==== 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 ALDOLASE 22-OCT-04 1WA3 . COMPND 2 MOLECULE: 2-KETO-3-DEOXY-6-PHOSPHOGLUCONATE ALDOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR S.W.B.FULLERTON,J.S.GRIFFITHS,A.B.MERKEL,N.J.WYMER,M.J.HUTCH . 1211 6 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48818.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 965 79.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 186 15.4 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 . 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 . 97 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 137 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 469 38.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 36 3.0 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 10 2 2 12 6 11 7 0 0 9 1 0 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 12 6 12 12 6 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 . 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 6 0 0 0 6 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 K > 0 0 204 0, 0.0 4,-1.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -55.4 9.3 -14.6 -22.3 2 3 A M H > + 0 0 12 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.855 360.0 59.1 -66.4 -42.1 10.3 -11.6 -20.1 3 4 A E H > S+ 0 0 65 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.915 107.4 47.6 -50.0 -51.6 11.8 -13.5 -17.2 4 5 A E H > S+ 0 0 110 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.840 110.4 53.7 -59.3 -36.7 14.4 -15.1 -19.5 5 6 A L H X S+ 0 0 39 -4,-1.2 4,-2.7 2,-0.2 5,-0.4 0.904 109.7 45.2 -68.2 -41.1 15.2 -11.8 -21.0 6 7 A F H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.925 113.8 51.9 -68.7 -38.3 15.9 -10.1 -17.7 7 8 A K H < S+ 0 0 118 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.894 114.3 43.2 -61.7 -38.1 17.9 -13.2 -16.8 8 9 A K H < S+ 0 0 154 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.928 123.7 31.6 -74.5 -49.6 19.9 -12.9 -20.0 9 10 A H H < S- 0 0 44 -4,-2.7 -3,-0.2 -5,-0.1 -2,-0.2 0.774 80.8-160.9 -87.6 -32.3 20.6 -9.2 -20.2 10 11 A K < + 0 0 78 -4,-2.4 164,-1.6 -5,-0.4 2,-0.3 0.441 61.2 72.7 69.5 2.8 20.8 -8.4 -16.4 11 12 A I E -a 174 0A 4 162,-0.3 26,-0.5 -5,-0.1 2,-0.4 -0.990 54.0-167.2-149.3 138.7 20.2 -4.7 -16.8 12 13 A V E -ab 175 37A 0 162,-2.6 164,-2.5 -2,-0.3 2,-0.5 -0.999 23.3-133.2-121.8 131.9 17.2 -2.4 -17.6 13 14 A A E -ab 176 38A 0 24,-2.6 26,-2.8 -2,-0.4 2,-0.9 -0.729 14.1-147.6 -81.4 125.4 17.7 1.3 -18.4 14 15 A V E - b 0 39A 4 162,-2.9 2,-0.8 -2,-0.5 167,-0.2 -0.826 20.0-152.2 -97.6 102.6 15.2 3.4 -16.5 15 16 A L E + b 0 40A 0 24,-3.1 26,-2.3 -2,-0.9 2,-0.4 -0.729 24.3 167.1 -95.0 109.0 14.6 6.2 -18.9 16 17 A R + 0 0 49 -2,-0.8 2,-0.3 24,-0.1 26,-0.1 -0.906 13.5 150.2-111.7 141.2 13.6 9.6 -17.5 17 18 A A - 0 0 8 -2,-0.4 3,-0.1 24,-0.1 165,-0.0 -0.969 48.8-123.0-163.9 166.7 13.7 12.7 -19.7 18 19 A N S S+ 0 0 137 -2,-0.3 2,-0.3 26,-0.2 3,-0.1 0.439 88.8 27.4-103.5 -3.7 12.0 16.0 -20.2 19 20 A S S > S- 0 0 44 1,-0.1 4,-2.4 25,-0.0 5,-0.2 -0.987 74.9-114.8-152.0 161.9 10.9 15.6 -23.8 20 21 A V H > S+ 0 0 31 -2,-0.3 4,-2.1 2,-0.2 5,-0.2 0.869 117.9 51.9 -58.1 -41.4 9.9 13.0 -26.3 21 22 A E H > S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 110.7 46.3 -68.5 -45.4 13.0 14.0 -28.4 22 23 A E H > S+ 0 0 46 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.900 111.4 52.1 -61.8 -41.9 15.4 13.6 -25.5 23 24 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.923 110.2 48.5 -64.4 -41.9 13.9 10.3 -24.4 24 25 A K H X S+ 0 0 65 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.917 110.9 50.4 -65.3 -41.4 14.3 8.9 -28.0 25 26 A E H X S+ 0 0 83 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.905 113.0 46.0 -62.3 -42.7 17.9 10.0 -28.2 26 27 A K H X S+ 0 0 18 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.853 110.4 52.6 -70.7 -36.2 18.7 8.4 -24.9 27 28 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.934 111.2 48.2 -63.5 -42.8 16.9 5.2 -25.7 28 29 A L H X S+ 0 0 49 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.933 112.4 48.6 -64.2 -43.6 18.9 5.0 -28.9 29 30 A A H X S+ 0 0 1 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.910 110.3 49.5 -59.8 -49.1 22.2 5.7 -27.1 30 31 A V H <>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 4,-0.3 0.927 112.7 49.2 -60.1 -39.4 21.7 3.1 -24.4 31 32 A F H ><5S+ 0 0 26 -4,-2.2 3,-1.8 -5,-0.2 -2,-0.2 0.928 108.0 51.9 -67.8 -45.4 20.9 0.5 -27.0 32 33 A E H 3<5S+ 0 0 87 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.812 106.8 56.5 -60.4 -30.0 24.0 1.4 -29.1 33 34 A G T 3<5S- 0 0 4 -4,-1.8 -1,-0.3 -5,-0.2 163,-0.2 0.470 130.7 -91.9 -80.5 -2.2 26.0 0.9 -25.9 34 35 A G T < 5S+ 0 0 32 -3,-1.8 2,-0.7 -4,-0.3 -3,-0.2 0.443 84.8 128.3 109.0 0.4 24.7 -2.7 -25.5 35 36 A V < + 0 0 1 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.791 24.3 171.8 -90.8 108.7 21.6 -2.2 -23.2 36 37 A H + 0 0 57 -2,-0.7 27,-3.5 -25,-0.2 2,-0.7 0.728 57.5 77.4 -89.8 -25.8 18.6 -4.0 -24.9 37 38 A L E +bc 12 63A 0 -26,-0.5 -24,-2.6 25,-0.2 2,-0.5 -0.817 62.2 176.7 -92.9 116.2 16.1 -3.6 -22.0 38 39 A I E -bc 13 64A 0 25,-2.7 27,-2.8 -2,-0.7 2,-0.6 -0.971 17.4-163.1-133.4 116.1 14.7 -0.1 -22.0 39 40 A E E -bc 14 65A 1 -26,-2.8 -24,-3.1 -2,-0.5 2,-0.8 -0.882 9.2-154.0-100.9 114.5 11.9 1.2 -19.7 40 41 A I E -bc 15 66A 0 25,-3.0 27,-2.2 -2,-0.6 2,-0.1 -0.810 22.5-140.9 -87.9 110.1 10.3 4.5 -20.9 41 42 A T E > - c 0 67A 0 -26,-2.3 3,-1.9 -2,-0.8 27,-0.2 -0.477 12.3-126.3 -78.2 150.0 9.0 6.0 -17.7 42 43 A F T 3 S+ 0 0 31 25,-2.0 5,-0.1 1,-0.3 4,-0.1 0.393 104.1 78.0 -76.3 8.6 5.7 7.9 -17.5 43 44 A T T 3 S+ 0 0 42 2,-0.1 -1,-0.3 3,-0.1 -27,-0.1 0.607 76.1 93.6 -84.4 -11.4 7.5 10.9 -16.1 44 45 A V S X S- 0 0 3 -3,-1.9 3,-1.3 -29,-0.2 -26,-0.2 -0.684 94.4-109.2 -71.7 128.1 8.5 11.4 -19.7 45 46 A P T 3 S+ 0 0 60 0, 0.0 5,-0.2 0, 0.0 -2,-0.1 -0.343 102.3 2.2 -53.2 133.6 6.0 13.8 -21.4 46 47 A D T >> S+ 0 0 105 -4,-0.1 4,-1.8 1,-0.1 3,-0.8 0.898 80.9 170.6 50.3 45.0 3.9 11.8 -23.9 47 48 A A H <> S+ 0 0 1 -3,-1.3 4,-2.4 1,-0.3 5,-0.1 0.833 72.9 58.0 -54.4 -36.8 5.8 8.6 -22.9 48 49 A D H 3> S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.875 103.7 52.0 -64.7 -35.5 3.3 6.5 -24.9 49 50 A T H <> S+ 0 0 46 -3,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.916 107.7 53.3 -64.5 -40.4 4.2 8.5 -28.0 50 51 A V H X S+ 0 0 0 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.951 108.3 48.9 -57.9 -52.2 7.9 7.7 -27.2 51 52 A I H >< S+ 0 0 0 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.925 112.6 48.0 -54.3 -49.0 7.2 4.0 -27.0 52 53 A K H >< S+ 0 0 131 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.932 111.8 49.6 -57.8 -44.6 5.3 4.0 -30.3 53 54 A E H 3< S+ 0 0 84 -4,-2.8 3,-0.4 1,-0.3 -1,-0.2 0.559 101.8 64.2 -76.3 -6.3 8.0 6.0 -32.1 54 55 A L T XX + 0 0 0 -3,-0.9 3,-1.5 -4,-0.9 4,-1.3 0.293 65.1 109.3 -98.1 9.7 10.7 3.5 -30.8 55 56 A S H <> S+ 0 0 64 -3,-1.4 4,-1.5 1,-0.3 -1,-0.2 0.854 71.5 63.2 -52.1 -33.8 9.2 0.7 -32.8 56 57 A F H 3> S+ 0 0 86 -3,-0.4 4,-0.6 1,-0.2 -1,-0.3 0.825 99.4 53.3 -60.9 -33.8 12.4 0.9 -35.0 57 58 A L H X4>S+ 0 0 0 -3,-1.5 5,-2.2 1,-0.2 3,-0.7 0.855 102.5 57.2 -69.4 -39.0 14.6 0.0 -32.0 58 59 A K H ><5S+ 0 0 68 -4,-1.3 3,-2.0 1,-0.2 -2,-0.2 0.895 99.8 59.7 -54.7 -42.9 12.5 -3.1 -31.4 59 60 A E H 3<5S+ 0 0 168 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.805 105.1 50.3 -58.4 -26.7 13.3 -4.2 -35.0 60 61 A K T <<5S- 0 0 122 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.482 134.2 -83.9 -91.4 -4.4 16.9 -4.2 -34.1 61 62 A G T < 5S+ 0 0 37 -3,-2.0 -3,-0.2 -4,-0.3 -2,-0.1 0.352 80.5 139.8 121.1 -11.7 16.6 -6.3 -30.9 62 63 A A < - 0 0 4 -5,-2.2 2,-0.6 -6,-0.1 -1,-0.3 -0.343 43.1-145.4 -68.4 150.6 15.5 -3.7 -28.2 63 64 A I E -c 37 0A 13 -27,-3.5 -25,-2.7 -2,-0.0 2,-0.6 -0.963 20.7-164.2-119.4 107.9 12.9 -4.7 -25.7 64 65 A I E +c 38 0A 0 -2,-0.6 20,-3.0 18,-0.2 21,-0.2 -0.861 17.2 158.4-106.9 123.2 10.9 -1.5 -24.9 65 66 A G E -c 39 0A 0 -27,-2.8 -25,-3.0 -2,-0.6 2,-0.4 -0.611 35.2-103.9-128.5-169.2 8.6 -1.3 -21.9 66 67 A A E -cd 40 86A 0 19,-2.2 21,-2.1 -27,-0.3 -25,-0.2 -0.914 28.8-172.0-128.0 140.6 7.0 1.3 -19.6 67 68 A G E +c 41 0A 0 -27,-2.2 -25,-2.0 -2,-0.4 21,-0.2 -0.763 61.5 40.1-125.2 176.6 8.0 2.4 -16.2 68 69 A T S S+ 0 0 6 -27,-0.2 2,-0.7 -2,-0.2 20,-0.2 0.829 70.3 167.8 49.8 36.9 6.6 4.7 -13.4 69 70 A V + 0 0 0 18,-1.8 21,-0.3 -3,-0.2 -1,-0.2 -0.712 9.7 162.2 -82.0 115.8 3.1 3.3 -14.2 70 71 A T + 0 0 41 -2,-0.7 2,-0.3 -3,-0.1 -1,-0.2 0.345 58.2 40.1-118.1 6.6 0.8 4.4 -11.4 71 72 A S S > S- 0 0 42 1,-0.1 4,-2.1 23,-0.0 -1,-0.1 -0.989 74.4-123.1-148.4 152.7 -2.6 4.0 -13.0 72 73 A V H > S+ 0 0 40 -2,-0.3 4,-2.9 2,-0.2 5,-0.2 0.868 112.6 62.6 -63.1 -34.7 -4.4 1.4 -15.2 73 74 A E H > S+ 0 0 92 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.941 107.1 42.4 -56.8 -45.2 -5.1 4.3 -17.6 74 75 A Q H > S+ 0 0 46 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.922 112.7 54.6 -63.3 -42.5 -1.3 4.8 -18.1 75 76 A C H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.911 108.3 49.3 -56.1 -42.3 -0.9 1.0 -18.3 76 77 A R H X S+ 0 0 89 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.935 111.2 47.9 -66.8 -43.9 -3.4 0.8 -21.1 77 78 A K H X S+ 0 0 91 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.932 112.8 50.8 -61.0 -43.8 -1.8 3.6 -23.1 78 79 A A H X>S+ 0 0 0 -4,-3.0 5,-2.5 2,-0.2 4,-0.5 0.935 113.9 42.5 -55.8 -53.7 1.6 1.9 -22.6 79 80 A V H ><5S+ 0 0 30 -4,-2.8 3,-1.1 1,-0.2 -2,-0.2 0.902 113.2 51.2 -64.6 -43.4 0.4 -1.5 -23.8 80 81 A E H 3<5S+ 0 0 142 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.843 109.0 53.5 -62.9 -30.9 -1.6 -0.1 -26.7 81 82 A S H 3<5S- 0 0 15 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.552 131.3 -89.2 -83.7 -10.1 1.5 1.8 -27.8 82 83 A G T <<5 + 0 0 19 -3,-1.1 -3,-0.2 -4,-0.5 -18,-0.2 0.525 62.5 165.7 119.3 9.7 3.7 -1.3 -27.8 83 84 A A < - 0 0 8 -5,-2.5 -18,-0.3 -6,-0.2 -1,-0.2 -0.367 21.6-161.4 -58.9 133.9 5.2 -1.7 -24.3 84 85 A E S S+ 0 0 60 -20,-3.0 21,-0.5 1,-0.2 2,-0.3 0.502 74.0 10.3 -95.5 -11.0 6.7 -5.2 -23.9 85 86 A F E - e 0 105A 0 -21,-0.2 -19,-2.2 19,-0.1 2,-0.4 -0.961 69.3-136.9-159.0 161.0 6.7 -5.1 -20.1 86 87 A I E -de 66 106A 0 19,-2.5 21,-3.0 -2,-0.3 2,-0.4 -0.988 17.3-175.9-129.8 132.9 5.3 -2.8 -17.4 87 88 A V E - e 0 107A 0 -21,-2.1 -18,-1.8 -2,-0.4 -2,-0.0 -0.978 0.9-173.6-127.2 143.4 7.2 -1.6 -14.2 88 89 A S - 0 0 0 19,-1.6 40,-0.1 -2,-0.4 -18,-0.1 -0.899 31.7-129.1-132.3 160.1 5.8 0.4 -11.3 89 90 A P S S+ 0 0 1 0, 0.0 2,-0.2 0, 0.0 228,-0.2 0.686 94.6 31.2 -78.9 -13.5 7.6 1.9 -8.3 90 91 A H S S- 0 0 3 -21,-0.3 19,-2.0 226,-0.2 2,-0.6 -0.636 95.7 -88.1-131.0 177.6 5.0 0.4 -6.0 91 92 A L + 0 0 20 17,-0.2 2,-0.4 -2,-0.2 19,-0.0 -0.899 42.7 179.9 -96.1 127.1 2.7 -2.7 -5.8 92 93 A D > - 0 0 5 -2,-0.6 4,-2.4 1,-0.1 5,-0.1 -0.954 19.1-166.5-131.5 109.3 -0.6 -2.1 -7.6 93 94 A E H > S+ 0 0 92 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.861 91.9 55.5 -63.0 -37.1 -3.2 -4.9 -7.6 94 95 A E H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.906 109.7 43.9 -61.9 -44.0 -5.2 -3.1 -10.3 95 96 A I H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.928 111.9 55.2 -67.3 -43.1 -2.2 -2.8 -12.7 96 97 A S H X S+ 0 0 1 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.935 109.5 46.2 -50.9 -47.5 -1.4 -6.5 -11.9 97 98 A Q H X S+ 0 0 111 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.898 112.1 51.1 -66.3 -40.1 -4.9 -7.5 -12.9 98 99 A F H X S+ 0 0 11 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.940 109.7 49.5 -58.6 -52.5 -4.8 -5.4 -16.1 99 100 A C H X>S+ 0 0 2 -4,-2.9 5,-2.4 1,-0.2 4,-0.9 0.878 109.6 51.6 -59.0 -36.1 -1.5 -6.9 -17.1 100 101 A K H ><5S+ 0 0 132 -4,-2.0 3,-0.9 -5,-0.2 -1,-0.2 0.946 107.3 52.7 -65.4 -45.9 -2.8 -10.5 -16.6 101 102 A E H 3<5S+ 0 0 146 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.875 116.4 40.0 -53.0 -39.7 -5.8 -9.8 -18.7 102 103 A K H 3<5S- 0 0 98 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.514 108.7-123.2 -84.1 -10.5 -3.5 -8.6 -21.5 103 104 A G T <<5 + 0 0 70 -4,-0.9 2,-0.4 -3,-0.9 -3,-0.2 0.853 62.7 144.6 66.8 33.0 -0.8 -11.3 -20.9 104 105 A V < - 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0 0 28 -5,-2.5 -1,-0.2 -6,-0.1 2,-0.2 -0.909 59.4-106.7-114.2 138.2 10.7 89.8 78.7 713 106 D F E -c 693 0G 57 -21,-0.6 -19,-2.3 -2,-0.4 2,-0.4 -0.494 36.8-166.2 -67.2 127.6 12.9 88.7 75.8 714 107 D Y E -c 694 0G 8 -2,-0.2 -19,-0.2 -21,-0.2 20,-0.2 -0.978 10.1-168.8-116.1 129.3 13.9 85.0 76.2 715 108 D M E -c 695 0G 1 -21,-3.1 -19,-1.4 -2,-0.4 20,-0.1 -0.895 13.7-159.8-115.0 96.7 16.7 83.4 74.1 716 109 D P - 0 0 0 0, 0.0 20,-2.6 0, 0.0 2,-0.3 -0.404 18.5-116.8 -73.2 157.2 16.8 79.6 74.5 717 110 D G E +e 736 0H 0 -19,-1.8 2,-0.3 18,-0.2 20,-0.2 -0.742 35.7 177.7 -94.9 141.5 19.9 77.5 73.8 718 111 D V E +e 737 0H 0 18,-2.1 20,-2.2 -2,-0.3 -20,-0.0 -0.939 23.6 171.7-142.0 150.0 19.6 74.9 71.0 719 112 D M + 0 0 1 -2,-0.3 18,-0.1 1,-0.2 -1,-0.1 0.338 68.9 52.3-132.5 -7.1 22.1 72.5 69.4 720 113 D T S > S- 0 0 0 1,-0.1 4,-2.7 406,-0.0 -1,-0.2 -0.961 79.1-120.1-140.1 142.4 19.9 70.4 67.1 721 114 D P H > S+ 0 0 1 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.888 115.9 54.4 -56.3 -34.4 17.3 71.1 64.4 722 115 D T H > S+ 0 0 3 381,-0.2 4,-2.2 2,-0.2 5,-0.2 0.917 110.1 45.9 -63.5 -42.5 14.6 69.3 66.5 723 116 D E H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.933 112.0 53.4 -60.5 -45.0 15.4 71.6 69.4 724 117 D L H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.914 109.4 46.5 -57.1 -49.7 15.3 74.6 67.0 725 118 D V H X S+ 0 0 5 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.928 109.9 53.3 -65.0 -43.7 11.8 73.7 65.6 726 119 D K H X S+ 0 0 89 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.943 110.8 48.0 -52.1 -48.0 10.4 73.2 69.1 727 120 D A H <>S+ 0 0 0 -4,-2.5 5,-2.0 1,-0.2 3,-0.3 0.896 110.1 52.7 -59.0 -39.7 11.7 76.6 70.1 728 121 D M H ><5S+ 0 0 47 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.890 102.8 56.6 -65.4 -42.5 10.2 78.1 66.9 729 122 D K H 3<5S+ 0 0 116 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.803 104.2 54.5 -56.8 -31.3 6.8 76.7 67.6 730 123 D L T 3<5S- 0 0 40 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.383 130.9 -99.6 -85.0 5.1 7.0 78.6 70.9 731 124 D G T < 5S+ 0 0 51 -3,-2.1 2,-0.4 1,-0.3 -3,-0.2 0.610 75.5 139.4 96.1 13.1 7.6 81.7 68.9 732 125 D H < + 0 0 22 -5,-2.0 -1,-0.3 1,-0.1 3,-0.1 -0.732 15.3 160.4 -90.2 136.1 11.4 82.1 69.0 733 126 D T + 0 0 54 -2,-0.4 26,-2.4 1,-0.2 2,-0.6 0.462 66.4 69.8-123.1 -13.7 13.4 83.1 66.0 734 127 D I E S+ f 0 759H 7 24,-0.2 2,-0.4 -20,-0.2 26,-0.2 -0.927 71.1 178.9-104.8 113.7 16.5 84.4 67.8 735 128 D L E - 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0 0 4 -5,-2.2 -18,-0.3 -6,-0.2 -1,-0.2 -0.291 24.7-162.7 -53.4 125.4 3.5 64.8 47.6 1098 85 F E S S+ 0 0 67 -20,-3.7 21,-0.6 1,-0.1 2,-0.3 0.456 72.1 15.9 -92.9 -6.7 4.6 61.1 47.6 1099 86 F F E S- s 01119K 2 -21,-0.3 -19,-1.8 19,-0.1 2,-0.4 -0.941 71.7-136.4-159.1 156.0 6.9 61.3 50.7 1100 87 F I E -rs10801120K 0 19,-2.6 21,-2.4 -2,-0.3 2,-0.4 -0.959 17.8-174.3-123.0 136.7 7.4 63.8 53.4 1101 88 F V E - s 01121K 0 -21,-1.9 -18,-1.9 -2,-0.4 -2,-0.0 -0.978 2.7-179.7-129.7 146.4 10.7 65.1 54.8 1102 89 F S - 0 0 0 19,-1.5 21,-0.2 -2,-0.4 40,-0.2 -0.974 34.8-129.1-139.1 154.1 11.4 67.3 57.7 1103 90 F P S S+ 0 0 1 0, 0.0 -381,-0.2 0, 0.0 2,-0.2 0.695 95.1 37.5 -72.1 -15.9 14.7 68.7 59.2 1104 91 F H S S- 0 0 1 -383,-0.2 19,-1.7 -382,-0.1 2,-0.7 -0.583 95.2 -92.5-124.0 179.5 13.5 67.5 62.6 1105 92 F L - 0 0 2 17,-0.2 2,-0.7 -2,-0.2 3,-0.1 -0.901 39.4-172.8 -98.5 114.4 11.6 64.7 64.3 1106 93 F D > - 0 0 5 -2,-0.7 4,-2.3 1,-0.1 5,-0.1 -0.931 11.7-166.8-110.7 109.0 8.0 65.7 64.4 1107 94 F E H > S+ 0 0 88 -2,-0.7 4,-1.7 1,-0.2 -1,-0.1 0.821 90.2 51.6 -63.4 -32.2 6.0 63.2 66.5 1108 95 F E H > S+ 0 0 130 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.930 110.3 46.2 -70.7 -47.6 2.7 64.7 65.2 1109 96 F I H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.897 110.9 55.7 -59.1 -40.9 3.7 64.5 61.5 1110 97 F S H X S+ 0 0 4 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.908 108.1 45.9 -60.6 -47.2 4.9 61.0 62.1 1111 98 F Q H X S+ 0 0 99 -4,-1.7 4,-2.7 1,-0.2 3,-0.2 0.978 112.7 50.8 -58.3 -57.0 1.5 59.8 63.4 1112 99 F F H X S+ 0 0 22 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.816 109.9 49.9 -45.5 -43.6 -0.4 61.5 60.6 1113 100 F C H X>S+ 0 0 2 -4,-2.2 5,-1.9 2,-0.2 4,-0.7 0.890 110.4 49.5 -70.2 -39.1 1.8 59.9 58.0 1114 101 F K H ><5S+ 0 0 138 -4,-2.0 3,-0.6 -3,-0.2 -2,-0.2 0.953 114.3 46.2 -58.7 -50.2 1.3 56.4 59.5 1115 102 F E H 3<5S+ 0 0 158 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.908 118.1 40.9 -61.6 -45.0 -2.5 57.0 59.6 1116 103 F K H 3<5S- 0 0 105 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.478 111.2-122.1 -86.1 0.8 -2.6 58.3 56.0 1117 104 F G T <<5 + 0 0 70 -4,-0.7 2,-0.3 -3,-0.6 -3,-0.2 0.721 62.4 139.9 70.8 24.0 -0.1 55.7 54.8 1118 105 F V < - 0 0 29 -5,-1.9 2,-0.3 -6,-0.2 -1,-0.2 -0.789 58.3-105.4-101.1 144.6 2.5 58.1 53.5 1119 106 F F E -s 1099 0K 56 -21,-0.6 -19,-2.6 -2,-0.3 2,-0.4 -0.520 37.3-170.5 -67.7 124.0 6.4 57.7 53.8 1120 107 F Y E -s 1100 0K 5 -2,-0.3 -19,-0.2 -21,-0.2 20,-0.2 -0.976 10.3-170.7-118.3 131.3 7.8 60.1 56.4 1121 108 F M E -s 1101 0K 2 -21,-2.4 -19,-1.5 -2,-0.4 2,-0.2 -0.925 13.1-162.2-122.1 101.2 11.5 60.6 56.8 1122 109 F P - 0 0 0 0, 0.0 20,-2.6 0, 0.0 2,-0.3 -0.536 18.0-119.5 -82.5 157.2 12.3 62.6 59.9 1123 110 F G E -u 1142 0L 0 -19,-1.7 2,-0.3 -21,-0.2 20,-0.2 -0.751 32.8-179.5 -93.1 142.5 15.6 64.4 60.5 1124 111 F V E +u 1143 0L 1 18,-2.4 20,-1.9 -2,-0.3 -20,-0.0 -0.915 22.5 175.5-135.4 158.0 17.7 63.4 63.5 1125 112 F M + 0 0 1 -2,-0.3 -1,-0.1 1,-0.2 18,-0.1 0.364 67.3 53.6-137.5 -4.2 21.1 64.6 64.9 1126 113 F T S > S- 0 0 0 1,-0.1 4,-2.9 -202,-0.0 -1,-0.2 -0.935 78.0-119.4-142.5 146.0 21.3 62.7 68.1 1127 114 F P H > S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 -225,-0.2 0.880 117.5 51.9 -56.2 -35.6 21.1 59.1 69.5 1128 115 F T H > S+ 0 0 15 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.939 111.7 45.0 -68.0 -43.6 18.1 60.2 71.7 1129 116 F E H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.903 113.0 53.4 -62.4 -41.9 16.3 61.7 68.6 1130 117 F L H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.901 109.2 46.8 -57.5 -48.1 17.3 58.5 66.8 1131 118 F V H X S+ 0 0 5 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.920 111.1 51.4 -64.7 -41.1 15.8 56.2 69.4 1132 119 F K H X S+ 0 0 66 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.882 110.6 49.8 -61.5 -41.4 12.5 58.2 69.6 1133 120 F A H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 3,-0.3 0.899 110.3 49.5 -63.9 -43.7 12.2 58.0 65.8 1134 121 F M H ><5S+ 0 0 55 -4,-2.2 3,-1.3 3,-0.2 -2,-0.2 0.859 107.9 53.5 -63.3 -39.3 12.7 54.2 65.8 1135 122 F K H 3<5S+ 0 0 110 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.727 104.7 56.1 -66.7 -21.2 10.1 53.8 68.6 1136 123 F L T 3<5S- 0 0 46 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.412 132.5 -97.5 -86.2 -0.7 7.8 55.8 66.2 1137 124 F G T < 5S+ 0 0 56 -3,-1.3 2,-0.4 1,-0.3 -3,-0.2 0.577 76.9 140.0 101.2 12.5 8.6 53.1 63.7 1138 125 F H < + 0 0 23 -5,-2.5 -1,-0.3 1,-0.1 -2,-0.1 -0.747 19.0 162.0 -97.6 136.1 11.3 54.7 61.6 1139 126 F T + 0 0 65 -2,-0.4 26,-2.8 1,-0.2 2,-0.6 0.474 69.7 65.1-118.9 -12.8 14.3 52.8 60.2 1140 127 F I E S- v 01165L 7 -20,-0.2 2,-0.4 24,-0.2 26,-0.2 -0.958 70.2-179.0-118.6 114.8 15.3 55.4 57.6 1141 128 F L E - 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