==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-JUL-11 3T1G . COMPND 2 MOLECULE: ORGANOPHOSPHATE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.TAKEUCHI,B.L.STODDARD . 349 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14465.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 262 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.3 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 . 17 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 37.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.9 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 1 1 2 2 1 1 1 2 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 2 2 0 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 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 4 A T 0 0 161 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 113.4 -2.4 1.1 -31.8 2 5 A P - 0 0 65 0, 0.0 3,-0.4 0, 0.0 300,-0.0 -0.124 360.0-141.0 -53.4 138.5 0.5 -1.3 -31.0 3 6 A A S S+ 0 0 11 1,-0.3 2,-0.4 299,-0.2 299,-0.0 0.881 95.7 20.0 -66.0 -41.3 4.0 0.0 -31.7 4 7 A F - 0 0 2 2,-0.1 2,-1.6 315,-0.1 -1,-0.3 -0.800 67.0-175.5-136.5 89.2 5.3 -3.3 -33.1 5 8 A N + 0 0 133 -3,-0.4 86,-0.1 -2,-0.4 -2,-0.0 -0.317 57.9 87.2 -84.8 52.6 2.4 -5.6 -34.1 6 9 A K S S- 0 0 68 -2,-1.6 -2,-0.1 85,-0.0 342,-0.1 -0.902 91.8 -58.1-142.6 166.6 4.8 -8.5 -34.9 7 10 A P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 85,-0.2 -0.252 56.1-165.9 -50.9 126.0 6.5 -11.5 -33.1 8 11 A K E -a 92 0A 13 83,-2.2 85,-2.1 82,-0.0 86,-1.0 -0.793 14.5-142.5-114.3 158.2 8.6 -10.4 -30.2 9 12 A V E -a 94 0A 0 -2,-0.3 2,-0.5 83,-0.2 280,-0.4 -0.991 13.3-164.1-120.0 127.7 11.3 -12.1 -28.1 10 13 A E E +a 95 0A 0 84,-2.1 86,-2.3 -2,-0.4 3,-0.1 -0.955 19.1 163.2-115.4 125.6 11.5 -11.4 -24.3 11 14 A L + 0 0 0 -2,-0.5 2,-0.4 84,-0.2 -1,-0.1 0.544 64.9 53.7-113.6 -14.0 14.6 -12.4 -22.4 12 15 A H + 0 0 0 277,-0.1 280,-1.8 246,-0.1 2,-0.3 -0.857 64.3 121.6-134.6 97.4 14.4 -10.4 -19.1 13 16 A V B -g 292 0B 0 -2,-0.4 85,-2.5 83,-0.4 2,-0.5 -0.941 49.6-132.3-156.3 133.5 11.2 -10.6 -17.0 14 17 A H B > -b 98 0A 22 278,-3.2 3,-1.4 -2,-0.3 85,-0.2 -0.790 7.8-147.7 -94.0 122.7 10.7 -11.7 -13.4 15 18 A L G > S+ 0 0 0 83,-2.4 3,-1.7 -2,-0.5 -1,-0.1 0.892 101.9 51.3 -51.9 -46.0 7.9 -14.3 -12.7 16 19 A S G 3 S+ 0 0 17 82,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.605 107.9 54.2 -73.7 -9.5 7.2 -12.8 -9.3 17 20 A G G < S+ 0 0 0 -3,-1.4 278,-3.2 275,-0.2 279,-0.4 0.138 105.8 56.9 -99.1 16.5 7.0 -9.4 -10.9 18 21 A A S < S+ 0 0 18 -3,-1.7 2,-0.3 276,-0.2 -1,-0.2 -0.219 72.6 128.1-146.0 44.3 4.4 -10.7 -13.3 19 22 A I - 0 0 8 -3,-0.3 60,-0.1 64,-0.0 -3,-0.0 -0.763 62.9-107.9-101.8 148.8 1.5 -12.1 -11.2 20 23 A K >> - 0 0 42 -2,-0.3 4,-1.8 1,-0.1 3,-0.6 -0.642 17.9-139.1 -78.1 131.7 -2.1 -11.2 -11.7 21 24 A P H 3> S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.851 105.9 55.4 -59.0 -34.7 -3.4 -8.9 -8.9 22 25 A E H 3> S+ 0 0 93 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.815 105.8 52.2 -65.7 -31.2 -6.7 -10.9 -8.9 23 26 A T H <> S+ 0 0 0 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.858 108.6 50.0 -72.5 -36.8 -4.7 -14.1 -8.4 24 27 A I H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.950 111.7 48.3 -62.1 -50.2 -2.9 -12.4 -5.4 25 28 A L H X S+ 0 0 23 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.903 109.4 54.4 -53.6 -46.5 -6.3 -11.4 -3.9 26 29 A Y H X S+ 0 0 88 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.927 112.7 40.1 -57.0 -50.0 -7.7 -14.9 -4.5 27 30 A F H X S+ 0 0 4 -4,-1.9 4,-2.1 2,-0.2 6,-0.3 0.762 110.0 59.1 -76.8 -25.9 -4.9 -16.7 -2.5 28 31 A G H X>S+ 0 0 4 -4,-2.2 5,-1.8 2,-0.2 4,-0.6 0.912 111.9 42.0 -59.7 -46.0 -4.8 -14.0 0.2 29 32 A K H ><5S+ 0 0 169 -4,-2.1 3,-0.6 -5,-0.2 -2,-0.2 0.925 115.3 49.6 -67.3 -46.7 -8.5 -14.8 0.8 30 33 A K H 3<5S+ 0 0 142 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 117.1 39.7 -61.6 -38.1 -8.0 -18.6 0.5 31 34 A R H 3<5S- 0 0 80 -4,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.455 106.3-119.4 -94.6 -3.9 -5.0 -18.8 2.9 32 35 A G T <<5 + 0 0 73 -3,-0.6 2,-0.5 -4,-0.6 -3,-0.2 0.836 62.5 147.7 64.3 34.3 -6.2 -16.3 5.5 33 36 A I < - 0 0 52 -5,-1.8 -1,-0.2 -6,-0.3 -2,-0.1 -0.903 49.3-113.2-105.0 128.3 -3.2 -14.0 4.9 34 37 A A - 0 0 95 -2,-0.5 34,-0.1 -3,-0.1 -5,-0.0 -0.250 31.4-175.6 -64.3 141.0 -3.7 -10.2 5.3 35 38 A L - 0 0 37 2,-0.0 30,-0.1 33,-0.0 29,-0.0 -0.998 32.2-126.6-138.1 139.2 -3.5 -7.8 2.3 36 39 A P S S+ 0 0 79 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 0.391 92.4 34.2 -69.8 4.2 -3.8 -4.0 2.4 37 40 A A - 0 0 8 6,-0.0 -2,-0.0 -12,-0.0 3,-0.0 -0.985 57.6-153.8-149.4 156.4 -6.6 -4.0 -0.2 38 41 A D S S+ 0 0 131 -2,-0.3 2,-0.2 0, 0.0 3,-0.1 -0.487 74.1 58.1-130.7 63.4 -9.5 -6.0 -1.3 39 42 A T S > S- 0 0 62 1,-0.1 4,-2.4 -18,-0.1 5,-0.2 -0.848 80.7-115.5-171.3 157.4 -9.9 -5.2 -5.0 40 43 A V H > S+ 0 0 49 -2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.947 114.5 52.5 -59.7 -49.3 -7.8 -5.3 -8.1 41 44 A E H > S+ 0 0 137 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.909 112.8 42.8 -53.4 -50.5 -7.8 -1.5 -8.5 42 45 A E H > S+ 0 0 86 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.881 113.4 51.4 -67.4 -41.4 -6.6 -0.9 -4.9 43 46 A L H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 5,-0.4 0.906 110.7 49.9 -61.0 -41.6 -4.0 -3.6 -5.0 44 47 A R H X S+ 0 0 102 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.877 107.6 53.6 -64.0 -40.3 -2.7 -2.2 -8.3 45 48 A N H < S+ 0 0 98 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.803 114.8 41.8 -62.8 -32.6 -2.5 1.3 -6.7 46 49 A I H < S+ 0 0 45 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.927 127.8 27.3 -79.3 -51.9 -0.4 -0.1 -3.9 47 50 A I H < S+ 0 0 0 -4,-2.7 -3,-0.2 -5,-0.1 -2,-0.2 0.789 109.9 79.3 -85.7 -33.8 1.9 -2.5 -5.8 48 51 A G S < S- 0 0 6 -4,-2.4 2,-0.4 -5,-0.4 249,-0.2 -0.328 71.6-140.3 -72.3 160.1 1.9 -0.6 -9.1 49 52 A M + 0 0 8 247,-1.5 216,-0.1 246,-0.2 -3,-0.1 -0.992 23.5 176.3-131.6 125.5 4.0 2.5 -9.7 50 53 A D S S+ 0 0 106 -2,-0.4 -1,-0.1 -5,-0.1 247,-0.0 0.679 74.9 32.0 -94.2 -27.2 3.0 5.6 -11.6 51 54 A K S S- 0 0 149 214,-0.1 -1,-0.1 1,-0.0 214,-0.0 -0.921 98.4 -77.1-134.1 157.0 6.1 7.6 -10.9 52 55 A P + 0 0 52 0, 0.0 214,-0.2 0, 0.0 213,-0.2 -0.239 49.7 161.3 -57.1 133.1 9.9 6.9 -10.5 53 56 A L - 0 0 86 212,-3.3 2,-0.3 1,-0.1 213,-0.1 0.375 38.0-101.4-110.1-102.8 10.9 5.6 -7.1 54 57 A S > - 0 0 51 1,-0.1 4,-1.6 211,-0.1 213,-0.2 -0.928 36.9 -77.2-174.9 175.0 14.2 3.8 -6.7 55 58 A Q H > S+ 0 0 40 -2,-0.3 4,-2.5 2,-0.2 3,-0.2 0.969 128.3 41.1 -57.8 -54.6 15.7 0.3 -6.4 56 59 A P H > S+ 0 0 77 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.884 113.8 51.8 -65.0 -40.4 14.7 -0.2 -2.7 57 60 A G H 4 S+ 0 0 22 2,-0.2 4,-0.4 1,-0.2 -2,-0.2 0.795 112.2 48.1 -66.3 -30.4 11.2 1.3 -3.2 58 61 A T H >< S+ 0 0 9 -4,-1.6 3,-1.6 -3,-0.2 4,-0.3 0.951 111.8 47.2 -69.8 -54.7 10.6 -1.0 -6.1 59 62 A L H >< S+ 0 0 98 -4,-2.5 3,-1.3 1,-0.3 4,-0.4 0.791 100.1 71.4 -58.5 -29.5 11.8 -4.1 -4.3 60 63 A A T >< S+ 0 0 48 -4,-2.0 3,-0.8 1,-0.2 4,-0.4 0.759 83.1 69.3 -60.5 -26.6 9.6 -3.1 -1.3 61 64 A K T X> S+ 0 0 36 -3,-1.6 3,-1.1 -4,-0.4 4,-0.6 0.779 85.6 69.5 -62.6 -28.9 6.4 -4.0 -3.2 62 65 A W H X> S+ 0 0 28 -3,-1.3 4,-2.7 -4,-0.3 3,-0.7 0.839 86.9 64.7 -62.3 -34.2 7.2 -7.7 -3.1 63 66 A D H <4 S+ 0 0 91 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.775 94.8 61.7 -61.2 -26.4 6.6 -7.9 0.7 64 67 A Y H <4 S+ 0 0 106 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.886 122.1 14.0 -66.5 -38.5 2.9 -7.0 0.2 65 68 A Y H XX S+ 0 0 0 -3,-0.7 3,-1.0 -4,-0.6 4,-0.8 0.632 102.6 81.9-120.1 -19.4 2.1 -10.1 -1.9 66 69 A M H >X S+ 0 0 1 -4,-2.7 4,-3.0 1,-0.2 3,-0.6 0.834 87.9 61.2 -61.6 -33.4 4.8 -12.7 -1.7 67 70 A P H 34 S+ 0 0 30 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.806 103.9 52.0 -60.0 -27.4 3.5 -14.1 1.6 68 71 A V H <4 S+ 0 0 0 -3,-1.0 -2,-0.2 1,-0.1 7,-0.1 0.744 120.8 32.0 -76.4 -25.4 0.3 -15.0 -0.3 69 72 A I H X< S+ 0 0 0 -4,-0.8 3,-1.4 -3,-0.6 7,-0.2 0.876 98.6 82.5-102.1 -50.5 2.2 -16.8 -3.0 70 73 A A T 3< S+ 0 0 0 -4,-3.0 35,-0.2 1,-0.2 34,-0.1 -0.298 96.5 22.9 -60.6 139.8 5.3 -18.4 -1.4 71 74 A G T 3 S+ 0 0 13 33,-2.4 2,-0.6 1,-0.1 -1,-0.2 0.429 95.5 106.5 85.7 0.4 4.7 -21.8 0.3 72 75 A C <> - 0 0 24 -3,-1.4 4,-2.3 32,-0.2 3,-0.2 -0.940 52.8-161.8-119.6 109.7 1.6 -22.7 -1.6 73 76 A R H > S+ 0 0 107 -2,-0.6 4,-1.7 1,-0.2 5,-0.2 0.864 93.0 50.5 -56.4 -44.3 2.0 -25.4 -4.2 74 77 A E H > S+ 0 0 120 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.869 111.5 48.4 -61.1 -42.1 -1.3 -24.5 -6.0 75 78 A A H > S+ 0 0 0 -3,-0.2 4,-2.0 2,-0.2 5,-0.2 0.890 108.2 53.2 -67.7 -41.9 -0.3 -20.8 -6.2 76 79 A I H X S+ 0 0 0 -4,-2.3 4,-1.1 -7,-0.2 -2,-0.2 0.904 112.6 43.1 -64.1 -44.0 3.2 -21.4 -7.5 77 80 A K H X S+ 0 0 54 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.903 112.8 54.0 -67.2 -40.4 2.0 -23.6 -10.5 78 81 A R H X S+ 0 0 72 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.844 104.9 51.1 -68.2 -36.7 -0.8 -21.2 -11.3 79 82 A I H X S+ 0 0 1 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.858 111.5 49.8 -69.1 -32.7 1.3 -18.0 -11.6 80 83 A A H X S+ 0 0 0 -4,-1.1 4,-1.6 -5,-0.2 -2,-0.2 0.930 112.9 46.3 -67.9 -47.0 3.6 -19.9 -14.0 81 84 A Y H X S+ 0 0 76 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.930 116.0 45.0 -57.9 -48.5 0.6 -21.1 -16.0 82 85 A E H X S+ 0 0 27 -4,-2.8 4,-2.1 1,-0.2 5,-0.2 0.757 103.8 64.0 -72.1 -27.4 -0.9 -17.6 -16.0 83 86 A F H X S+ 0 0 4 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.942 105.9 45.6 -57.6 -46.3 2.4 -16.0 -16.9 84 87 A V H X S+ 0 0 0 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.903 109.9 54.9 -62.3 -44.8 2.3 -17.9 -20.2 85 88 A E H X S+ 0 0 48 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.930 112.4 41.0 -54.3 -50.8 -1.3 -16.9 -20.8 86 89 A M H < S+ 0 0 73 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.848 114.0 52.0 -75.0 -33.3 -0.7 -13.2 -20.5 87 90 A K H ><>S+ 0 0 5 -4,-1.9 3,-1.8 -5,-0.2 5,-1.2 0.884 103.4 58.7 -65.6 -40.7 2.6 -13.2 -22.4 88 91 A A H ><5S+ 0 0 30 -4,-2.5 3,-1.0 1,-0.3 -1,-0.2 0.820 101.5 57.0 -56.2 -32.3 0.9 -15.1 -25.3 89 92 A K T 3<5S+ 0 0 149 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.601 97.3 63.3 -74.8 -13.5 -1.5 -12.1 -25.4 90 93 A E T < 5S- 0 0 34 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.283 116.2-106.8 -95.8 10.3 1.5 -9.7 -26.0 91 94 A G T < 5 + 0 0 37 -3,-1.0 -83,-2.2 1,-0.3 2,-0.5 0.768 68.4 151.1 70.2 26.2 2.6 -11.2 -29.3 92 95 A V E < -a 8 0A 2 -5,-1.2 -1,-0.3 -85,-0.2 -83,-0.2 -0.795 27.1-177.8 -89.9 127.7 5.6 -12.9 -27.8 93 96 A V E S+ 0 0 11 -85,-2.1 51,-2.2 -2,-0.5 2,-0.3 0.676 75.3 25.6 -95.1 -23.8 6.7 -16.2 -29.5 94 97 A Y E -ac 9 144A 2 -86,-1.0 -84,-2.1 49,-0.2 2,-0.4 -0.946 67.6-179.4-146.0 124.6 9.6 -16.9 -27.1 95 98 A V E -ac 10 145A 0 49,-2.5 51,-2.4 -2,-0.3 2,-0.5 -0.967 17.0-159.5-122.5 137.6 10.0 -15.9 -23.4 96 99 A E E - c 0 146A 0 -86,-2.3 2,-0.4 -2,-0.4 -83,-0.4 -0.980 21.2-167.4-104.9 124.5 12.7 -16.5 -20.9 97 100 A V E - c 0 147A 0 49,-2.7 51,-2.2 -2,-0.5 2,-0.3 -0.917 1.9-158.7-116.3 138.8 11.3 -16.0 -17.4 98 101 A R E +bc 14 148A 0 -85,-2.5 -83,-2.4 -2,-0.4 -82,-0.4 -0.855 18.2 150.5-124.7 152.8 13.4 -15.7 -14.2 99 102 A Y E - c 0 149A 4 49,-1.9 51,-2.3 -2,-0.3 79,-0.2 -0.978 45.0-106.1-166.9 161.7 12.9 -16.2 -10.4 100 103 A S > - 0 0 8 -2,-0.3 3,-0.8 49,-0.2 4,-0.4 -0.903 23.0-158.1 -96.0 112.9 14.6 -17.1 -7.2 101 104 A P G > S+ 0 0 0 0, 0.0 3,-1.0 0, 0.0 4,-0.5 0.827 92.2 60.4 -60.9 -30.4 13.4 -20.6 -6.2 102 105 A H G > S+ 0 0 0 48,-0.3 3,-0.8 1,-0.2 5,-0.1 0.834 96.2 60.1 -64.3 -33.8 14.4 -19.8 -2.6 103 106 A L G < S+ 0 0 30 -3,-0.8 -1,-0.2 1,-0.2 -33,-0.2 0.555 107.2 45.2 -76.0 -8.9 12.0 -16.8 -2.5 104 107 A L G < S+ 0 0 2 -3,-1.0 -33,-2.4 -4,-0.4 -1,-0.2 0.429 98.5 92.7-107.1 -1.9 9.0 -19.1 -3.2 105 108 A A < - 0 0 0 -3,-0.8 17,-0.2 -4,-0.5 -35,-0.1 -0.546 45.7-175.6 -90.1 153.9 10.0 -21.8 -0.7 106 109 A N S S+ 0 0 13 15,-2.0 13,-2.7 -2,-0.2 2,-0.3 0.159 70.4 65.7-126.9 14.8 9.0 -22.2 3.0 107 110 A S S S+ 0 0 15 14,-1.4 13,-0.1 11,-0.2 -1,-0.1 -1.000 104.2 4.9-140.9 136.4 11.2 -25.2 3.7 108 111 A K S S+ 0 0 159 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.851 90.7 125.3 60.3 39.2 15.0 -25.7 3.8 109 112 A V - 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0 0 10 -5,-1.4 2,-0.3 -6,-0.1 -1,-0.2 -0.694 50.0-159.4-126.8 164.0 3.1 -2.6 -18.3 300 303 A T >> - 0 0 60 -2,-0.2 3,-1.3 -3,-0.1 4,-0.8 -0.800 52.9 -89.8-126.1 176.5 3.0 -4.9 -21.2 301 304 A L H 3> S+ 0 0 0 -2,-0.3 4,-1.4 1,-0.3 3,-0.3 0.811 126.2 65.1 -58.0 -29.0 5.7 -5.3 -23.8 302 305 A D H 3> S+ 0 0 47 1,-0.2 4,-3.5 2,-0.2 -1,-0.3 0.817 91.1 63.8 -64.9 -32.6 3.9 -2.6 -25.8 303 306 A T H <> S+ 0 0 39 -3,-1.3 4,-2.0 1,-0.2 -1,-0.2 0.927 106.6 42.9 -51.1 -49.1 4.7 -0.0 -23.0 304 307 A D H X S+ 0 0 0 -4,-0.8 4,-1.4 -3,-0.3 -1,-0.2 0.797 116.8 46.4 -74.3 -30.5 8.4 -0.4 -23.7 305 308 A Y H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.875 111.5 51.3 -78.3 -40.0 8.0 -0.3 -27.5 306 309 A Q H X S+ 0 0 40 -4,-3.5 4,-2.5 1,-0.2 5,-0.3 0.913 109.0 53.6 -55.6 -44.5 5.6 2.7 -27.4 307 310 A M H X>S+ 0 0 17 -4,-2.0 4,-2.0 -5,-0.3 5,-0.5 0.913 112.0 41.7 -59.7 -48.9 8.2 4.5 -25.2 308 311 A T H X5S+ 0 0 0 -4,-1.4 6,-1.7 3,-0.2 4,-1.1 0.864 115.6 50.0 -68.6 -39.5 11.1 4.0 -27.7 309 312 A K H X5S+ 0 0 93 -4,-2.2 4,-0.6 4,-0.2 -2,-0.2 0.926 119.7 34.4 -65.6 -46.3 9.0 4.7 -30.8 310 313 A K H <5S+ 0 0 160 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.970 131.1 26.2 -76.6 -54.9 7.5 8.0 -29.4 311 314 A D H <5S+ 0 0 123 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.1 0.729 132.0 33.1 -85.5 -23.1 10.3 9.5 -27.4 312 315 A M H < - 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