==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-DEC-09 3KZP . COMPND 2 MOLECULE: PUTATIVE DIGUANYLATE CYCLASE/PHOSPHODIESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES; . AUTHOR M.M.KLIMECKA,M.CHRUSZCZ,M.D.ZIMMERMAN,M.KUDRITSKA,A.SAVCHENK . 463 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20043.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 353 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 34 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 0 0 2 3 3 0 0 0 0 0 0 0 4 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 2 2 4 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 . 2 2 0 0 0 0 0 2 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 2 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 5 A K 0 0 128 0, 0.0 26,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 13.7 41.3 65.2 23.0 2 6 A F + 0 0 34 24,-0.2 2,-0.3 25,-0.1 24,-0.2 -0.944 360.0 175.3-125.7 147.2 43.2 62.0 24.1 3 7 A Q E -A 25 0A 62 22,-2.7 22,-2.5 -2,-0.4 2,-0.4 -0.970 26.6-115.3-139.9 165.2 42.4 59.3 26.5 4 8 A L E -A 24 0A 6 -2,-0.3 227,-2.1 20,-0.2 2,-0.3 -0.848 23.4-171.7-102.8 134.7 43.9 56.0 27.6 5 9 A F E -AB 23 230A 18 18,-3.2 18,-2.9 -2,-0.4 2,-0.4 -0.799 13.1-142.0-107.5 162.3 42.4 52.6 27.2 6 10 A I E -AB 22 229A 2 223,-3.2 223,-2.0 -2,-0.3 16,-0.2 -0.970 7.2-163.4-121.1 141.5 43.7 49.3 28.6 7 11 A Q E -A 21 0A 33 14,-2.7 14,-2.1 -2,-0.4 12,-0.1 -0.904 17.2-142.4-120.2 105.1 43.7 45.9 26.9 8 12 A P E -A 20 0A 13 0, 0.0 2,-0.7 0, 0.0 12,-0.2 -0.457 17.5-133.8 -59.6 132.6 44.2 43.0 29.3 9 13 A K E -A 19 0A 2 10,-3.1 9,-3.3 -2,-0.1 10,-0.6 -0.859 24.8-161.0 -95.3 112.3 46.4 40.4 27.6 10 14 A L E -A 17 0A 40 -2,-0.7 214,-2.4 214,-0.3 7,-0.2 -0.799 18.4-120.2-105.7 124.2 44.8 37.1 28.1 11 15 A D B > -I 223 0B 16 5,-2.5 4,-1.7 -2,-0.5 212,-0.2 -0.335 19.8-137.9 -59.5 133.4 46.6 33.8 27.8 12 16 A V T 4 S+ 0 0 17 210,-1.4 -1,-0.1 1,-0.2 194,-0.1 0.846 95.9 41.3 -67.5 -32.9 44.9 31.7 25.1 13 17 A L T 4 S+ 0 0 129 209,-0.2 -1,-0.2 1,-0.1 210,-0.0 0.838 133.6 11.9 -91.6 -34.6 45.1 28.4 27.0 14 18 A Q T 4 S- 0 0 156 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.539 90.0-128.1-126.3 -9.8 44.2 29.3 30.6 15 19 A G < + 0 0 37 -4,-1.7 -3,-0.1 1,-0.2 2,-0.0 0.480 51.4 151.8 80.6 4.1 42.9 32.8 30.3 16 20 A N - 0 0 68 -6,-0.1 -5,-2.5 1,-0.1 2,-0.7 -0.326 53.3-107.2 -63.3 151.7 45.1 34.4 33.0 17 21 A I E +A 10 0A 78 -7,-0.2 -7,-0.2 1,-0.2 3,-0.1 -0.699 36.0 179.2 -81.7 111.2 46.0 38.2 32.6 18 22 A V E - 0 0 50 -9,-3.3 52,-0.4 -2,-0.7 2,-0.3 0.925 63.2 -35.0 -83.0 -43.1 49.6 38.3 31.6 19 23 A E E -A 9 0A 6 -10,-0.6 -10,-3.1 50,-0.1 2,-0.4 -0.917 59.4-109.9-162.9 171.5 49.9 42.1 31.4 20 24 A Y E -Ac 8 71A 30 50,-2.4 52,-2.5 -2,-0.3 2,-0.4 -0.989 22.8-144.9-116.4 137.9 47.8 45.1 30.4 21 25 A E E -Ac 7 72A 11 -14,-2.1 -14,-2.7 -2,-0.4 2,-0.5 -0.830 11.1-139.4-102.3 132.9 48.5 47.2 27.3 22 26 A I E -A 6 0A 3 50,-2.8 52,-0.4 -2,-0.4 2,-0.4 -0.816 23.9-170.2 -89.8 125.8 47.9 50.9 27.4 23 27 A L E -A 5 0A 18 -18,-2.9 -18,-3.2 -2,-0.5 2,-0.3 -0.959 20.0-127.4-125.8 136.9 46.4 52.2 24.2 24 28 A L E +A 4 0A 19 -2,-0.4 2,-0.3 -20,-0.2 -20,-0.2 -0.631 33.2 172.7 -77.6 136.0 45.8 55.8 23.0 25 29 A R E -A 3 0A 42 -22,-2.5 -22,-2.7 -2,-0.3 8,-0.2 -0.965 26.0-125.9-139.1 154.8 42.2 56.6 21.9 26 30 A D - 0 0 2 6,-1.9 -24,-0.2 -2,-0.3 7,-0.0 -0.133 37.0 -98.7 -81.1-170.8 40.5 59.8 20.9 27 31 A D S S+ 0 0 116 -26,-0.5 -25,-0.1 4,-0.1 -1,-0.0 -0.017 71.5 144.5 -99.8 28.4 37.2 61.2 22.5 28 32 A S - 0 0 48 4,-0.2 -3,-0.0 2,-0.1 0, 0.0 -0.197 67.7-114.0 -69.8 160.2 35.0 59.8 19.7 29 33 A A S S+ 0 0 118 1,-0.3 -1,-0.1 2,-0.0 0, 0.0 0.933 125.1 26.8 -54.7 -47.4 31.5 58.4 20.1 30 34 A V S S- 0 0 116 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.955 104.7-133.8-112.7 109.1 33.3 55.2 19.1 31 35 A P + 0 0 43 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 -0.359 31.4 170.8 -67.4 139.1 36.9 55.7 20.2 32 36 A R - 0 0 127 -2,-0.1 -6,-1.9 0, 0.0 -4,-0.2 -0.910 48.7 -72.8-134.6 165.1 39.6 54.8 17.7 33 37 A F - 0 0 75 -2,-0.3 2,-1.8 -8,-0.2 3,-0.2 -0.427 49.2-128.9 -56.6 130.1 43.4 55.3 17.7 34 38 A P > + 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 -0.558 43.4 162.8 -90.5 74.8 43.8 59.0 17.0 35 39 A L H > S+ 0 0 19 -2,-1.8 4,-2.5 1,-0.2 5,-0.2 0.950 71.7 42.4 -62.6 -55.5 46.3 58.7 14.1 36 40 A S H > S+ 0 0 58 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.907 116.6 50.1 -55.8 -44.0 46.0 62.2 12.6 37 41 A E H > S+ 0 0 49 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.928 110.2 47.9 -64.5 -45.3 46.0 63.8 16.1 38 42 A L H X S+ 0 0 11 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.886 111.4 52.1 -65.2 -37.6 49.1 62.0 17.3 39 43 A E H X S+ 0 0 23 -4,-2.5 4,-1.4 -5,-0.2 -1,-0.2 0.879 107.9 51.1 -64.9 -36.2 50.9 62.9 14.0 40 44 A A H < S+ 0 0 55 -4,-2.1 4,-0.3 -5,-0.2 -2,-0.2 0.900 111.8 47.6 -66.2 -38.2 50.1 66.6 14.5 41 45 A V H >< S+ 0 0 4 -4,-1.9 3,-1.1 1,-0.2 7,-0.3 0.887 110.1 52.7 -65.1 -42.8 51.5 66.4 18.1 42 46 A L H 3< S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.791 105.1 56.6 -66.0 -26.5 54.6 64.6 16.7 43 47 A A T 3< S+ 0 0 82 -4,-1.4 2,-0.4 -5,-0.1 -1,-0.2 0.529 105.1 54.2 -83.5 -5.1 55.1 67.4 14.2 44 48 A D <> - 0 0 71 -3,-1.1 4,-2.5 -4,-0.3 5,-0.2 -0.971 67.5-152.4-137.7 117.3 55.3 70.2 16.8 45 49 A E H > S+ 0 0 80 -2,-0.4 4,-2.5 1,-0.2 5,-0.1 0.842 96.7 52.3 -61.2 -38.8 57.7 70.2 19.7 46 50 A E H > S+ 0 0 159 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.916 113.0 44.1 -63.6 -41.5 55.5 72.3 22.0 47 51 A L H > S+ 0 0 80 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.854 111.3 53.9 -71.3 -33.9 52.5 70.1 21.4 48 52 A Y H X S+ 0 0 0 -4,-2.5 4,-2.9 -7,-0.3 -2,-0.2 0.912 107.7 50.7 -67.2 -38.2 54.6 67.0 21.9 49 53 A L H X S+ 0 0 75 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.953 112.8 46.1 -59.2 -48.5 55.8 68.4 25.3 50 54 A A H X S+ 0 0 59 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.906 114.5 47.6 -62.8 -41.6 52.2 69.0 26.4 51 55 A F H X S+ 0 0 15 -4,-2.7 4,-3.5 2,-0.2 -2,-0.2 0.930 111.0 51.6 -64.5 -44.4 51.1 65.5 25.1 52 56 A S H X S+ 0 0 4 -4,-2.9 4,-2.6 2,-0.2 5,-0.3 0.885 109.6 49.6 -59.9 -40.7 54.1 63.9 26.9 53 57 A E H X S+ 0 0 117 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.923 114.4 45.1 -66.6 -45.3 53.2 65.6 30.1 54 58 A W H X S+ 0 0 84 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.917 115.9 46.3 -57.1 -51.3 49.6 64.4 29.8 55 59 A F H X S+ 0 0 15 -4,-3.5 4,-3.0 2,-0.2 5,-0.2 0.938 112.4 47.1 -62.4 -46.9 50.6 60.9 28.9 56 60 A S H X S+ 0 0 20 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.898 115.5 45.7 -68.8 -38.4 53.2 60.3 31.5 57 61 A E H X S+ 0 0 98 -4,-1.7 4,-2.3 -5,-0.3 -1,-0.2 0.921 114.1 48.7 -69.0 -43.5 51.0 61.7 34.3 58 62 A A H X S+ 0 0 19 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.910 113.8 47.0 -60.7 -43.1 48.0 59.7 33.1 59 63 A F H X S+ 0 0 0 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.874 108.3 54.3 -70.2 -36.1 50.1 56.5 32.9 60 64 A L H X S+ 0 0 32 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.924 105.3 54.2 -63.0 -41.1 51.6 57.1 36.3 61 65 A D H X S+ 0 0 93 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.916 109.6 49.2 -53.8 -44.6 48.0 57.3 37.7 62 66 A V H X S+ 0 0 7 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.933 107.5 53.1 -59.2 -51.0 47.3 53.9 36.1 63 67 A L H < S+ 0 0 1 -4,-2.5 6,-0.2 1,-0.2 -1,-0.2 0.874 109.9 48.5 -53.8 -41.9 50.5 52.3 37.5 64 68 A K H < S+ 0 0 140 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.870 109.1 53.4 -67.2 -39.1 49.4 53.4 41.1 65 69 A K H < S+ 0 0 129 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.839 120.8 31.2 -63.4 -40.4 45.9 52.0 40.6 66 70 A Y S >< S+ 0 0 56 -4,-2.0 3,-0.9 1,-0.1 -1,-0.3 -0.752 72.3 164.8-118.0 79.5 47.3 48.6 39.5 67 71 A P T 3 + 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.697 69.2 54.0 -77.4 -11.8 50.6 48.3 41.5 68 72 A N T 3 S+ 0 0 145 2,-0.1 2,-0.3 0, 0.0 -5,-0.0 0.344 95.4 79.4 -98.3 4.0 51.1 44.5 41.1 69 73 A D S < S- 0 0 50 -3,-0.9 2,-0.4 -6,-0.2 -50,-0.1 -0.798 73.6-112.6-120.1 159.0 50.9 44.2 37.3 70 74 A R - 0 0 52 -52,-0.4 -50,-2.4 -2,-0.3 2,-0.4 -0.724 28.9-159.3 -84.7 137.6 53.0 44.6 34.2 71 75 A F E -cd 20 99A 0 27,-2.2 29,-2.5 -2,-0.4 2,-0.4 -0.937 4.7-153.4-119.0 132.6 52.0 47.4 31.7 72 76 A A E -cd 21 100A 0 -52,-2.5 -50,-2.8 -2,-0.4 2,-0.3 -0.905 14.0-172.9-102.0 129.9 53.0 47.5 28.0 73 77 A I E - d 0 101A 0 27,-2.5 29,-3.1 -2,-0.4 2,-0.5 -0.936 19.4-128.6-120.0 150.4 53.1 51.1 26.4 74 78 A N E - d 0 102A 42 -52,-0.4 2,-0.4 -2,-0.3 29,-0.2 -0.866 23.7-177.8-102.5 131.6 53.7 51.7 22.7 75 79 A I E - d 0 103A 1 27,-2.4 29,-1.9 -2,-0.5 -2,-0.0 -0.994 20.4-138.3-128.8 127.9 56.3 54.1 21.5 76 80 A A >> - 0 0 1 -2,-0.4 3,-1.5 27,-0.2 4,-0.6 -0.496 24.1-121.9 -77.9 142.1 56.9 54.9 17.9 77 81 A P G >4 S+ 0 0 2 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.872 110.4 62.4 -58.0 -29.7 60.6 55.1 17.0 78 82 A Q G >4 S+ 0 0 9 1,-0.3 3,-1.4 2,-0.2 4,-0.1 0.722 89.1 68.1 -69.7 -19.4 60.2 58.7 15.8 79 83 A Q G X4 S+ 0 0 15 -3,-1.5 3,-1.6 1,-0.3 6,-0.4 0.790 86.3 71.5 -68.5 -21.0 59.2 59.8 19.3 80 84 A L G << S+ 0 0 1 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.609 81.4 70.8 -70.7 -13.9 62.8 59.0 20.3 81 85 A F G < S+ 0 0 7 -3,-1.4 2,-0.5 -4,-0.2 -1,-0.3 0.473 87.2 78.4 -77.4 -9.3 64.0 62.1 18.4 82 86 A Y S X> S- 0 0 5 -3,-1.6 3,-1.4 1,-0.1 4,-0.7 -0.939 73.6-149.8-100.5 122.9 62.4 64.2 21.1 83 87 A I H 3> S+ 0 0 132 -2,-0.5 4,-2.5 1,-0.3 5,-0.2 0.811 94.5 71.9 -58.1 -29.3 64.4 64.5 24.4 84 88 A E H 3> S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.866 91.2 58.9 -55.5 -35.1 61.1 64.9 26.2 85 89 A T H <> S+ 0 0 0 -3,-1.4 4,-1.7 -6,-0.4 -1,-0.2 0.950 108.8 40.7 -64.5 -49.8 60.4 61.2 25.5 86 90 A L H X S+ 0 0 26 -4,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.848 110.6 62.4 -65.9 -31.6 63.5 60.0 27.3 87 91 A H H X S+ 0 0 114 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.920 108.0 40.1 -60.5 -43.8 62.8 62.6 30.0 88 92 A W H X S+ 0 0 13 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.809 112.3 54.9 -80.1 -22.6 59.5 61.1 31.0 89 93 A L H < S+ 0 0 0 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.873 109.5 50.5 -68.6 -35.9 60.9 57.5 30.7 90 94 A D H >< S+ 0 0 54 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.934 108.1 51.6 -64.5 -42.9 63.5 58.7 33.1 91 95 A K H 3< S+ 0 0 109 -4,-2.0 3,-0.4 1,-0.3 -2,-0.2 0.834 112.5 44.7 -66.2 -30.1 60.9 60.1 35.4 92 96 A L T >< S+ 0 0 10 -4,-1.6 3,-2.3 1,-0.2 -1,-0.3 0.282 80.8 113.6 -90.3 9.5 58.9 56.8 35.5 93 97 A K G X + 0 0 106 -3,-1.5 3,-1.3 1,-0.3 4,-0.3 0.689 59.5 70.4 -64.2 -23.3 62.1 54.7 35.9 94 98 A S G 3 S+ 0 0 83 -3,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.665 107.8 41.2 -63.5 -18.0 61.2 53.5 39.5 95 99 A E G X S+ 0 0 48 -3,-2.3 3,-2.2 1,-0.1 -1,-0.3 0.368 80.3 105.4-108.2 3.0 58.6 51.4 37.8 96 100 A S G X + 0 0 10 -3,-1.3 3,-1.8 1,-0.3 43,-0.5 0.743 67.4 72.6 -57.2 -25.7 60.5 50.3 34.8 97 101 A H G 3 S+ 0 0 123 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.580 107.8 34.8 -69.4 -9.3 60.8 46.8 36.3 98 102 A R G < S+ 0 0 24 -3,-2.2 -27,-2.2 -29,-0.0 2,-0.4 0.117 103.5 90.6-126.4 25.6 57.2 46.2 35.5 99 103 A I E < -d 71 0A 0 -3,-1.8 40,-2.0 -29,-0.2 2,-0.5 -0.987 54.3-159.6-124.4 132.1 56.9 48.2 32.3 100 104 A T E -de 72 139A 0 -29,-2.5 -27,-2.5 -2,-0.4 2,-0.7 -0.932 9.6-149.5-102.6 127.3 57.4 46.9 28.7 101 105 A V E -de 73 140A 0 38,-3.3 40,-2.9 -2,-0.5 2,-0.7 -0.900 11.3-157.7 -95.1 114.0 58.2 49.4 26.0 102 106 A E E -de 74 141A 0 -29,-3.1 -27,-2.4 -2,-0.7 2,-0.6 -0.901 8.9-144.9 -94.9 113.1 56.8 48.1 22.8 103 107 A X E -de 75 142A 1 38,-3.3 40,-2.4 -2,-0.7 -27,-0.2 -0.676 24.0-139.3 -78.7 118.4 58.6 49.7 19.9 104 108 A T - 0 0 7 -29,-1.9 40,-0.1 -2,-0.6 -1,-0.1 -0.285 13.4-124.2 -81.4 166.4 55.9 50.1 17.2 105 109 A E + 0 0 22 -29,-0.1 44,-1.9 45,-0.1 45,-0.2 0.305 64.0 137.5 -88.4 3.6 56.2 49.5 13.4 106 110 A D - 0 0 43 42,-0.2 2,-0.5 43,-0.1 -28,-0.2 -0.198 45.1-154.6 -58.3 147.2 55.0 53.0 12.6 107 111 A I + 0 0 43 -30,-0.1 2,-0.2 -31,-0.1 -1,-0.1 -0.847 30.2 164.6-121.7 81.5 56.7 55.2 10.0 108 112 A F - 0 0 7 -2,-0.5 2,-0.2 1,-0.1 243,-0.1 -0.649 47.1 -87.5 -93.8 161.3 55.9 58.7 11.1 109 113 A D - 0 0 32 -2,-0.2 -1,-0.1 239,-0.1 3,-0.1 -0.479 47.8-114.6 -68.4 135.9 57.6 61.9 9.9 110 114 A V - 0 0 14 -2,-0.2 5,-0.1 1,-0.1 -1,-0.1 -0.511 38.3 -94.5 -75.5 134.0 60.7 62.6 11.8 111 115 A P > - 0 0 1 0, 0.0 3,-2.1 0, 0.0 4,-0.4 -0.201 40.0-113.7 -50.2 142.1 60.6 65.9 13.9 112 116 A G G > S+ 0 0 36 1,-0.3 3,-1.2 -69,-0.2 4,-0.4 0.778 109.9 63.0 -59.5 -30.4 62.1 68.7 11.9 113 117 A H G 3 S+ 0 0 79 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.627 110.0 42.7 -73.4 -11.8 65.2 69.3 14.1 114 118 A K G X S+ 0 0 49 -3,-2.1 3,-1.2 1,-0.1 -1,-0.3 0.353 84.7 94.5-111.2 2.4 66.4 65.8 13.3 115 119 A R T < S+ 0 0 81 -3,-1.2 227,-0.1 -4,-0.4 -2,-0.1 0.813 72.5 70.5 -65.5 -26.1 65.6 65.7 9.5 116 120 A H T 3 S+ 0 0 143 -4,-0.4 -1,-0.2 -3,-0.1 2,-0.2 0.744 78.9 96.3 -60.6 -24.4 69.2 66.8 8.7 117 121 A L S < S- 0 0 29 -3,-1.2 -3,-0.0 1,-0.1 5,-0.0 -0.471 79.8-122.0 -69.0 131.5 70.5 63.4 9.8 118 122 A N > - 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p 0 432C 0 -24,-2.4 -21,-2.9 -2,-0.4 2,-0.4 -0.967 6.0-167.8-117.9 134.0 64.2 39.8 -3.9 400 171 B F E - p 0 433C 0 32,-2.6 34,-2.6 -2,-0.4 2,-0.7 -0.966 11.3-152.7-122.5 124.4 66.0 38.6 -0.7 401 172 B S E > - p 0 434C 2 -2,-0.4 3,-1.6 -23,-0.4 34,-0.2 -0.889 11.7-166.7-112.9 111.5 69.5 39.8 -0.2 402 173 B L G > S+ 0 0 22 32,-2.3 3,-2.4 -2,-0.7 33,-0.2 0.867 86.0 70.0 -64.3 -38.0 71.8 37.7 1.8 403 174 B I G > S+ 0 0 94 1,-0.3 3,-0.6 31,-0.2 -1,-0.3 0.640 91.8 58.0 -46.5 -31.2 74.3 40.6 2.1 404 175 B H G < S+ 0 0 63 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.436 106.7 50.1 -82.2 -1.2 71.9 42.4 4.4 405 176 B F G X + 0 0 7 -3,-2.4 3,-1.7 -4,-0.1 -1,-0.2 -0.081 61.8 141.0-135.5 38.2 71.9 39.6 6.9 406 177 B K T < S+ 0 0 168 -3,-0.6 -1,-0.1 1,-0.2 4,-0.1 0.799 72.1 51.1 -45.1 -43.5 75.6 38.7 7.6 407 178 B N T 3 S+ 0 0 135 -3,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.485 86.1 97.2 -92.3 6.0 75.2 38.0 11.3 408 179 B I S < S- 0 0 11 -3,-1.7 5,-0.2 1,-0.0 -3,-0.1 -0.801 83.9-112.7 -91.8 118.1 72.3 35.6 11.1 409 180 B P >> - 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