==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-SEP-03 1UP2 . COMPND 2 MOLECULE: PUTATIVE CELLULASE CEL6; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR A.VARROT,S.LEYDIER,G.PELL,H.J.GILBERT,G.J.DAVIES . 293 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11680.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 197 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.0 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 . 1 0.3 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 . 17 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 1 1 0 2 0 0 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 3 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 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 1 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 88 A A 0 0 129 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.6 10.6 10.3 -9.9 2 89 A N > - 0 0 44 1,-0.2 3,-1.4 2,-0.1 244,-0.0 -0.559 360.0-158.7 -67.4 111.4 12.4 12.4 -7.2 3 90 A P T 3 S+ 0 0 55 0, 0.0 -1,-0.2 0, 0.0 150,-0.1 0.625 88.0 58.5 -70.3 -11.1 9.6 13.5 -4.9 4 91 A L T > S+ 0 0 3 2,-0.1 3,-0.6 242,-0.1 2,-0.2 0.505 85.6 94.4 -94.8 -7.5 11.8 16.5 -3.6 5 92 A A T < S+ 0 0 51 -3,-1.4 250,-0.0 1,-0.2 249,-0.0 -0.572 71.7 42.0 -82.1 145.1 12.3 18.0 -7.0 6 93 A G T 3 S+ 0 0 87 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.326 101.6 52.4 107.6 -14.8 9.9 20.8 -8.1 7 94 A K S < S- 0 0 88 -3,-0.6 61,-0.2 62,-0.0 3,-0.1 -0.978 83.0-104.0-142.7 155.8 9.3 23.1 -5.1 8 95 A P - 0 0 89 0, 0.0 61,-2.8 0, 0.0 2,-0.3 -0.310 43.4-101.1 -68.0 155.9 11.7 24.9 -2.8 9 96 A F B -a 69 0A 20 59,-0.2 2,-0.2 235,-0.1 -5,-0.0 -0.603 47.1 -98.3 -77.5 143.3 12.2 23.6 0.7 10 97 A Y - 0 0 24 59,-2.8 2,-0.6 -2,-0.3 29,-0.5 -0.451 26.7-142.2 -67.9 130.2 10.2 25.4 3.4 11 98 A V - 0 0 49 -2,-0.2 -1,-0.1 27,-0.2 25,-0.1 -0.819 21.1-129.1 -90.8 121.7 12.0 28.1 5.4 12 99 A D > - 0 0 14 -2,-0.6 3,-1.0 25,-0.2 6,-0.2 -0.596 15.2-161.7 -72.0 115.2 10.8 27.9 9.0 13 100 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 22,-0.0 0.662 87.7 48.6 -71.1 -15.3 9.8 31.5 10.0 14 101 A A T 3 S+ 0 0 72 4,-0.1 -2,-0.1 5,-0.0 5,-0.0 0.159 78.0 132.0-113.5 13.6 10.0 30.6 13.8 15 102 A S <> - 0 0 4 -3,-1.0 4,-2.1 20,-0.2 3,-0.2 -0.267 69.8-116.1 -61.5 155.7 13.4 28.9 14.0 16 103 A A H > S+ 0 0 34 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.879 119.0 58.2 -61.6 -34.4 15.7 30.0 16.7 17 104 A A H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 18,-0.3 0.877 104.9 49.1 -62.0 -40.2 18.0 31.2 13.9 18 105 A X H > S+ 0 0 35 -3,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.910 110.6 50.5 -64.0 -43.3 15.3 33.5 12.6 19 106 A V H X S+ 0 0 63 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.936 113.5 45.6 -57.2 -47.7 14.7 34.8 16.1 20 107 A A H X S+ 0 0 16 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.899 112.7 50.0 -64.4 -42.7 18.4 35.5 16.5 21 108 A A H < S+ 0 0 12 -4,-2.4 7,-0.3 10,-0.3 3,-0.3 0.890 111.7 47.5 -65.0 -41.1 18.7 37.1 13.1 22 109 A R H < S+ 0 0 164 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.852 113.9 49.0 -69.2 -32.7 15.8 39.4 13.6 23 110 A N H < S+ 0 0 120 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.648 81.4 115.8 -79.2 -17.2 17.1 40.4 17.1 24 111 A A < - 0 0 25 -4,-1.2 4,-0.0 -3,-0.3 -3,-0.0 -0.323 60.4-140.8 -62.4 127.5 20.7 41.2 16.0 25 112 A N S S+ 0 0 155 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 -0.921 95.4 22.9-132.5 104.5 21.5 44.9 16.4 26 113 A P S S- 0 0 98 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 0.616 118.4 -98.6 -77.4 171.1 23.0 45.6 14.1 27 114 A P - 0 0 111 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.223 35.6-140.9 -55.4 138.6 22.0 43.0 11.6 28 115 A N > - 0 0 42 -7,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.929 4.5-151.2-110.7 121.2 24.5 40.1 11.4 29 116 A A H > S+ 0 0 66 -2,-0.5 4,-1.9 1,-0.2 5,-0.1 0.797 95.7 52.4 -63.1 -31.9 25.1 38.7 7.9 30 117 A E H > S+ 0 0 36 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.938 111.2 44.5 -72.3 -45.9 26.0 35.2 9.3 31 118 A L H > S+ 0 0 7 1,-0.2 4,-2.8 2,-0.2 -10,-0.3 0.894 114.0 51.7 -64.6 -37.3 22.8 34.8 11.3 32 119 A T H X S+ 0 0 53 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.923 107.8 50.7 -64.1 -44.6 20.8 36.1 8.4 33 120 A S H < S+ 0 0 30 -4,-1.9 4,-0.2 1,-0.2 -2,-0.2 0.935 115.5 42.5 -58.2 -48.1 22.3 33.6 6.0 34 121 A V H >< S+ 0 0 0 -4,-2.0 3,-1.7 1,-0.2 -2,-0.2 0.935 112.2 53.0 -64.7 -48.2 21.6 30.7 8.3 35 122 A A H 3< S+ 0 0 2 -4,-2.8 -1,-0.2 -18,-0.3 -2,-0.2 0.776 107.8 52.6 -58.9 -29.3 18.1 31.9 9.3 36 123 A N T 3< S+ 0 0 94 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.374 90.2 93.1 -91.5 3.9 17.1 32.2 5.6 37 124 A T S < S- 0 0 20 -3,-1.7 -25,-0.2 -4,-0.2 2,-0.1 -0.813 85.6-109.0-102.2 133.0 18.1 28.6 4.6 38 125 A P + 0 0 28 0, 0.0 220,-0.4 0, 0.0 2,-0.3 -0.431 45.1 174.0 -63.8 132.8 15.5 25.9 4.8 39 126 A Q - 0 0 8 -29,-0.5 32,-0.3 -2,-0.1 220,-0.2 -0.974 34.5 -91.9-137.7 154.5 16.1 23.4 7.7 40 127 A S - 0 0 0 218,-2.2 2,-0.6 -2,-0.3 32,-0.2 -0.273 31.5-129.9 -71.7 151.3 14.2 20.5 9.1 41 128 A Y E -b 72 0B 36 30,-2.4 32,-2.7 -26,-0.0 2,-0.4 -0.885 24.9-142.5-106.0 115.8 11.7 21.0 12.0 42 129 A W E -b 73 0B 58 -2,-0.6 2,-0.4 30,-0.2 32,-0.2 -0.700 16.0-170.9 -91.4 132.2 12.3 18.5 14.8 43 130 A L E +b 74 0B 0 30,-3.3 32,-2.8 -2,-0.4 2,-0.2 -0.955 17.2 147.9-118.9 139.1 9.5 16.9 16.8 44 131 A D > - 0 0 35 -2,-0.4 3,-1.9 30,-0.2 32,-0.2 -0.586 64.0 -48.5-143.5-156.1 10.0 14.8 19.9 45 132 A Q T 3 S+ 0 0 68 30,-0.4 31,-0.1 1,-0.3 46,-0.1 0.566 117.4 76.9 -66.2 -11.9 8.3 13.9 23.2 46 133 A A T 3 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.1 30,-0.0 0.574 91.8 62.4 -65.6 -14.5 7.6 17.6 24.0 47 134 A F S < S- 0 0 54 -3,-1.9 -1,-0.2 3,-0.0 5,-0.1 -0.881 88.8-153.1-113.2 93.9 4.8 17.1 21.4 48 135 A P >> - 0 0 55 0, 0.0 4,-2.3 0, 0.0 3,-1.9 -0.246 26.6-108.0 -70.8 159.7 2.5 14.5 22.9 49 136 A P H 3> S+ 0 0 44 0, 0.0 4,-0.6 0, 0.0 -4,-0.0 0.843 115.8 65.6 -49.5 -35.8 0.3 12.1 20.8 50 137 A A H 34 S+ 0 0 95 1,-0.2 4,-0.1 2,-0.1 -3,-0.0 0.749 121.1 13.2 -61.1 -28.7 -2.7 14.0 22.0 51 138 A T H X> S+ 0 0 78 -3,-1.9 4,-1.5 2,-0.1 3,-0.6 0.515 97.3 91.8-128.1 -10.9 -1.7 17.2 20.1 52 139 A V H 3X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.802 80.9 65.9 -63.9 -28.4 1.2 16.5 17.7 53 140 A G H 3X S+ 0 0 13 -4,-0.6 4,-2.9 1,-0.2 -1,-0.2 0.920 104.2 45.0 -53.2 -49.1 -1.3 15.9 14.8 54 141 A G H <> S+ 0 0 52 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.884 111.7 52.3 -64.1 -40.9 -2.4 19.5 15.0 55 142 A T H X S+ 0 0 31 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.925 112.5 45.4 -58.5 -47.4 1.2 20.7 15.2 56 143 A V H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-0.3 0.941 112.0 50.6 -63.4 -48.1 2.1 18.7 12.1 57 144 A A H X S+ 0 0 47 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.885 110.2 52.2 -57.1 -39.7 -1.0 19.9 10.2 58 145 A R H X S+ 0 0 171 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.912 112.2 43.7 -60.5 -46.6 -0.1 23.5 11.0 59 146 A Y H X S+ 0 0 4 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.940 117.1 43.7 -73.2 -43.0 3.5 23.2 9.7 60 147 A T H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.845 114.5 51.7 -71.6 -31.8 2.6 21.3 6.5 61 148 A G H X S+ 0 0 32 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.896 110.6 47.9 -66.1 -43.5 -0.3 23.6 5.9 62 149 A A H X S+ 0 0 35 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.895 111.0 50.9 -64.0 -39.5 1.9 26.6 6.3 63 150 A A H <>S+ 0 0 0 -4,-2.3 5,-2.6 2,-0.2 3,-0.5 0.922 109.7 50.0 -64.2 -41.4 4.5 25.1 4.0 64 151 A Q H ><5S+ 0 0 114 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.887 106.4 55.7 -63.0 -39.5 1.9 24.5 1.4 65 152 A A H 3<5S+ 0 0 93 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.735 109.4 48.2 -63.7 -23.8 0.7 28.1 1.8 66 153 A A T 3<5S- 0 0 62 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.384 115.0-119.1 -93.1 0.4 4.3 29.1 0.9 67 154 A G T < 5S+ 0 0 43 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.817 74.9 122.0 63.6 37.3 4.4 26.7 -2.1 68 155 A A < - 0 0 6 -5,-2.6 -59,-0.2 -61,-0.2 -1,-0.2 -0.824 68.2-110.9-133.9 159.8 7.2 24.8 -0.4 69 156 A M B -a 9 0A 9 -61,-2.8 -59,-2.8 -2,-0.3 2,-0.2 -0.818 32.1-143.7 -95.3 117.2 8.1 21.3 0.8 70 157 A P - 0 0 1 0, 0.0 43,-2.2 0, 0.0 2,-0.5 -0.567 6.5-152.9 -78.6 144.7 8.3 21.0 4.6 71 158 A V E - c 0 113B 9 -32,-0.3 -30,-2.4 -61,-0.2 2,-0.4 -0.989 14.5-174.7-116.9 125.4 11.0 18.8 6.1 72 159 A L E -bc 41 114B 1 41,-2.7 43,-2.8 -2,-0.5 2,-0.5 -0.945 12.7-150.6-119.1 140.3 10.2 17.3 9.6 73 160 A T E -bc 42 115B 0 -32,-2.7 -30,-3.3 -2,-0.4 2,-0.6 -0.964 7.1-149.2-113.7 124.4 12.5 15.2 11.7 74 161 A L E +bc 43 116B 1 41,-2.7 43,-2.0 -2,-0.5 -30,-0.2 -0.823 26.5 162.4 -93.0 118.7 11.0 12.7 14.1 75 162 A Y + 0 0 25 -32,-2.8 -30,-0.4 -2,-0.6 14,-0.2 -0.458 36.4 105.5-138.3 58.5 13.2 12.3 17.1 76 163 A G + 0 0 0 -32,-0.2 14,-2.9 13,-0.1 4,-0.1 0.235 37.4 145.0-123.9 14.1 11.1 10.5 19.8 77 164 A I > - 0 0 4 12,-0.2 3,-0.9 1,-0.1 11,-0.1 -0.198 58.7 -99.6 -62.0 140.7 12.4 6.9 19.9 78 165 A P T 3 S+ 0 0 3 0, 0.0 13,-0.1 0, 0.0 11,-0.1 -0.361 111.2 20.3 -56.8 145.6 12.4 5.2 23.3 79 166 A H T > S- 0 0 71 11,-0.4 3,-2.1 9,-0.4 10,-0.2 0.854 95.0-161.7 58.6 38.5 15.8 5.3 24.9 80 167 A R B X +I 88 0C 20 8,-1.3 3,-1.7 -3,-0.9 8,-0.6 -0.239 67.9 1.8 -54.4 138.6 16.7 8.2 22.6 81 168 A D G > S- 0 0 17 1,-0.3 3,-1.8 6,-0.2 -1,-0.3 0.620 117.9 -84.7 56.0 19.4 20.4 8.8 22.2 82 169 A a G < S- 0 0 39 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.823 82.9 -59.2 52.5 36.6 21.0 5.8 24.5 83 170 A G G < S+ 0 0 58 -3,-1.7 -1,-0.3 5,-0.1 -2,-0.2 0.617 110.8 122.1 71.4 17.0 20.6 8.1 27.5 84 171 A S S X S- 0 0 52 -3,-1.8 3,-1.8 -4,-0.2 -1,-0.1 0.342 82.2 -41.0 -90.9-143.9 23.5 10.4 26.5 85 172 A Y T 3 S+ 0 0 68 1,-0.3 191,-0.6 -4,-0.1 183,-0.1 0.804 141.3 40.3 -57.7 -29.6 23.7 14.2 25.7 86 173 A A T 3 S+ 0 0 14 -5,-0.2 -1,-0.3 189,-0.1 -4,-0.1 -0.096 84.0 162.6-111.6 37.6 20.3 14.1 23.9 87 174 A S < + 0 0 71 -3,-1.8 2,-0.3 -6,-0.2 -6,-0.2 -0.113 28.9 81.1 -57.1 147.1 18.5 11.7 26.2 88 175 A G B +I 80 0C 31 -8,-0.6 -8,-1.3 -11,-0.1 -9,-0.4 -0.986 29.1 134.3 156.0-136.6 14.7 11.7 25.9 89 176 A G - 0 0 13 -2,-0.3 -12,-0.2 -14,-0.2 -13,-0.1 -0.050 69.4 -41.6 72.4 173.7 12.1 10.2 23.6 90 177 A F - 0 0 20 -14,-2.9 -11,-0.4 1,-0.1 -10,-0.2 -0.317 51.1-123.4 -70.7 156.8 8.9 8.5 24.7 91 178 A A S S+ 0 0 80 -13,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.879 85.5 17.1 -71.0 -39.0 8.9 6.1 27.7 92 179 A T S > S- 0 0 63 1,-0.1 4,-2.3 -14,-0.1 5,-0.1 -0.876 71.9-113.1-136.0 165.7 7.5 3.1 25.9 93 180 A G H > S+ 0 0 5 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.839 117.0 57.7 -65.2 -35.7 6.9 1.5 22.5 94 181 A T H > S+ 0 0 114 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.929 108.1 46.1 -60.5 -44.3 3.1 1.9 23.1 95 182 A D H > S+ 0 0 66 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.921 111.9 52.1 -61.9 -46.9 3.5 5.7 23.5 96 183 A Y H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.915 107.9 50.4 -58.1 -44.3 5.7 5.8 20.4 97 184 A R H X S+ 0 0 91 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.905 110.1 50.6 -63.0 -38.3 3.2 4.0 18.3 98 185 A G H X S+ 0 0 29 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.893 110.0 51.4 -66.5 -35.1 0.5 6.4 19.5 99 186 A W H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.927 108.5 49.8 -65.4 -47.0 2.7 9.3 18.6 100 187 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.911 108.6 53.8 -60.2 -44.1 3.4 8.0 15.1 101 188 A D H X S+ 0 0 72 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.905 110.2 47.0 -54.7 -44.5 -0.4 7.5 14.6 102 189 A A H X S+ 0 0 16 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.884 110.1 52.1 -67.5 -41.1 -1.0 11.2 15.5 103 190 A V H X S+ 0 0 1 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.949 110.7 48.6 -57.8 -45.3 1.8 12.4 13.2 104 191 A A H X S+ 0 0 20 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.890 108.7 53.8 -64.1 -40.0 0.2 10.5 10.3 105 192 A S H < S+ 0 0 97 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.901 109.5 47.6 -58.4 -42.2 -3.2 11.9 11.1 106 193 A G H < S+ 0 0 10 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.825 109.6 54.5 -70.9 -29.9 -1.8 15.4 11.0 107 194 A L H >< S+ 0 0 0 -4,-1.9 3,-2.8 1,-0.2 -2,-0.2 0.896 75.8 159.7 -65.8 -41.3 0.0 14.6 7.6 108 195 A G T 3< S- 0 0 44 -4,-2.1 -1,-0.2 1,-0.3 43,-0.1 -0.388 77.7 -34.1 53.9-119.7 -3.2 13.5 6.0 109 196 A S T 3 S+ 0 0 94 40,-0.2 -1,-0.3 -2,-0.1 -2,-0.1 0.060 105.9 128.3-112.5 16.9 -2.5 13.7 2.2 110 197 A S < - 0 0 29 -3,-2.8 2,-0.1 1,-0.1 41,-0.1 -0.412 66.9 -99.1 -84.3 150.6 -0.3 16.7 2.5 111 198 A P + 0 0 20 0, 0.0 2,-0.3 0, 0.0 41,-0.2 -0.460 57.2 148.4 -65.2 136.1 3.3 17.0 1.0 112 199 A A E - d 0 152B 0 39,-1.9 41,-3.1 -2,-0.1 2,-0.5 -0.957 42.2-138.6-164.5 152.6 6.0 16.4 3.5 113 200 A T E -cd 71 153B 0 -43,-2.2 -41,-2.7 -2,-0.3 2,-0.5 -0.980 26.4-161.7-114.5 126.4 9.5 15.1 3.8 114 201 A I E -cd 72 154B 0 39,-2.9 41,-3.1 -2,-0.5 2,-0.7 -0.964 13.6-161.4-119.0 122.0 10.1 13.0 6.9 115 202 A I E -cd 73 155B 0 -43,-2.8 -41,-2.7 -2,-0.5 2,-0.9 -0.897 23.6-144.5 -95.5 112.0 13.4 12.1 8.4 116 203 A V E -cd 74 156B 1 39,-2.9 41,-2.4 -2,-0.7 69,-0.1 -0.702 56.3 -36.1 -90.6 106.3 12.7 9.1 10.7 117 204 A E > - 0 0 1 -43,-2.0 3,-1.9 -2,-0.9 4,-0.5 0.922 62.9-130.4 56.4 73.2 14.7 8.9 13.9 118 205 A P T 3 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 68,-0.0 -0.231 89.9 1.3 -42.7 127.4 18.3 10.2 13.6 119 206 A D T 3> S+ 0 0 29 1,-0.1 4,-3.1 -39,-0.1 5,-0.2 0.156 95.7 116.1 80.6 -15.5 20.7 7.6 15.1 120 207 A A H <> S+ 0 0 2 -3,-1.9 4,-0.5 1,-0.2 -1,-0.1 0.928 84.8 31.2 -57.8 -52.7 18.0 5.0 16.1 121 208 A L H >4 S+ 0 0 2 -4,-0.5 3,-0.5 36,-0.4 -1,-0.2 0.903 122.6 49.8 -69.6 -37.3 19.2 2.2 13.8 122 209 A A H 34 S+ 0 0 3 1,-0.2 3,-0.3 35,-0.1 -2,-0.2 0.862 118.1 37.1 -75.1 -35.7 22.9 3.2 13.9 123 210 A X H >< S+ 0 0 53 -4,-3.1 3,-1.8 1,-0.2 -1,-0.2 0.387 83.9 110.1 -92.4 2.7 23.1 3.4 17.7 124 211 A A G X< + 0 0 0 -4,-0.5 3,-2.1 -3,-0.5 -1,-0.2 0.628 56.1 79.5 -61.3 -21.5 20.8 0.5 18.5 125 212 A D G 3 S+ 0 0 95 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.588 76.4 74.5 -67.3 -9.6 23.5 -1.8 19.8 126 213 A a G < S+ 0 0 71 -3,-1.8 -1,-0.3 2,-0.1 2,-0.2 0.645 90.4 76.2 -70.4 -14.0 23.4 0.0 23.2 127 214 A L S < S- 0 0 21 -3,-2.1 -48,-0.0 -4,-0.1 0, 0.0 -0.604 94.6-100.7 -91.7 157.3 20.2 -1.8 23.7 128 215 A S > - 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