==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-FEB-13 3ZNZ . COMPND 2 MOLECULE: PROTEIN FAM105B; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.KEUSEKOTTEN,P.R.ELLIOTT,L.GLOCKNER,Y.KULATHU,T.WAUER,D.KRA . 412 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17878.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 298 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 11.9 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 24 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 32.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 1 2 0 0 2 3 1 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 0 PARALLEL BRIDGES PER LADDER . 5 6 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 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 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 78 A G 0 0 113 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 83.4 -21.4 24.8 -0.8 2 79 A P - 0 0 57 0, 0.0 2,-0.2 0, 0.0 45,-0.1 -0.253 360.0-118.8 -56.6 138.7 -20.2 22.5 -3.6 3 80 A L - 0 0 108 1,-0.1 3,-0.3 43,-0.0 133,-0.1 -0.592 13.0-138.8 -75.0 142.7 -16.4 22.4 -4.0 4 81 A S S S+ 0 0 13 131,-0.4 43,-2.7 1,-0.3 2,-0.5 0.967 94.8 11.4 -66.1 -51.4 -15.2 23.6 -7.4 5 82 A V B S-A 46 0A 13 130,-0.3 -1,-0.3 41,-0.2 41,-0.2 -0.921 89.8-140.0-132.2 102.4 -12.6 20.9 -7.8 6 83 A A - 0 0 22 39,-3.1 3,-0.1 -2,-0.5 41,-0.0 -0.111 31.6 -85.1 -65.9 159.4 -13.0 18.1 -5.1 7 84 A P - 0 0 91 0, 0.0 38,-0.4 0, 0.0 -1,-0.1 -0.297 58.6 -89.5 -65.3 148.9 -10.0 16.5 -3.4 8 85 A E - 0 0 38 36,-0.1 2,-0.4 -3,-0.1 36,-0.2 -0.219 44.2-170.3 -63.4 145.4 -8.4 13.6 -5.3 9 86 A M E -B 43 0B 82 34,-1.8 34,-2.4 -3,-0.1 5,-0.1 -0.988 38.7 -88.3-134.1 144.4 -9.7 10.1 -4.7 10 87 A D E > -B 42 0B 67 -2,-0.4 4,-2.2 32,-0.2 32,-0.3 -0.256 41.5-131.6 -51.5 133.0 -8.3 6.8 -5.9 11 88 A I H > S+ 0 0 2 30,-1.9 4,-2.9 1,-0.2 -1,-0.1 0.896 102.2 44.3 -68.4 -40.0 -9.9 6.3 -9.3 12 89 A M H > S+ 0 0 45 29,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.851 112.6 52.6 -74.8 -30.6 -11.0 2.7 -8.9 13 90 A D H > S+ 0 0 101 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.877 112.1 47.7 -63.2 -37.4 -12.4 3.4 -5.4 14 91 A Y H X S+ 0 0 11 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.956 112.2 48.4 -67.3 -49.7 -14.3 6.3 -7.0 15 92 A C H X S+ 0 0 2 -4,-2.9 4,-2.1 1,-0.2 3,-0.2 0.933 109.2 53.8 -52.9 -48.5 -15.5 4.0 -9.8 16 93 A K H < S+ 0 0 84 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.867 110.7 45.1 -58.7 -42.0 -16.6 1.4 -7.3 17 94 A K H < S+ 0 0 45 -4,-1.7 3,-0.3 1,-0.2 -1,-0.3 0.820 117.9 44.5 -69.9 -31.8 -18.8 3.8 -5.2 18 95 A E H < S+ 0 0 31 -4,-1.8 2,-0.4 -3,-0.2 -2,-0.2 0.700 114.7 43.0 -91.0 -21.3 -20.3 5.4 -8.3 19 96 A W < + 0 0 3 -4,-2.1 -1,-0.2 -5,-0.2 358,-0.2 -0.657 60.3 139.0-131.4 81.3 -21.1 2.3 -10.4 20 97 A R + 0 0 138 357,-2.7 357,-0.2 -2,-0.4 358,-0.2 0.576 36.1 114.3-100.0 -14.5 -22.7 -0.5 -8.3 21 98 A G - 0 0 1 355,-2.2 2,-1.4 1,-0.1 355,-0.1 -0.177 69.7-125.6 -67.0 152.4 -25.4 -1.8 -10.6 22 99 A N S S+ 0 0 169 353,-0.2 2,-0.3 4,-0.1 -1,-0.1 -0.442 73.0 115.9 -89.8 59.9 -25.6 -5.2 -12.2 23 100 A T S > S- 0 0 25 -2,-1.4 4,-2.2 353,-0.2 5,-0.2 -0.904 78.4-116.2-132.7 157.1 -25.9 -3.7 -15.7 24 101 A Q H > S+ 0 0 144 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.912 115.9 53.4 -56.6 -42.6 -24.1 -3.6 -19.0 25 102 A K H > S+ 0 0 62 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.915 108.7 47.5 -60.9 -44.8 -23.7 0.2 -18.6 26 103 A A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.908 112.0 51.7 -62.4 -39.6 -22.2 -0.0 -15.1 27 104 A T H X S+ 0 0 52 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.908 109.1 49.9 -62.7 -42.9 -19.8 -2.7 -16.5 28 105 A C H X S+ 0 0 24 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.900 110.3 50.0 -60.3 -43.6 -18.8 -0.4 -19.4 29 106 A M H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.941 111.3 48.8 -62.2 -45.3 -18.1 2.5 -17.0 30 107 A K H X S+ 0 0 79 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.895 111.2 49.5 -61.8 -41.3 -16.0 0.2 -14.7 31 108 A M H X S+ 0 0 85 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.888 111.3 50.5 -65.2 -40.8 -14.0 -1.1 -17.7 32 109 A G H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.939 110.7 47.6 -60.2 -50.1 -13.4 2.5 -18.9 33 110 A Y H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.894 107.7 57.5 -60.3 -40.9 -12.2 3.6 -15.5 34 111 A E H < S+ 0 0 102 -4,-2.4 4,-0.4 2,-0.2 -1,-0.2 0.907 108.1 46.5 -51.9 -46.0 -9.9 0.5 -15.4 35 112 A E H >< S+ 0 0 71 -4,-1.8 3,-1.2 1,-0.2 4,-0.3 0.911 112.0 49.7 -68.4 -41.3 -8.2 1.6 -18.6 36 113 A V H >X S+ 0 0 0 -4,-2.2 3,-2.0 1,-0.2 4,-1.9 0.888 101.8 65.0 -59.3 -37.3 -7.9 5.2 -17.4 37 114 A S T 3< S+ 0 0 39 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.639 86.7 70.7 -65.2 -14.6 -6.3 3.9 -14.2 38 115 A Q T <4 S+ 0 0 160 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.724 116.5 21.1 -71.3 -24.4 -3.4 2.5 -16.2 39 116 A K T <4 S+ 0 0 139 -3,-2.0 2,-0.4 -4,-0.3 -2,-0.2 0.546 125.2 48.4-120.3 -17.7 -2.2 6.1 -16.7 40 117 A F < - 0 0 6 -4,-1.9 221,-0.3 221,-0.1 -1,-0.2 -0.964 54.4-164.2-129.8 148.3 -3.9 8.1 -13.9 41 118 A T + 0 0 40 219,-2.3 -30,-1.9 -2,-0.4 -29,-0.3 0.768 68.6 21.7-101.5 -30.6 -4.0 7.4 -10.2 42 119 A S E -BC 10 260B 8 218,-1.9 218,-2.8 -32,-0.3 2,-0.4 -0.827 59.1-139.0-138.2 169.0 -6.8 9.6 -8.9 43 120 A I E -BC 9 259B 2 -34,-2.4 -34,-1.8 -2,-0.3 2,-0.5 -0.991 5.4-155.8-133.3 139.0 -9.9 11.6 -9.9 44 121 A R E - C 0 258B 25 214,-3.0 214,-2.2 -2,-0.4 2,-0.4 -0.973 23.8-130.5-112.9 118.2 -11.0 15.0 -8.8 45 122 A R - 0 0 61 -2,-0.5 -39,-3.1 -38,-0.4 2,-0.3 -0.530 21.6-146.0 -70.6 125.3 -14.7 15.6 -9.1 46 123 A V B -A 5 0A 0 -2,-0.4 -41,-0.2 -41,-0.2 2,-0.2 -0.689 25.3-100.0 -94.5 141.4 -15.5 18.8 -10.9 47 124 A R - 0 0 52 -43,-2.7 2,-1.2 -2,-0.3 4,-0.2 -0.435 26.6-145.3 -65.8 127.1 -18.5 20.9 -10.0 48 125 A G + 0 0 0 -2,-0.2 298,-2.3 1,-0.2 360,-0.3 -0.458 55.2 128.0 -94.9 63.6 -21.4 20.4 -12.5 49 126 A D B S-D 345 0C 6 -2,-1.2 296,-0.2 296,-0.2 -1,-0.2 -0.046 92.0 -90.8-105.6 28.0 -22.8 23.9 -12.5 50 127 A N S S+ 0 0 4 294,-2.7 147,-1.0 149,-0.1 148,-0.3 0.319 122.4 81.5 72.7 -3.8 -22.7 24.1 -16.3 51 128 A Y >> + 0 0 8 293,-0.3 4,-3.0 146,-0.2 3,-1.0 0.395 58.5 108.6 -95.3 -2.1 -19.2 25.7 -16.2 52 129 A A H 3> S+ 0 0 0 292,-0.7 4,-3.1 1,-0.3 5,-0.3 0.819 72.3 53.4 -50.2 -41.1 -17.7 22.2 -15.8 53 130 A A H 3> S+ 0 0 1 290,-0.5 4,-1.6 1,-0.2 -1,-0.3 0.906 117.6 38.4 -60.5 -40.1 -16.1 22.1 -19.3 54 131 A L H <> S+ 0 0 2 -3,-1.0 4,-2.9 2,-0.2 5,-0.3 0.898 116.8 50.6 -75.8 -44.5 -14.4 25.4 -18.7 55 132 A R H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.935 113.4 44.9 -58.1 -49.6 -13.6 24.7 -15.0 56 133 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 -5,-0.2 -2,-0.2 0.934 117.6 43.4 -63.9 -46.0 -12.0 21.3 -15.8 57 134 A T H X S+ 0 0 1 -4,-1.6 4,-2.5 -5,-0.3 -2,-0.2 0.936 117.7 44.3 -64.5 -47.2 -10.0 22.6 -18.8 58 135 A L H X S+ 0 0 5 -4,-2.9 4,-3.0 2,-0.2 5,-0.3 0.888 111.6 52.7 -70.2 -38.9 -8.8 25.8 -17.1 59 136 A F H X S+ 0 0 7 -4,-2.7 4,-2.7 -5,-0.3 -1,-0.2 0.941 113.2 44.5 -59.2 -47.6 -8.0 24.1 -13.8 60 137 A Q H X S+ 0 0 4 -4,-2.1 4,-0.9 -5,-0.2 -2,-0.2 0.902 115.2 48.5 -62.5 -42.8 -5.8 21.6 -15.7 61 138 A A H < S+ 0 0 3 -4,-2.5 3,-0.3 -5,-0.2 -2,-0.2 0.936 117.9 39.2 -63.9 -46.0 -4.2 24.3 -17.9 62 139 A M H >< S+ 0 0 0 -4,-3.0 3,-1.4 1,-0.2 -2,-0.2 0.874 110.9 56.4 -76.7 -33.5 -3.4 26.6 -15.0 63 140 A S H 3< S+ 0 0 10 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.698 112.3 44.1 -72.7 -17.1 -2.3 23.9 -12.5 64 141 A Q T 3< S+ 0 0 50 -4,-0.9 -1,-0.3 -3,-0.3 2,-0.3 0.326 84.9 140.4-100.3 3.5 0.3 22.7 -15.0 65 142 A A < + 0 0 7 -3,-1.4 3,-0.1 1,-0.2 -3,-0.1 -0.297 10.2 153.0 -63.0 115.2 1.4 26.3 -15.9 66 143 A V S S+ 0 0 117 1,-0.3 2,-0.3 -2,-0.3 -1,-0.2 0.627 72.2 22.8-113.1 -25.0 5.1 26.5 -16.3 67 144 A G S S- 0 0 40 53,-0.0 -1,-0.3 0, 0.0 53,-0.1 -0.964 83.1-111.1-134.3 154.6 5.1 29.4 -18.7 68 145 A L - 0 0 21 -2,-0.3 5,-0.1 -3,-0.1 48,-0.1 -0.762 47.0-114.5 -78.2 123.5 2.6 32.2 -19.4 69 146 A P >> - 0 0 19 0, 0.0 4,-1.6 0, 0.0 3,-1.1 -0.348 16.9-124.0 -62.2 144.0 1.3 31.4 -22.9 70 147 A P H 3> S+ 0 0 101 0, 0.0 4,-1.9 0, 0.0 -2,-0.0 0.857 109.7 59.4 -53.8 -41.1 2.2 34.1 -25.5 71 148 A W H 34 S+ 0 0 31 1,-0.2 6,-0.1 2,-0.2 144,-0.1 0.803 110.9 42.3 -59.9 -29.0 -1.4 34.6 -26.5 72 149 A L H <4 S+ 0 0 0 -3,-1.1 -1,-0.2 1,-0.2 40,-0.1 0.746 110.0 57.4 -87.6 -27.9 -2.1 35.6 -22.9 73 150 A Q H < S+ 0 0 89 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.804 81.2 109.9 -68.0 -32.2 1.1 37.7 -22.6 74 151 A D >< - 0 0 83 -4,-1.9 3,-1.6 -5,-0.2 4,-0.4 -0.261 62.6-149.4 -57.8 118.0 0.1 39.8 -25.6 75 152 A P G > S+ 0 0 98 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.827 94.2 68.0 -53.6 -37.0 -0.8 43.4 -24.5 76 153 A E G >> S+ 0 0 48 1,-0.3 3,-1.2 2,-0.2 4,-1.0 0.752 84.3 72.4 -56.7 -27.8 -3.4 43.7 -27.4 77 154 A L G X4 S+ 0 0 15 -3,-1.6 3,-0.5 1,-0.3 -1,-0.3 0.863 92.9 55.1 -56.4 -36.9 -5.5 41.1 -25.6 78 155 A M G <4 S+ 0 0 35 -3,-1.5 4,-0.3 -4,-0.4 -1,-0.3 0.704 105.7 52.2 -70.9 -18.6 -6.4 43.8 -23.0 79 156 A L G <> S+ 0 0 112 -3,-1.2 4,-2.4 -4,-0.4 3,-0.3 0.653 87.8 89.0 -88.0 -18.2 -7.6 46.0 -25.8 80 157 A L H S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.928 114.4 41.0 -58.7 -45.1 -13.1 44.0 -25.3 82 159 A E H > S+ 0 0 95 -3,-0.3 4,-2.1 -4,-0.3 5,-0.3 0.904 115.4 51.9 -67.4 -41.5 -13.2 47.6 -26.3 83 160 A K H X S+ 0 0 93 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.926 116.7 38.9 -59.4 -45.2 -12.2 46.8 -29.9 84 161 A L H X S+ 0 0 13 -4,-3.0 4,-3.7 2,-0.2 7,-0.2 0.898 117.3 46.3 -75.1 -43.3 -14.9 44.2 -30.2 85 162 A I H < S+ 0 0 1 -4,-2.5 7,-0.2 -5,-0.3 -2,-0.2 0.877 111.5 52.3 -72.5 -36.3 -17.8 45.8 -28.4 86 163 A S H < S+ 0 0 80 -4,-2.1 3,-0.2 -5,-0.3 -1,-0.2 0.919 118.7 38.3 -60.1 -43.8 -17.2 49.2 -30.2 87 164 A K H < S+ 0 0 154 -4,-1.4 2,-0.7 -5,-0.3 -2,-0.2 0.927 123.9 37.7 -74.1 -48.1 -17.3 47.3 -33.5 88 165 A Y >< - 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0 0 75 -3,-1.4 -3,-0.0 -4,-0.3 6,-0.0 -0.367 68.2-133.0 -69.0 153.7 6.4 30.2 -8.9 122 206 A R S S+ 0 0 244 1,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.819 81.0 37.7 -81.5 -33.5 9.6 28.3 -8.3 123 207 A T S > S- 0 0 80 1,-0.1 4,-1.8 0, 0.0 5,-0.1 -0.894 71.5-129.3-122.0 153.4 8.4 24.8 -7.7 124 208 A A H > S+ 0 0 46 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.858 110.1 57.2 -64.0 -37.0 5.7 22.7 -9.3 125 209 A E H > S+ 0 0 132 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.936 106.4 47.1 -60.7 -46.7 4.4 21.9 -5.9 126 210 A A H > S+ 0 0 31 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.881 112.0 52.3 -62.7 -38.9 3.9 25.5 -4.9 127 211 A R H X S+ 0 0 27 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.914 109.2 48.5 -61.2 -46.6 2.2 26.1 -8.2 128 212 A Q H X S+ 0 0 36 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.917 113.2 47.4 -62.2 -43.4 -0.3 23.2 -7.7 129 213 A I H X S+ 0 0 79 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.920 112.6 48.6 -64.5 -43.7 -1.1 24.4 -4.2 130 214 A A H X S+ 0 0 28 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.863 110.5 51.5 -65.0 -36.9 -1.6 28.0 -5.3 131 215 A C H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.884 107.0 53.9 -69.2 -36.0 -3.8 26.9 -8.1 132 216 A D H < S+ 0 0 39 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.945 108.8 48.3 -60.5 -45.9 -5.9 24.9 -5.8 133 217 A E H >< S+ 0 0 129 -4,-2.0 3,-1.7 1,-0.2 -1,-0.2 0.861 105.3 59.6 -62.4 -37.9 -6.5 27.9 -3.5 134 218 A L H >< S+ 0 0 14 -4,-1.8 3,-1.5 1,-0.3 -1,-0.2 0.896 100.6 55.0 -57.0 -41.6 -7.4 30.0 -6.6 135 219 A F T 3< S+ 0 0 5 -4,-1.6 -131,-0.4 -3,-0.3 -130,-0.3 0.098 98.7 63.2 -86.2 23.9 -10.3 27.7 -7.4 136 220 A T T < S+ 0 0 114 -3,-1.7 2,-0.9 -132,-0.1 -1,-0.3 0.261 81.2 87.5-117.9 1.2 -11.7 28.2 -3.8 137 221 A N <> - 0 0 63 -3,-1.5 4,-2.7 1,-0.2 5,-0.2 -0.862 63.9-167.6 -99.0 97.9 -12.3 31.9 -4.5 138 222 A E H > S+ 0 0 58 -2,-0.9 4,-2.5 1,-0.2 5,-0.3 0.950 80.9 46.8 -52.5 -63.0 -15.8 31.8 -6.0 139 223 A A H > S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.895 116.3 44.6 -47.1 -54.3 -15.9 35.4 -7.3 140 224 A E H > S+ 0 0 52 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.891 111.5 54.5 -58.4 -42.9 -12.5 35.3 -8.9 141 225 A E H X S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 3,-0.2 0.935 108.4 46.8 -59.5 -48.7 -13.1 31.8 -10.4 142 226 A Y H X S+ 0 0 41 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.835 107.3 57.9 -68.2 -27.4 -16.3 32.9 -12.2 143 227 A S H X S+ 0 0 20 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.2 0.890 102.7 55.4 -65.1 -36.8 -14.5 36.0 -13.5 144 228 A L H X S+ 0 0 0 -4,-1.7 4,-2.1 -3,-0.2 -2,-0.2 0.867 105.6 51.2 -62.2 -37.7 -12.0 33.6 -15.1 145 229 A Y H X S+ 0 0 0 -4,-1.4 4,-2.8 2,-0.2 -1,-0.2 0.834 105.6 55.0 -72.4 -30.1 -14.8 31.8 -16.9 146 230 A E H X S+ 0 0 6 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.924 108.8 49.5 -63.7 -43.5 -16.2 35.2 -18.2 147 231 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.925 112.4 47.1 -57.4 -47.6 -12.7 35.8 -19.6 148 232 A V H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.909 110.8 50.9 -64.3 -42.2 -12.7 32.3 -21.2 149 233 A K H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.885 110.3 50.5 -63.6 -36.5 -16.2 32.7 -22.7 150 234 A F H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.897 108.5 51.4 -67.7 -40.0 -15.1 36.1 -24.2 151 235 A L H X S+ 0 0 4 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.856 109.5 51.2 -62.6 -35.6 -12.0 34.5 -25.7 152 236 A M H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.947 111.3 47.1 -66.1 -46.8 -14.3 31.8 -27.2 153 237 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.921 113.0 49.4 -59.5 -44.3 -16.6 34.5 -28.7 154 238 A N H X S+ 0 0 14 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.936 111.6 47.5 -60.5 -47.6 -13.6 36.4 -30.0 155 239 A R H X S+ 0 0 51 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.886 110.2 53.8 -62.0 -37.6 -12.1 33.3 -31.7 156 240 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.904 107.7 50.6 -63.5 -41.5 -15.5 32.5 -33.1 157 241 A I H X S+ 0 0 6 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.920 110.2 49.5 -60.2 -46.3 -15.7 36.0 -34.7 158 242 A E H X S+ 0 0 70 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.930 113.4 45.5 -59.3 -47.2 -12.2 35.6 -36.2 159 243 A L H X S+ 0 0 4 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.862 113.4 50.6 -66.5 -35.9 -13.0 32.2 -37.7 160 244 A Y H X S+ 0 0 55 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.955 113.1 44.0 -66.7 -51.1 -16.4 33.4 -39.0 161 245 A N H X S+ 0 0 53 -4,-2.7 4,-1.0 2,-0.2 6,-0.2 0.886 114.7 49.9 -61.4 -41.6 -14.9 36.5 -40.7 162 246 A D H ><>S+ 0 0 49 -4,-2.4 5,-2.7 -5,-0.2 3,-0.5 0.925 112.0 48.4 -58.9 -47.9 -12.1 34.5 -42.1 163 247 A K H ><5S+ 0 0 92 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.912 108.8 53.3 -59.9 -44.5 -14.5 31.9 -43.4 164 248 A E H 3<5S+ 0 0 120 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.722 107.1 53.1 -65.7 -20.4 -16.7 34.6 -45.0 165 249 A K T <<5S- 0 0 155 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.332 119.7-108.0 -94.1 5.9 -13.6 35.9 -46.8 166 250 A G T < 5S+ 0 0 73 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.626 72.4 145.8 76.0 13.2 -12.8 32.6 -48.3 167 251 A K < - 0 0 114 -5,-2.7 -1,-0.2 -6,-0.2 2,-0.1 -0.418 59.1 -88.3 -81.1 159.3 -9.8 32.2 -46.0 168 252 A E + 0 0 189 -2,-0.1 -1,-0.1 -3,-0.1 -5,-0.0 -0.442 53.0 173.8 -67.3 135.4 -8.6 28.9 -44.6 169 253 A V - 0 0 27 -2,-0.1 2,-0.2 -6,-0.1 5,-0.1 -0.960 41.9 -89.8-136.5 156.3 -10.3 27.9 -41.3 170 254 A P >> - 0 0 31 0, 0.0 3,-1.5 0, 0.0 4,-0.6 -0.499 43.3-123.3 -59.9 137.5 -10.3 24.9 -39.0 171 255 A F H >> S+ 0 0 100 1,-0.3 4,-1.5 2,-0.2 3,-1.1 0.781 104.8 68.6 -58.8 -29.7 -13.1 22.7 -40.3 172 256 A F H 3> S+ 0 0 7 1,-0.3 4,-3.0 2,-0.2 -1,-0.3 0.848 93.3 60.7 -59.9 -30.3 -14.9 22.5 -37.0 173 257 A S H <> S+ 0 0 1 -3,-1.5 4,-1.9 2,-0.2 -1,-0.3 0.830 98.5 56.0 -68.6 -30.4 -15.8 26.2 -37.4 174 258 A V H << S+ 0 0 26 -3,-1.1 4,-0.5 -4,-0.6 -1,-0.2 0.929 113.3 42.0 -62.5 -43.4 -17.7 25.4 -40.6 175 259 A L H >X S+ 0 0 4 -4,-1.5 3,-0.9 2,-0.2 4,-0.7 0.894 108.6 59.0 -71.0 -40.2 -19.8 22.9 -38.6 176 260 A L H >< S+ 0 0 1 -4,-3.0 3,-0.7 1,-0.3 -1,-0.2 0.923 112.7 39.3 -53.7 -45.7 -20.1 25.3 -35.6 177 261 A F T 3< S+ 0 0 17 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.471 102.1 71.7 -89.3 -1.6 -21.7 27.9 -37.8 178 262 A A T <4 S+ 0 0 3 -3,-0.9 139,-0.4 -4,-0.5 -1,-0.2 0.613 73.8 106.0 -82.4 -14.3 -23.8 25.4 -39.8 179 263 A R S X< S- 0 0 0 -3,-0.7 3,-2.3 -4,-0.7 133,-0.0 -0.480 77.3-130.1 -69.1 136.3 -26.0 24.9 -36.8 180 264 A D T 3 S+ 0 0 87 1,-0.3 3,-0.4 2,-0.2 -1,-0.1 0.768 109.6 44.7 -60.6 -30.0 -29.5 26.5 -37.2 181 265 A T T 3 S+ 0 0 59 1,-0.2 -1,-0.3 2,-0.1 10,-0.3 0.338 120.2 42.6 -92.0 4.6 -29.2 28.2 -33.8 182 266 A S < + 0 0 0 -3,-2.3 -3,-0.3 -5,-0.1 -1,-0.2 -0.056 64.0 134.5-143.0 39.9 -25.6 29.2 -34.4 183 267 A N S S+ 0 0 64 -3,-0.4 -6,-0.1 -5,-0.2 -3,-0.1 0.633 79.0 12.0 -70.7 -14.9 -25.4 30.5 -38.0 184 268 A D S > S- 0 0 47 -3,-0.1 4,-2.4 1,-0.0 3,-0.2 -0.926 89.4 -93.6-151.3 171.1 -23.3 33.6 -37.1 185 269 A P H > S+ 0 0 9 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.850 122.7 58.2 -62.1 -33.4 -21.4 34.9 -34.0 186 270 A G H > S+ 0 0 5 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.911 109.3 42.6 -57.6 -47.0 -24.5 36.8 -32.9 187 271 A Q H > S+ 0 0 45 2,-0.2 4,-2.8 -3,-0.2 5,-0.4 0.891 110.6 57.0 -67.8 -40.4 -26.6 33.6 -32.7 188 272 A L H X>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 4,-1.6 0.923 111.4 43.9 -54.5 -46.2 -23.7 31.7 -31.1 189 273 A L H <>S+ 0 0 0 -4,-2.4 5,-2.5 3,-0.2 6,-0.2 0.953 119.0 40.4 -63.6 -51.3 -23.7 34.3 -28.3 190 274 A R H <5S+ 0 0 86 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.821 127.3 29.9 -71.5 -30.9 -27.5 34.5 -27.8 191 275 A N H <5S+ 0 0 72 -4,-2.8 -1,-0.2 -10,-0.3 -3,-0.2 0.588 135.5 11.4-108.6 -14.5 -28.3 30.8 -28.1 192 276 A H T X5S+ 0 0 19 -4,-1.6 4,-0.5 -5,-0.4 -3,-0.2 0.649 122.1 43.8-130.3 -55.2 -25.2 29.0 -26.9 193 277 A L T >4>>S+ 0 0 45 -6,-0.2 3,-2.3 -3,-0.2 5,-1.9 0.677 82.2 111.5 -76.2 -18.6 -26.2 29.9 -21.5 196 280 A V B <<5S+e 200 0D 2 -3,-1.0 5,-0.2 -4,-0.5 -145,-0.2 -0.391 87.2 13.6 -64.5 123.6 -22.8 28.6 -20.5 197 281 A G T 345S+ 0 0 2 -147,-1.0 -1,-0.3 3,-0.8 -146,-0.2 0.460 132.1 54.5 88.9 2.9 -22.4 28.5 -16.7 198 282 A H T <45S- 0 0 55 -3,-2.3 209,-0.4 2,-0.6 -2,-0.2 0.491 123.3 -10.0-127.1 -84.8 -26.2 28.9 -16.4 199 283 A T T <5S+ 0 0 67 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.536 124.0 23.9-103.5 -9.4 -28.7 26.7 -18.1 200 284 A G B < -e 196 0D 1 -5,-1.9 -3,-0.8 -151,-0.1 -2,-0.6 -0.998 59.1-144.7-156.6 153.6 -26.4 24.7 -20.4 201 285 A G - 0 0 5 -2,-0.3 2,-0.4 -5,-0.2 143,-0.2 0.130 47.4 -57.5 -94.8-149.3 -22.9 23.5 -21.0 202 286 A L E -F 343 0E 1 141,-1.7 141,-2.6 -6,-0.0 -1,-0.1 -0.817 38.4-137.7-102.2 137.8 -20.8 23.0 -24.1 203 287 A E E >> -F 342 0E 6 -2,-0.4 4,-1.0 139,-0.3 3,-0.6 -0.406 38.1-100.4 -74.4 166.9 -21.6 20.8 -27.1 204 288 A Q H >> S+ 0 0 20 137,-0.6 4,-1.1 135,-0.3 3,-0.7 0.878 125.1 54.5 -57.0 -40.0 -18.8 18.8 -28.6 205 289 A V H 3> S+ 0 0 1 134,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.829 105.6 54.2 -66.3 -27.4 -18.2 21.3 -31.4 206 290 A E H <> S+ 0 0 2 -3,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.689 96.0 65.7 -79.8 -18.4 -17.9 24.0 -28.7 207 291 A M H S+ 0 0 0 -4,-2.3 5,-1.5 1,-0.2 4,-0.8 0.906 112.6 45.0 -58.7 -44.2 -9.5 24.5 -27.1 212 296 A Y H <5S+ 0 0 32 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.836 108.1 59.2 -69.7 -31.3 -8.7 27.1 -29.7 213 297 A A H <5S+ 0 0 1 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.893 121.4 23.3 -65.3 -40.1 -9.7 29.9 -27.3 214 298 A V H <5S- 0 0 3 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.358 104.1-123.8-107.6 4.9 -7.1 29.0 -24.7 215 299 A R T <5 + 0 0 70 -4,-0.8 2,-0.4 -5,-0.2 -3,-0.2 0.918 66.3 130.3 49.2 50.5 -4.7 27.1 -27.1 216 300 A H < - 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