65,-0.1 -1,-0.3 -0.944 61.8-131.9-124.9 142.8 12.1 46.0 -5.1 11 85 A D E -a 77 0A 47 65,-3.0 67,-2.1 -2,-0.4 2,-0.5 -0.769 34.9-123.4 -81.0 137.5 10.6 48.4 -2.6 12 86 A I E -a 78 0A 44 -2,-0.4 67,-0.2 65,-0.2 2,-0.1 -0.750 21.1-122.2 -88.4 124.2 10.3 46.6 0.8 13 87 A Y - 0 0 7 65,-3.0 2,-0.6 -2,-0.5 67,-0.3 -0.428 26.0-129.5 -62.5 131.8 6.8 46.5 2.2 14 88 A L - 0 0 74 -2,-0.1 -1,-0.1 31,-0.1 33,-0.1 -0.802 24.7-111.6 -93.3 120.2 6.7 48.2 5.6 15 89 A S > - 0 0 6 -2,-0.6 4,-1.7 31,-0.3 29,-0.1 -0.243 22.0-164.2 -50.5 119.7 5.0 46.1 8.3 16 90 A P H > S+ 0 0 29 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.815 91.7 59.9 -73.1 -32.6 1.7 47.8 9.4 17 91 A Y H > S+ 0 0 74 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.934 112.1 37.9 -54.1 -50.5 1.8 45.5 12.5 18 92 A Y H > S+ 0 0 2 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.859 111.0 60.1 -74.2 -36.8 5.1 47.0 13.5 19 93 A A H X S+ 0 0 22 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.927 107.7 45.0 -55.8 -48.3 4.1 50.6 12.4 20 94 A E H X S+ 0 0 147 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.889 112.3 51.6 -64.7 -40.1 1.2 50.7 14.8 21 95 A E H X S+ 0 0 31 -4,-1.5 4,-2.0 -5,-0.2 -2,-0.2 0.939 113.9 44.5 -58.8 -46.1 3.3 49.2 17.6 22 96 A V H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 -2,-0.2 0.904 111.9 51.6 -66.5 -44.4 5.9 51.9 17.0 23 97 A E H X S+ 0 0 89 -4,-2.8 4,-1.6 2,-0.2 -1,-0.2 0.900 113.2 45.1 -59.4 -44.3 3.4 54.7 16.7 24 98 A A H X S+ 0 0 52 -4,-2.4 4,-0.6 2,-0.2 -1,-0.2 0.851 113.7 50.9 -65.9 -36.3 1.8 53.7 20.0 25 99 A A H >< S+ 0 0 1 -4,-2.0 3,-0.9 -5,-0.2 4,-0.3 0.910 109.2 50.4 -65.2 -44.7 5.3 53.4 21.5 26 100 A A H >< S+ 0 0 2 -4,-3.0 3,-1.3 1,-0.2 -2,-0.2 0.845 102.0 61.8 -61.8 -37.7 6.2 56.9 20.3 27 101 A A H 3< S+ 0 0 79 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.731 105.5 47.6 -62.7 -23.7 3.0 58.4 21.8 28 102 A M T << S+ 0 0 134 -3,-0.9 2,-0.5 -4,-0.6 -1,-0.3 0.448 86.3 109.3 -97.7 -2.7 4.2 57.3 25.3 29 103 A I < - 0 0 16 -3,-1.3 6,-0.1 -4,-0.3 -3,-0.0 -0.667 51.0-162.4 -84.1 120.6 7.7 58.7 25.0 30 104 A D S S+ 0 0 164 -2,-0.5 -1,-0.2 4,-0.1 5,-0.1 0.973 70.8 77.0 -56.8 -62.9 8.5 61.8 27.1 31 105 A D > - 0 0 72 1,-0.2 4,-2.2 2,-0.1 5,-0.1 -0.358 67.6-154.7 -60.3 118.9 11.7 62.9 25.3 32 106 A P H > S+ 0 0 94 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.713 96.6 53.7 -68.6 -22.5 10.8 64.6 22.0 33 107 A V H > S+ 0 0 91 2,-0.2 4,-1.5 1,-0.1 5,-0.1 0.907 113.1 42.0 -75.0 -44.7 14.2 63.7 20.6 34 108 A L H > S+ 0 0 26 2,-0.2 4,-2.7 1,-0.2 -1,-0.1 0.805 113.1 55.8 -67.9 -32.0 13.6 60.1 21.5 35 109 A K H X S+ 0 0 93 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.935 108.4 45.3 -63.6 -51.0 10.1 60.4 20.2 36 110 A A H X S+ 0 0 33 -4,-1.7 4,-0.7 2,-0.2 -2,-0.2 0.790 115.3 48.8 -66.4 -30.9 11.1 61.7 16.8 37 111 A K H >X S+ 0 0 38 -4,-1.5 4,-0.9 324,-0.2 3,-0.7 0.908 107.9 53.9 -71.6 -45.5 13.8 58.9 16.6 38 112 A A H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.2 4,-0.4 0.888 105.6 54.9 -53.5 -41.7 11.2 56.3 17.7 39 113 A L H >< S+ 0 0 55 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.774 97.6 62.8 -67.0 -27.8 9.0 57.4 14.8 40 114 A K H X< S+ 0 0 66 -3,-0.7 3,-1.8 -4,-0.7 -1,-0.2 0.810 89.3 72.1 -65.5 -30.5 11.9 56.9 12.3 41 115 A V G X< S+ 0 0 0 -4,-0.9 3,-1.9 -3,-0.8 -1,-0.2 0.796 85.6 62.8 -55.4 -36.1 11.8 53.1 13.1 42 116 A K G < S+ 0 0 75 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.609 96.8 60.1 -70.9 -9.7 8.5 52.5 11.3 43 117 A E G < S+ 0 0 108 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.377 88.3 90.1 -90.7 -1.1 10.3 53.5 8.0 44 118 A I S < S- 0 0 16 -3,-1.9 -29,-0.1 -4,-0.1 2,-0.0 -0.890 85.4-117.5-102.5 120.8 12.7 50.7 8.5 45 119 A P + 0 0 24 0, 0.0 261,-0.3 0, 0.0 2,-0.3 -0.285 38.3 174.4 -60.7 133.5 11.7 47.4 6.9 46 120 A T - 0 0 3 -33,-0.3 34,-0.3 -4,-0.1 2,-0.3 -0.840 33.3 -97.3-129.1 167.3 11.1 44.4 9.2 47 121 A F - 0 0 2 259,-1.3 2,-0.6 260,-0.5 34,-0.3 -0.653 30.2-128.7 -86.9 146.1 9.8 40.8 8.8 48 122 A I E -b 81 0A 8 32,-2.6 34,-2.5 -2,-0.3 2,-0.4 -0.858 24.0-144.4-100.0 116.1 6.2 39.9 9.5 49 123 A W E -b 82 0A 28 -2,-0.6 2,-0.7 32,-0.2 34,-0.1 -0.639 16.4-166.1 -88.5 129.5 5.9 36.9 11.8 50 124 A F E +b 83 0A 1 32,-2.2 34,-1.2 -2,-0.4 -1,-0.1 -0.685 31.8 150.6-107.2 73.1 3.2 34.3 11.5 51 125 A D + 0 0 34 -2,-0.7 2,-0.3 32,-0.1 -1,-0.1 0.423 63.8 41.3 -87.4 -2.7 3.8 32.8 15.0 52 126 A V S > S- 0 0 17 -3,-0.1 3,-1.6 46,-0.1 4,-0.2 -0.989 79.4-126.4-145.7 148.9 0.2 31.8 15.4 53 127 A V G > S+ 0 0 30 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.763 105.5 67.6 -69.9 -25.4 -2.4 30.3 12.9 54 128 A R G 3 S+ 0 0 181 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.622 92.8 62.9 -68.2 -11.7 -4.9 33.0 13.6 55 129 A K G X> S+ 0 0 20 -3,-1.6 4,-0.8 1,-0.2 3,-0.8 0.554 74.9 92.7 -86.8 -7.8 -2.6 35.4 11.9 56 130 A T H X> S+ 0 0 0 -3,-1.6 3,-0.9 1,-0.3 4,-0.7 0.854 81.8 54.3 -58.4 -39.5 -2.8 33.7 8.5 57 131 A P H 3> S+ 0 0 62 0, 0.0 4,-1.5 0, 0.0 3,-0.5 0.821 96.6 67.0 -63.4 -31.8 -5.7 35.9 7.3 58 132 A D H <> S+ 0 0 35 -3,-0.8 4,-2.6 -4,-0.2 -2,-0.2 0.829 92.5 62.9 -52.8 -35.5 -3.5 39.0 8.1 59 133 A L H - 0 0 1 1,-0.1 3,-1.0 -3,-0.1 14,-0.3 -0.182 53.8 -98.4 -53.5 147.6 6.1 24.0 14.1 87 161 A P T 3 S+ 0 0 0 0, 0.0 14,-0.2 0, 0.0 -1,-0.1 -0.493 112.9 17.8 -66.7 144.7 4.6 21.5 16.6 88 162 A D T 3 S- 0 0 32 12,-2.4 3,-0.3 -2,-0.1 10,-0.1 0.851 99.6-161.9 55.8 37.2 6.7 21.3 19.8 89 163 A R < + 0 0 10 -3,-1.0 4,-0.1 11,-0.4 -1,-0.1 -0.069 61.1 10.6 -49.2 145.5 8.3 24.6 18.7 90 164 A A S > S- 0 0 1 46,-0.6 3,-2.2 45,-0.3 -1,-0.2 0.921 77.4-170.0 47.2 58.4 11.6 25.8 20.2 91 165 A a T 3 S+ 0 0 5 -3,-0.3 59,-0.3 1,-0.3 58,-0.3 0.613 76.3 52.7 -57.4 -22.6 12.1 22.4 21.8 92 166 A A T 3 S+ 0 0 44 44,-0.2 2,-0.3 57,-0.1 -1,-0.3 0.402 111.6 48.4 -93.4 -0.8 15.1 23.5 24.0 93 167 A A < - 0 0 16 -3,-2.2 232,-0.1 -4,-0.1 3,-0.0 -0.960 59.2-151.9-140.0 154.6 13.3 26.4 25.6 94 168 A A S > S+ 0 0 33 -2,-0.3 3,-1.6 1,-0.1 4,-0.1 0.670 80.4 86.1 -95.0 -21.7 10.0 27.2 27.2 95 169 A A T 3 S+ 0 0 1 1,-0.3 245,-0.5 2,-0.1 221,-0.2 0.824 102.9 26.2 -51.2 -45.9 9.8 30.9 26.2 96 170 A S T 3 S+ 0 0 24 -6,-0.2 -1,-0.3 1,-0.2 -2,-0.1 -0.299 78.6 159.8-115.1 46.5 8.2 30.4 22.8 97 171 A N < - 0 0 68 -3,-1.6 -8,-0.2 226,-0.1 -1,-0.2 0.753 37.2-140.9 -39.4 -52.7 6.5 27.1 23.6 98 172 A G - 0 0 15 -3,-0.1 -10,-0.1 -4,-0.1 -1,-0.1 0.200 16.1-100.8 98.7 149.0 3.9 27.2 20.7 99 173 A E S S+ 0 0 80 -12,-0.1 2,-0.5 -11,-0.0 -1,-0.1 0.685 95.3 77.2 -78.0 -21.1 0.2 26.4 20.1 100 174 A F - 0 0 15 -14,-0.3 -12,-2.4 -15,-0.1 -11,-0.4 -0.815 59.7-168.8-101.5 131.0 0.8 23.0 18.3 101 175 A S > > - 0 0 54 -2,-0.5 5,-1.6 3,-0.3 3,-1.4 -0.946 25.3-143.3-120.1 135.7 1.6 19.8 20.2 102 176 A L G > 5S+ 0 0 58 -2,-0.4 3,-0.5 1,-0.3 5,-0.2 0.761 104.5 60.7 -64.4 -25.3 2.8 16.5 18.7 103 177 A A G 3 5S+ 0 0 108 1,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.692 109.2 45.0 -71.5 -18.6 0.8 14.7 21.4 104 178 A D G < 5S- 0 0 114 -3,-1.4 -3,-0.3 0, 0.0 -1,-0.2 -0.486 131.6 -73.3-128.7 61.8 -2.4 16.4 20.0 105 179 A G T <>5S+ 0 0 44 -3,-0.5 4,-2.0 -2,-0.1 3,-0.2 0.737 78.0 151.9 62.2 26.2 -2.4 16.1 16.2 106 180 A G H >< + 0 0 1 -5,-1.6 4,-2.1 1,-0.2 -4,-0.2 0.806 62.4 55.2 -58.8 -38.9 0.3 18.8 15.9 107 181 A M H > S+ 0 0 24 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.922 111.8 42.4 -64.9 -45.8 1.8 17.6 12.6 108 182 A E H > S+ 0 0 127 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.879 113.1 54.0 -68.5 -38.9 -1.4 17.7 10.6 109 183 A K H X S+ 0 0 91 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.875 108.0 51.1 -61.0 -38.4 -2.3 21.1 12.3 110 184 A Y H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.882 106.8 51.9 -67.9 -39.4 1.0 22.4 11.1 111 185 A K H X S+ 0 0 54 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.888 110.6 49.7 -63.8 -37.4 0.4 21.3 7.5 112 186 A D H X S+ 0 0 87 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.901 107.0 54.4 -66.4 -42.8 -3.0 23.1 7.6 113 187 A Y H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.915 111.2 45.4 -53.5 -46.9 -1.2 26.3 9.0 114 188 A V H X S+ 0 0 2 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.912 111.7 52.4 -61.5 -44.5 1.1 26.2 5.9 115 189 A D H X S+ 0 0 52 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.829 107.7 52.1 -60.8 -37.6 -1.8 25.5 3.6 116 190 A R H X S+ 0 0 86 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.934 110.2 47.3 -64.6 -48.0 -3.6 28.5 5.0 117 191 A L H X S+ 0 0 2 -4,-2.0 4,-1.8 1,-0.2 3,-0.4 0.931 112.2 51.8 -56.0 -47.6 -0.6 30.7 4.4 118 192 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.838 105.0 54.6 -58.5 -38.7 -0.4 29.2 0.9 119 193 A S H X S+ 0 0 41 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.787 107.3 50.2 -72.3 -28.0 -4.1 30.0 0.1 120 194 A E H X S+ 0 0 22 -4,-1.4 4,-0.9 -3,-0.4 3,-0.3 0.902 111.1 49.3 -67.6 -44.7 -3.5 33.7 1.0 121 195 A I H >< S+ 0 0 8 -4,-1.8 3,-0.9 1,-0.2 -2,-0.2 0.920 107.2 54.3 -61.5 -46.1 -0.5 33.8 -1.3 122 196 A R H 3< S+ 0 0 139 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.791 103.0 59.3 -54.5 -32.6 -2.5 32.2 -4.1 123 197 A K H 3< S+ 0 0 119 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.795 117.9 27.8 -67.1 -32.0 -5.1 35.0 -3.7 124 198 A Y X< + 0 0 73 -3,-0.9 3,-0.7 -4,-0.9 -1,-0.3 -0.678 67.5 159.5-135.8 79.6 -2.5 37.8 -4.4 125 199 A P T 3 + 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.369 57.3 80.7 -85.7 3.8 0.3 36.4 -6.7 126 200 A D T 3 S+ 0 0 99 -63,-0.1 2,-0.5 2,-0.1 -49,-0.2 0.517 78.6 76.3 -92.0 -3.7 1.6 39.8 -8.1 127 201 A V S < S- 0 0 9 -3,-0.7 -49,-0.2 -6,-0.2 2,-0.1 -0.921 81.2-123.5-112.3 127.2 3.8 40.7 -5.1 128 202 A R E -c 78 0A 53 -51,-1.2 -49,-2.8 -2,-0.5 2,-0.4 -0.412 27.5-157.4 -63.8 141.5 7.2 39.0 -4.4 129 203 A I E -c 79 0A 5 43,-0.4 45,-2.5 -51,-0.2 2,-0.5 -0.983 12.3-164.7-124.7 132.9 7.5 37.3 -1.0 130 204 A V E -cd 80 174A 0 -51,-2.3 -49,-3.0 -2,-0.4 2,-0.4 -0.993 17.4-167.3-111.8 126.3 10.7 36.5 1.0 131 205 A A E -cd 81 175A 0 43,-3.3 45,-2.4 -2,-0.5 2,-0.5 -0.932 17.6-147.8-118.8 134.1 10.0 34.0 3.8 132 206 A V E -cd 82 176A 0 -51,-2.5 -49,-3.3 -2,-0.4 2,-0.8 -0.873 28.1-134.5 -94.5 132.0 12.3 33.0 6.8 133 207 A I E -cd 83 177A 0 43,-2.7 45,-2.1 -2,-0.5 4,-0.2 -0.818 53.9 -42.2-106.0 105.1 11.6 29.4 7.6 134 208 A E > - 0 0 1 -51,-2.8 3,-0.6 -2,-0.8 4,-0.4 0.916 61.6-142.6 57.0 71.2 11.2 28.3 11.2 135 209 A P T 3 S+ 0 0 7 0, 0.0 -45,-0.3 0, 0.0 -1,-0.1 -0.286 81.3 17.1 -55.1 143.2 13.7 30.0 13.5 136 210 A D T 3 S+ 0 0 47 1,-0.1 -46,-0.6 -47,-0.1 -45,-0.3 0.890 102.2 98.7 62.1 44.2 15.1 27.9 16.3 137 211 A S S X S+ 0 0 1 -3,-0.6 3,-1.7 -4,-0.2 4,-0.4 0.501 83.1 23.6-118.2 -86.4 14.0 24.5 14.8 138 212 A L T >> S+ 0 0 0 -4,-0.4 3,-1.6 1,-0.3 4,-0.6 0.781 111.4 69.9 -61.3 -32.3 16.7 22.5 12.9 139 213 A A H >> S+ 0 0 0 1,-0.3 4,-1.0 2,-0.2 3,-0.9 0.829 92.8 62.3 -50.4 -34.1 19.6 24.2 14.7 140 214 A N H <> S+ 0 0 1 -3,-1.7 4,-2.2 1,-0.2 -1,-0.3 0.763 93.4 61.2 -61.9 -29.8 18.3 22.2 17.7 141 215 A M H <4 S+ 0 0 21 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.665 102.0 54.1 -75.7 -15.8 19.0 18.9 15.9 142 216 A V H << S+ 0 0 31 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.889 131.3 2.1 -80.1 -43.1 22.7 19.7 15.7 143 217 A T H < S+ 0 0 46 -4,-1.0 3,-0.2 1,-0.1 -2,-0.2 0.528 122.9 59.0-126.2 -10.3 23.4 20.5 19.4 144 218 A N >< + 0 0 38 -4,-2.2 3,-1.9 -5,-0.2 6,-0.3 0.055 56.9 117.3-118.1 23.4 20.3 19.9 21.6 145 219 A M T 3 + 0 0 51 1,-0.3 -1,-0.1 5,-0.1 -4,-0.1 0.410 66.6 74.6 -78.2 5.1 19.4 16.2 21.0 146 220 A N T 3 S+ 0 0 119 -3,-0.2 2,-0.4 4,-0.0 -1,-0.3 0.646 78.6 91.7 -78.3 -21.1 20.0 15.6 24.7 147 221 A V S <> S- 0 0 41 -3,-1.9 4,-2.5 1,-0.1 5,-0.2 -0.659 76.4-142.8 -79.3 126.4 16.7 17.4 25.2 148 222 A A H > S+ 0 0 71 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.910 100.8 50.8 -50.7 -50.0 13.8 15.0 25.4 149 223 A K H > S+ 0 0 61 -58,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.849 110.8 48.5 -62.5 -36.6 11.5 17.4 23.5 150 224 A a H >> S+ 0 0 0 -6,-0.3 4,-1.0 -59,-0.3 3,-0.6 0.938 111.1 49.3 -69.3 -46.7 14.0 18.0 20.7 151 225 A R H 3< S+ 0 0 137 -4,-2.5 3,-0.4 1,-0.3 4,-0.3 0.874 114.2 46.9 -57.9 -40.5 14.7 14.3 20.2 152 226 A G H 3< S+ 0 0 55 -4,-2.3 -1,-0.3 -5,-0.2 4,-0.2 0.677 114.6 48.1 -73.1 -19.1 10.9 13.8 20.1 153 227 A A H S+ 0 0 70 -4,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.871 116.5 53.4 -66.6 -36.1 11.2 14.0 12.4 156 230 A A H > S+ 0 0 4 -4,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.865 108.0 49.3 -63.3 -41.3 8.4 16.6 12.9 157 231 A Y H X S+ 0 0 1 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.929 115.3 44.3 -64.0 -45.3 10.9 19.6 12.4 158 232 A K H X S+ 0 0 43 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.968 117.3 43.3 -65.1 -54.6 12.3 18.0 9.2 159 233 A E H X S+ 0 0 85 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.887 116.1 49.5 -56.4 -44.6 8.9 17.0 7.7 160 234 A G H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.943 113.7 43.4 -63.2 -51.9 7.4 20.3 8.7 161 235 A V H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.911 114.0 51.1 -60.0 -45.4 10.2 22.4 7.2 162 236 A I H X S+ 0 0 30 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.916 112.3 47.2 -59.2 -45.1 10.4 20.3 4.0 163 237 A Y H X S+ 0 0 59 -4,-2.4 4,-2.5 -5,-0.2 5,-0.3 0.929 112.0 49.3 -61.8 -49.1 6.6 20.6 3.5 164 238 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.926 112.8 49.1 -54.3 -47.5 6.7 24.4 4.1 165 239 A L H X S+ 0 0 1 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.881 111.8 47.5 -59.7 -43.0 9.6 24.6 1.6 166 240 A R H X S+ 0 0 128 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.893 114.4 45.4 -71.1 -40.4 7.7 22.5 -1.1 167 241 A Q H X S+ 0 0 66 -4,-2.5 4,-0.8 2,-0.2 -2,-0.2 0.909 117.0 43.8 -67.4 -43.0 4.5 24.5 -0.8 168 242 A L H <>S+ 0 0 2 -4,-2.3 5,-2.4 -5,-0.3 3,-0.5 0.892 111.7 52.9 -73.2 -38.4 6.1 27.9 -0.8 169 243 A S H ><5S+ 0 0 12 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.865 103.3 58.1 -62.1 -40.4 8.5 27.1 -3.7 170 244 A A H 3<5S+ 0 0 86 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.805 109.3 46.1 -59.8 -29.7 5.6 25.9 -5.8 171 245 A L T 3<5S- 0 0 62 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.398 120.7-108.7 -94.8 0.9 4.2 29.4 -5.4 172 246 A G T < 5 + 0 0 24 -3,-1.4 -43,-0.4 1,-0.3 2,-0.3 0.775 63.7 153.2 78.1 26.5 7.5 31.2 -6.1 173 247 A V < - 0 0 2 -5,-2.4 2,-0.6 -8,-0.1 -1,-0.3 -0.691 45.5-125.4 -82.1 138.2 8.2 32.4 -2.6 174 248 A Y E -d 130 0A 2 -45,-2.5 -43,-3.3 -2,-0.3 2,-0.4 -0.794 31.1-160.8 -86.5 120.6 11.9 32.9 -1.8 175 249 A S E -de 131 211A 0 35,-2.9 38,-1.4 -2,-0.6 37,-1.2 -0.832 18.9-173.2-106.8 139.8 12.8 30.9 1.3 176 250 A Y E -de 132 213A 0 -45,-2.4 -43,-2.7 -2,-0.4 2,-0.3 -0.984 22.8-141.6-124.8 118.5 15.7 31.3 3.7 177 251 A V E -de 133 214A 1 36,-2.5 38,-2.2 -2,-0.4 -43,-0.1 -0.617 27.1-104.8 -81.3 134.0 15.9 28.5 6.2 178 252 A D E - e 0 215A 5 -45,-2.1 38,-0.2 -2,-0.3 -39,-0.2 -0.366 36.9-179.6 -59.4 134.5 16.9 29.5 9.8 179 253 A A - 0 0 0 36,-2.9 6,-0.2 1,-0.4 -1,-0.1 -0.091 34.6-121.3-131.8 32.5 20.5 28.4 10.4 180 254 A G - 0 0 5 35,-0.1 37,-2.2 4,-0.1 38,-0.5 -0.373 40.6 -83.2 66.9-138.2 21.2 29.6 14.0 181 255 A H >>> - 0 0 21 35,-0.2 4,-2.2 36,-0.1 3,-1.7 -0.924 41.4 -80.2-157.8 175.9 24.0 32.0 14.6 182 256 A A H 3>5S+ 0 0 0 -2,-0.3 4,-0.6 1,-0.3 5,-0.3 0.837 125.2 49.3 -55.4 -40.0 27.8 32.2 15.1 183 257 A G H 345S+ 0 0 15 3,-0.2 -1,-0.3 2,-0.1 56,-0.1 0.436 120.8 36.7 -84.1 1.7 27.7 31.2 18.8 184 258 A W H <45S+ 0 0 46 -3,-1.7 3,-0.2 93,-0.0 -2,-0.2 0.728 136.5 9.1-110.8 -66.4 25.4 28.3 18.1 185 259 A L H <5S+ 0 0 0 -4,-2.2 -3,-0.2 -6,-0.2 9,-0.2 0.452 112.4 79.3 -99.7 -3.0 26.4 26.6 14.8 186 260 A G << + 0 0 0 -5,-0.9 -1,-0.2 -4,-0.6 -3,-0.2 0.715 62.1 108.1 -79.0 -26.6 29.6 28.5 14.2 187 261 A W S >> S- 0 0 90 -5,-0.3 3,-2.2 -3,-0.2 4,-0.8 -0.320 83.5-117.0 -50.1 133.3 31.8 26.5 16.6 188 262 A N H >> S+ 0 0 133 1,-0.3 3,-0.9 2,-0.2 4,-0.6 0.816 112.7 56.5 -46.1 -42.2 34.1 24.3 14.5 189 263 A A H 34 S+ 0 0 81 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.738 109.0 46.5 -65.6 -24.9 32.6 21.1 15.7 190 264 A N H <> S+ 0 0 34 -3,-2.2 4,-1.6 2,-0.1 -1,-0.2 0.544 92.3 81.4 -94.8 -9.5 29.1 22.1 14.6 191 265 A L H S+ 0 0 44 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.849 112.3 49.1 -63.4 -31.0 27.0 18.5 10.8 194 268 A S H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 5,-0.3 0.935 110.7 48.1 -69.2 -47.1 25.0 21.8 10.0 195 269 A A H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.921 113.7 49.6 -58.3 -44.1 26.1 21.9 6.3 196 270 A R H X S+ 0 0 142 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.937 113.4 45.4 -55.4 -54.9 25.2 18.2 6.1 197 271 A L H X S+ 0 0 14 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.910 114.9 44.1 -62.1 -49.5 21.7 18.7 7.6 198 272 A F H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.865 112.3 53.1 -69.5 -34.6 20.7 21.8 5.7 199 273 A A H X S+ 0 0 7 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.863 108.6 51.9 -63.2 -35.5 21.9 20.3 2.4 200 274 A Q H X S+ 0 0 65 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.919 109.2 48.1 -66.4 -48.0 19.7 17.3 3.2 201 275 A I H X S+ 0 0 2 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.873 109.8 54.5 -56.8 -41.0 16.6 19.4 3.8 202 276 A Y H <>S+ 0 0 34 -4,-2.0 5,-2.5 2,-0.2 6,-0.2 0.912 110.9 45.0 -61.7 -46.0 17.5 21.2 0.5 203 277 A K H ><5S+ 0 0 99 -4,-2.0 3,-2.5 3,-0.2 -2,-0.2 0.963 113.2 48.5 -57.5 -58.4 17.5 17.9 -1.4 204 278 A D H 3<5S+ 0 0 58 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.763 107.5 57.9 -57.7 -27.3 14.3 16.6 0.2 205 279 A A T ><5S- 0 0 4 -4,-1.7 3,-0.5 -5,-0.2 -1,-0.3 0.301 124.7-103.4 -87.8 5.2 12.7 19.9 -0.6 206 280 A G T < 5 - 0 0 42 -3,-2.5 -3,-0.2 1,-0.2 -2,-0.1 0.497 43.1 -95.6 92.6 6.3 13.4 19.4 -4.3 207 281 A R T 3 < + 0 0 135 -5,-2.5 -1,-0.2 1,-0.2 -4,-0.1 0.758 61.4 179.0 55.0 28.7 16.4 21.7 -4.8 208 282 A S X - 0 0 32 -3,-0.5 3,-2.3 -6,-0.2 -1,-0.2 -0.380 36.9-129.7 -59.3 135.6 14.1 24.5 -6.0 209 283 A A T 3 S+ 0 0 58 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.713 107.1 70.8 -59.6 -21.6 16.0 27.8 -6.9 210 284 A F T 3 S+ 0 0 27 1,-0.2 -35,-2.9 -36,-0.1 2,-1.6 0.658 76.6 82.8 -71.2 -16.6 13.3 29.5 -4.7 211 285 A I E < +e 175 0A 4 -3,-2.3 -1,-0.2 -37,-0.2 -35,-0.1 -0.707 67.6 174.7 -82.9 86.2 15.1 27.8 -1.7 212 286 A R E - 0 0 23 -2,-1.6 48,-2.1 -37,-1.2 2,-0.3 0.873 39.9 -85.0 -72.5 -42.0 17.6 30.7 -1.8 213 287 A G E -ef 176 260A 0 -38,-1.4 -36,-2.5 46,-0.3 2,-0.3 -0.845 57.0 -37.0 174.3-133.4 19.6 29.9 1.3 214 288 A L E -ef 177 261A 0 46,-2.5 48,-1.9 -38,-0.3 2,-0.5 -0.895 32.8-138.5-131.1 151.2 19.8 30.4 5.1 215 289 A A E -ef 178 262A 0 -38,-2.2 -36,-2.9 -2,-0.3 2,-0.3 -0.939 24.2-167.6-111.3 132.1 19.0 33.1 7.6 216 290 A T E + f 0 263A 0 46,-2.6 48,-2.4 -2,-0.5 -35,-0.2 -0.842 59.3 21.3-118.5 156.7 21.3 33.8 10.5 217 291 A N S > S+ 0 0 1 -37,-2.2 3,-2.7 -2,-0.3 -36,-0.1 0.561 70.8 174.1 71.4 13.8 21.2 35.7 13.8 218 292 A V T 3 S- 0 0 18 -38,-0.5 -1,-0.2 1,-0.3 3,-0.1 -0.353 74.3 -5.2 -56.5 119.5 17.4 35.7 13.8 219 293 A S T 3 S+ 0 0 28 1,-0.2 -1,-0.3 -2,-0.1 2,-0.1 0.594 118.1 108.7 67.2 16.1 16.3 37.2 17.2 220 294 A N < - 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