==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 16-DEC-10 3Q11 . COMPND 2 MOLECULE: ASPARTATE-SEMIALDEHYDE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR A.G.PAVLOVSKY,R.E.VIOLA,C.R.FAEHNLE . 717 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25492.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 79 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 49 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 163 22.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.2 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 4 0 0 0 0 1 1 2 0 5 0 1 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 5 4 2 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 . 6 0 0 2 2 0 2 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 . 2 2 0 0 2 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 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 2 A G 0 0 63 0, 0.0 2,-0.3 0, 0.0 27,-0.2 0.000 360.0 360.0 360.0-176.9 -9.1 -2.9 32.2 2 3 A Y E -a 28 0A 33 25,-3.6 27,-2.3 63,-0.0 28,-1.7 -0.697 360.0-136.8-104.8 148.0 -9.9 -1.4 28.7 3 4 A T E -a 30 0A 22 -2,-0.3 62,-2.1 26,-0.2 63,-1.9 -0.937 35.2-166.8 -91.5 119.8 -12.7 -1.6 26.3 4 5 A V E -ab 31 66A 0 26,-2.7 28,-2.3 -2,-0.6 2,-0.4 -0.937 9.4-161.1-117.8 129.8 -10.9 -2.0 23.0 5 6 A A E -ab 32 67A 0 61,-3.0 63,-2.9 -2,-0.4 2,-0.6 -0.918 5.3-156.8-110.5 136.9 -12.5 -1.6 19.5 6 7 A V E > -ab 33 68A 0 26,-2.7 28,-2.9 -2,-0.4 3,-0.7 -0.948 9.6-159.6-111.9 109.6 -11.0 -2.9 16.3 7 8 A V E 3 S+ab 34 69A 0 61,-3.1 63,-2.8 -2,-0.6 28,-0.2 -0.818 83.3 21.8 -93.0 120.8 -12.3 -0.9 13.2 8 9 A G T > S+ 0 0 6 26,-2.8 3,-1.2 -2,-0.6 6,-0.5 0.771 77.2 161.4 87.6 36.4 -11.8 -3.0 10.0 9 10 A A T < + 0 0 1 25,-1.9 9,-0.2 -3,-0.7 26,-0.1 0.672 66.4 56.1 -63.0 -20.1 -11.7 -6.2 12.1 10 11 A T T 3 S+ 0 0 62 24,-0.2 -1,-0.2 4,-0.1 25,-0.1 0.597 91.1 86.1 -91.4 -16.1 -12.4 -8.3 9.0 11 12 A G S <> S- 0 0 28 -3,-1.2 4,-2.4 59,-0.2 5,-0.2 -0.063 95.2 -89.7 -80.4-175.9 -9.6 -7.2 6.6 12 13 A A H > S+ 0 0 10 2,-0.2 4,-0.9 1,-0.2 5,-0.1 0.887 129.0 38.1 -62.9 -44.6 -6.0 -8.4 6.3 13 14 A V H > S+ 0 0 22 2,-0.2 4,-2.6 57,-0.2 3,-0.5 0.911 113.3 58.3 -70.6 -43.7 -4.6 -6.0 8.9 14 15 A G H > S+ 0 0 0 -6,-0.5 4,-2.2 56,-0.3 -2,-0.2 0.875 102.0 53.9 -52.2 -44.8 -7.7 -6.4 11.1 15 16 A A H X S+ 0 0 48 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.856 112.4 44.3 -59.5 -37.7 -7.1 -10.2 11.3 16 17 A Q H X S+ 0 0 53 -4,-0.9 4,-2.8 -3,-0.5 -2,-0.2 0.812 107.3 58.2 -78.1 -32.4 -3.6 -9.5 12.5 17 18 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.916 107.0 50.0 -58.7 -41.5 -4.8 -6.7 14.9 18 19 A I H X S+ 0 0 15 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.933 112.1 46.6 -59.8 -48.8 -6.9 -9.5 16.5 19 20 A K H X S+ 0 0 79 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.891 113.1 48.0 -61.8 -43.6 -3.9 -11.8 16.8 20 21 A M H < S+ 0 0 1 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.844 112.8 49.5 -69.2 -34.7 -1.6 -9.1 18.2 21 22 A L H >< S+ 0 0 3 -4,-2.2 3,-1.2 -5,-0.2 -2,-0.2 0.893 108.0 53.1 -66.4 -42.7 -4.3 -8.2 20.7 22 23 A E H 3< S+ 0 0 59 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.811 116.1 40.9 -58.9 -31.4 -4.8 -11.8 21.7 23 24 A E T 3< S+ 0 0 96 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.302 97.9 110.5-101.1 6.7 -1.1 -12.0 22.4 24 25 A S < - 0 0 23 -3,-1.2 -3,-0.1 1,-0.1 311,-0.0 -0.405 68.0-137.8 -84.1 157.9 -0.9 -8.6 24.0 25 26 A T + 0 0 120 -2,-0.1 -1,-0.1 2,-0.1 -4,-0.1 0.590 65.4 124.7 -83.3 -15.5 -0.2 -7.7 27.7 26 27 A L S S- 0 0 11 1,-0.1 2,-1.2 308,-0.1 -2,-0.1 -0.148 70.7-119.8 -47.4 130.4 -3.0 -5.0 27.5 27 28 A P - 0 0 55 0, 0.0 -25,-3.6 0, 0.0 2,-0.6 -0.665 38.6-174.6 -77.0 102.2 -5.7 -5.5 30.2 28 29 A I E +a 2 0A 42 -2,-1.2 -25,-0.2 -27,-0.2 3,-0.1 -0.895 21.0 170.9-105.5 115.3 -8.7 -6.0 28.0 29 30 A D E S+ 0 0 124 -27,-2.3 2,-0.3 -2,-0.6 -26,-0.2 0.755 75.2 11.5 -85.1 -32.1 -12.1 -6.2 29.8 30 31 A K E -a 3 0A 127 -28,-1.7 -26,-2.7 2,-0.0 2,-0.4 -0.991 63.6-158.7-152.2 135.8 -14.2 -6.0 26.5 31 32 A I E -a 4 0A 12 -2,-0.3 2,-0.4 -28,-0.2 -26,-0.2 -0.949 6.2-167.7-120.2 142.3 -13.5 -6.2 22.8 32 33 A R E -a 5 0A 44 -28,-2.3 -26,-2.7 -2,-0.4 2,-0.6 -0.993 9.7-150.5-129.4 135.1 -15.6 -4.9 20.0 33 34 A Y E -a 6 0A 0 19,-0.5 21,-2.8 -2,-0.4 2,-0.4 -0.929 18.1-175.7-107.0 121.1 -15.3 -5.7 16.3 34 35 A L E +ac 7 54A 0 -28,-2.9 -26,-2.8 -2,-0.6 -25,-1.9 -0.911 16.1 138.2-117.8 142.0 -16.4 -2.9 13.9 35 36 A A E - c 0 55A 6 19,-2.8 21,-2.6 -2,-0.4 2,-0.1 -0.693 51.0 -55.6-150.9-152.6 -16.5 -3.0 10.1 36 37 A S >> - 0 0 37 19,-0.2 4,-1.4 -2,-0.2 3,-0.7 -0.289 57.9 -91.7 -89.2 178.9 -18.8 -2.0 7.2 37 38 A A T 34 S+ 0 0 64 1,-0.2 18,-0.1 2,-0.2 -1,-0.1 0.791 122.2 68.2 -56.9 -29.4 -22.5 -2.8 6.6 38 39 A R T 34 S+ 0 0 208 1,-0.2 -1,-0.2 3,-0.0 17,-0.0 0.864 111.1 29.0 -61.6 -39.0 -21.2 -5.8 4.6 39 40 A S T X4 S+ 0 0 18 -3,-0.7 3,-2.1 15,-0.1 14,-0.3 0.575 89.2 120.3 -98.5 -15.1 -19.8 -7.6 7.6 40 41 A A T 3< S+ 0 0 39 -4,-1.4 14,-0.2 1,-0.2 3,-0.1 -0.295 77.0 26.4 -56.6 130.2 -22.2 -6.3 10.3 41 42 A G T 3 S+ 0 0 61 12,-2.8 -1,-0.2 1,-0.4 13,-0.1 0.018 96.5 112.7 103.9 -25.7 -24.1 -9.2 11.9 42 43 A K < - 0 0 130 -3,-2.1 11,-2.9 10,-0.1 -1,-0.4 -0.211 64.0-118.9 -73.6 170.0 -21.4 -11.8 11.2 43 44 A S E +G 52 0B 70 9,-0.2 2,-0.3 -3,-0.1 9,-0.2 -0.914 27.6 177.0-120.8 141.1 -19.3 -13.5 14.0 44 45 A L E -G 51 0B 58 7,-2.4 7,-2.9 -2,-0.4 2,-0.2 -0.991 27.8-110.3-142.6 144.7 -15.6 -13.5 14.6 45 46 A K E -G 50 0B 98 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.472 17.8-172.7 -79.6 142.0 -13.4 -15.0 17.4 46 47 A F E > S-G 49 0B 13 3,-2.2 3,-2.3 -2,-0.2 2,-0.6 -0.908 78.7 -54.7-122.6 108.1 -11.5 -13.3 20.1 47 48 A K T 3 S- 0 0 128 -2,-0.4 -2,-0.0 1,-0.3 -25,-0.0 -0.545 122.8 -23.6 56.7-107.4 -9.6 -16.2 21.7 48 49 A D T 3 S+ 0 0 139 -2,-0.6 -1,-0.3 -3,-0.1 2,-0.2 0.521 118.1 101.1-106.5 -7.8 -12.5 -18.5 22.4 49 50 A Q E < -G 46 0B 105 -3,-2.3 -3,-2.2 1,-0.0 2,-0.6 -0.498 70.0-127.9 -82.1 145.4 -15.2 -15.9 22.6 50 51 A D E -G 45 0B 108 -5,-0.2 2,-0.5 -2,-0.2 -5,-0.2 -0.841 25.4-165.0 -92.3 120.2 -17.7 -15.2 19.8 51 52 A I E -G 44 0B 24 -7,-2.9 -7,-2.4 -2,-0.6 2,-0.5 -0.928 13.8-137.1-111.5 124.5 -17.8 -11.4 18.9 52 53 A T E -G 43 0B 91 -2,-0.5 -19,-0.5 -9,-0.2 2,-0.2 -0.673 23.5-125.4 -81.1 125.4 -20.6 -10.0 16.8 53 54 A I - 0 0 7 -11,-2.9 -12,-2.8 -2,-0.5 2,-0.3 -0.518 26.6-156.5 -74.1 133.4 -19.3 -7.5 14.1 54 55 A E E -c 34 0A 64 -21,-2.8 -19,-2.8 -2,-0.2 2,-0.3 -0.828 21.7-108.0-111.9 147.6 -21.0 -4.1 14.2 55 56 A E E -c 35 0A 102 -2,-0.3 2,-0.4 -21,-0.2 -19,-0.2 -0.580 41.3-114.5 -68.8 133.4 -21.4 -1.4 11.5 56 57 A T + 0 0 7 -21,-2.6 2,-0.3 -2,-0.3 -19,-0.1 -0.596 49.6 163.4 -73.7 123.0 -19.0 1.5 12.2 57 58 A T > - 0 0 39 -2,-0.4 3,-1.3 22,-0.1 4,-0.2 -0.878 54.0-102.8-135.2 167.4 -21.1 4.6 13.0 58 59 A E T 3 S+ 0 0 71 -2,-0.3 3,-0.3 1,-0.2 -2,-0.0 0.733 123.1 44.2 -59.1 -25.2 -20.6 8.1 14.6 59 60 A T T > S+ 0 0 110 1,-0.2 3,-0.6 2,-0.1 -1,-0.2 0.305 87.5 90.9-105.2 6.9 -22.3 6.8 17.7 60 61 A A T < S+ 0 0 10 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.1 0.466 71.9 70.8 -84.3 -1.5 -20.6 3.4 18.0 61 62 A F T > + 0 0 1 -3,-0.3 3,-1.8 -4,-0.2 -1,-0.2 0.324 58.6 129.5-106.4 9.1 -17.7 4.5 20.3 62 63 A E T < S+ 0 0 121 -3,-0.6 3,-0.1 1,-0.3 25,-0.1 -0.450 81.4 12.9 -67.5 130.3 -19.4 5.2 23.6 63 64 A G T 3 S+ 0 0 59 23,-0.3 2,-0.4 1,-0.3 -1,-0.3 0.417 94.6 133.8 84.4 0.7 -17.5 3.5 26.4 64 65 A V < - 0 0 6 -3,-1.8 -1,-0.3 1,-0.2 -60,-0.2 -0.722 32.7-178.1 -89.8 128.3 -14.5 2.7 24.3 65 66 A D S S+ 0 0 60 -62,-2.1 24,-1.8 -2,-0.4 2,-0.4 0.872 74.0 19.6 -84.9 -45.9 -11.0 3.4 25.7 66 67 A I E -bd 4 89A 0 -63,-1.9 -61,-3.0 22,-0.2 2,-0.4 -0.995 62.4-172.9-133.0 129.4 -8.9 2.4 22.7 67 68 A A E -bd 5 90A 0 22,-2.0 24,-2.6 -2,-0.4 2,-0.6 -0.992 9.0-158.3-123.8 126.6 -9.8 2.1 19.1 68 69 A L E -bd 6 91A 0 -63,-2.9 -61,-3.1 -2,-0.4 2,-0.5 -0.924 15.7-155.2-101.4 121.0 -7.5 0.7 16.5 69 70 A F E +bd 7 92A 1 22,-2.5 24,-2.8 -2,-0.6 25,-0.2 -0.857 34.1 145.9-102.6 126.5 -8.5 1.8 12.9 70 71 A S + 0 0 21 -63,-2.8 -56,-0.3 -2,-0.5 -59,-0.2 -0.333 39.5 105.9-149.5 64.2 -7.6 -0.1 9.8 71 72 A A S > S- 0 0 35 1,-0.4 4,-0.5 -58,-0.1 -63,-0.1 -0.012 89.6 -77.1-133.1 27.0 -10.5 0.3 7.4 72 73 A G H > - 0 0 41 2,-0.1 4,-1.7 1,-0.1 3,-0.4 0.143 51.3 -79.5 88.1 152.9 -9.1 2.8 4.9 73 74 A S H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.826 126.1 59.9 -53.1 -38.4 -8.5 6.5 5.0 74 75 A S H > S+ 0 0 74 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.914 104.8 47.0 -59.1 -48.4 -12.2 7.2 4.3 75 76 A T H X S+ 0 0 29 -4,-0.5 4,-2.5 -3,-0.4 5,-0.4 0.898 113.8 47.8 -62.0 -43.1 -13.4 5.3 7.4 76 77 A S H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.912 110.7 52.1 -66.0 -41.8 -10.9 7.0 9.7 77 78 A A H < S+ 0 0 11 -4,-2.6 280,-0.4 1,-0.2 -1,-0.2 0.880 116.7 39.5 -59.3 -41.2 -11.7 10.5 8.3 78 79 A K H < S+ 0 0 77 -4,-1.9 279,-0.4 -5,-0.2 280,-0.2 0.874 131.6 19.5 -77.7 -39.1 -15.4 9.9 8.9 79 80 A Y H X S+ 0 0 37 -4,-2.5 4,-1.9 -5,-0.2 3,-0.2 0.731 102.2 74.8-114.3 -27.9 -15.3 8.2 12.3 80 81 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.4 5,-0.2 0.896 97.8 52.9 -57.3 -42.4 -12.0 8.7 14.2 81 82 A P H > S+ 0 0 2 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.882 108.8 50.4 -61.0 -35.9 -13.0 12.3 15.1 82 83 A Y H > S+ 0 0 31 -4,-0.2 4,-1.7 -3,-0.2 -2,-0.2 0.845 108.7 52.1 -67.9 -35.2 -16.3 11.0 16.6 83 84 A A H X>S+ 0 0 0 -4,-1.9 5,-2.6 2,-0.2 4,-0.9 0.921 109.0 49.5 -63.0 -46.1 -14.3 8.4 18.6 84 85 A V H ><5S+ 0 0 3 -4,-2.4 3,-1.0 1,-0.2 265,-0.5 0.925 109.6 51.8 -58.3 -45.9 -12.1 11.2 20.0 85 86 A K H 3<5S+ 0 0 133 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.847 106.5 54.3 -58.6 -36.9 -15.2 13.2 20.9 86 87 A A H 3<5S- 0 0 32 -4,-1.7 -23,-0.3 -5,-0.1 -1,-0.3 0.681 128.6-100.3 -70.0 -19.5 -16.5 10.1 22.7 87 88 A G T <<5S+ 0 0 12 -3,-1.0 -3,-0.2 -4,-0.9 -2,-0.1 0.557 74.7 141.7 110.7 14.3 -13.2 10.0 24.7 88 89 A V < - 0 0 0 -5,-2.6 2,-0.5 -6,-0.1 261,-0.3 -0.380 49.7-133.9 -78.8 156.6 -11.4 7.3 22.8 89 90 A V E -d 66 0A 0 -24,-1.8 -22,-2.0 259,-0.1 2,-0.5 -0.990 29.1-151.8-105.7 120.2 -7.7 7.2 22.0 90 91 A V E -de 67 121A 0 30,-3.7 32,-3.3 -2,-0.5 2,-0.6 -0.791 16.5-164.2 -97.9 128.5 -7.4 6.2 18.4 91 92 A V E -de 68 122A 0 -24,-2.6 -22,-2.5 -2,-0.5 2,-0.6 -0.967 23.5-159.3-104.5 113.0 -4.4 4.4 16.9 92 93 A D E -de 69 123A 0 30,-3.3 32,-3.2 -2,-0.6 -22,-0.1 -0.849 23.1-170.7-107.3 119.2 -4.9 4.9 13.2 93 94 A N + 0 0 8 -24,-2.8 -23,-0.1 -2,-0.6 -1,-0.1 0.552 62.4 92.4 -80.3 -6.1 -3.3 2.7 10.5 94 95 A T S S- 0 0 7 -25,-0.2 3,-0.3 -22,-0.1 4,-0.2 -0.295 80.1-123.4 -88.0 170.4 -4.2 5.0 7.6 95 96 A S S > S+ 0 0 41 1,-0.2 3,-0.6 2,-0.1 4,-0.4 0.505 86.8 96.8 -83.5 -5.9 -2.4 7.9 5.9 96 97 A Y T 3 S+ 0 0 106 1,-0.2 3,-0.2 2,-0.1 -1,-0.2 0.869 95.0 22.1 -58.7 -47.1 -5.2 10.3 6.6 97 98 A F T > S+ 0 0 10 -3,-0.3 3,-1.7 1,-0.1 -1,-0.2 0.385 92.9 104.9 -99.9 0.5 -3.9 12.0 9.8 98 99 A R T < S+ 0 0 1 -3,-0.6 -1,-0.1 1,-0.3 -2,-0.1 0.800 84.9 39.5 -58.9 -36.9 -0.2 11.2 9.4 99 100 A Q T 3 S+ 0 0 87 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.272 85.6 116.3-101.0 11.4 1.0 14.7 8.4 100 101 A N X - 0 0 48 -3,-1.7 3,-2.2 1,-0.1 -3,-0.0 -0.698 64.3-141.3 -76.9 123.9 -1.3 16.6 10.8 101 102 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.650 101.6 58.8 -65.2 -15.3 0.9 18.5 13.3 102 103 A D T 3 S+ 0 0 63 251,-0.1 17,-0.6 -5,-0.1 19,-0.3 0.398 97.4 77.5 -87.3 -0.2 -1.6 17.7 16.1 103 104 A V S < S- 0 0 2 -3,-2.2 2,-0.2 -6,-0.2 19,-0.2 -0.948 76.6-136.8-119.2 116.4 -1.0 13.9 15.4 104 105 A P - 0 0 14 0, 0.0 19,-2.7 0, 0.0 2,-0.7 -0.520 10.6-151.3 -66.7 136.3 2.1 12.0 16.5 105 106 A L B -f 123 0A 2 -2,-0.2 2,-0.4 17,-0.2 19,-0.2 -0.909 31.1-164.2-111.1 102.3 3.4 9.6 13.8 106 107 A V + 0 0 0 17,-1.7 230,-0.1 -2,-0.7 6,-0.1 -0.792 45.1 168.7-118.9 128.2 5.0 6.9 15.9 107 108 A V >> - 0 0 0 -2,-0.4 4,-2.5 17,-0.1 3,-2.1 -0.992 37.9-143.6-111.8 111.9 7.3 3.9 15.7 108 109 A P H 3> S+ 0 0 15 0, 0.0 4,-0.9 0, 0.0 5,-0.1 0.767 95.6 53.7 -55.4 -32.2 7.7 3.3 19.4 109 110 A E H 34 S+ 0 0 36 2,-0.1 -3,-0.0 1,-0.1 168,-0.0 0.712 120.3 33.9 -68.7 -21.4 11.4 2.3 19.2 110 111 A V H <4 S+ 0 0 15 -3,-2.1 3,-0.1 1,-0.0 -1,-0.1 0.867 135.8 6.0-103.1 -50.3 12.2 5.6 17.5 111 112 A N H >< + 0 0 4 -4,-2.5 3,-1.9 1,-0.1 4,-0.4 -0.163 64.4 141.2-141.0 43.7 9.9 8.3 18.8 112 113 A A G >< S+ 0 0 13 -4,-0.9 3,-1.9 1,-0.3 4,-0.4 0.814 71.0 73.5 -51.2 -32.7 7.8 7.1 21.7 113 114 A H G > S+ 0 0 99 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.792 84.6 65.4 -52.1 -33.1 8.4 10.6 23.2 114 115 A A G X S+ 0 0 25 -3,-1.9 3,-0.7 1,-0.2 -1,-0.3 0.728 87.3 70.5 -64.5 -24.0 6.0 12.0 20.6 115 116 A L G X S+ 0 0 0 -3,-1.9 3,-2.1 -4,-0.4 -1,-0.2 0.812 80.7 73.9 -63.3 -33.5 3.1 10.1 22.2 116 117 A D G < S+ 0 0 82 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.1 0.806 99.3 43.5 -54.0 -36.6 3.0 12.3 25.4 117 118 A A G < S+ 0 0 78 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.1 0.133 83.6 143.4 -98.9 19.6 1.4 15.3 23.6 118 119 A H < - 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