==== 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 HYDROLASE 10-APR-07 2PGO . COMPND 2 MOLECULE: CYCLOHEXANE-1,2-DIONE HYDROLASE (CDH); . SOURCE 2 ORGANISM_SCIENTIFIC: AZOARCUS SP.; . AUTHOR A.K.STEINBACH,E.WARKENTIN,P.M.H.KRONECK,U.ERMLER . 1174 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39808.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 815 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 160 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.0 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 91 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 145 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 340 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.6 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 2 0 4 6 2 4 2 12 2 2 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 4 10 8 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 A 0 0 70 0, 0.0 171,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 142.9 59.0 45.4 70.3 2 3 A I E +A 171 0A 85 169,-0.2 2,-0.3 170,-0.1 169,-0.3 -0.567 360.0 175.3 -69.8 130.2 61.4 42.7 69.2 3 4 A K E -A 170 0A 55 167,-2.6 167,-2.1 -2,-0.3 2,-0.2 -0.969 31.3-113.1-136.0 148.1 60.4 41.3 65.8 4 5 A R E >> -A 169 0A 42 -2,-0.3 4,-2.0 165,-0.2 3,-0.7 -0.518 30.4-118.7 -71.7 147.8 61.8 38.8 63.2 5 6 A G H 3> S+ 0 0 1 163,-2.7 4,-2.3 160,-0.4 161,-0.2 0.865 114.1 58.5 -51.5 -42.7 63.0 40.2 59.9 6 7 A A H 3> S+ 0 0 0 160,-2.5 4,-1.8 162,-0.2 -1,-0.3 0.882 106.2 48.1 -58.6 -40.9 60.4 38.1 58.1 7 8 A D H <> S+ 0 0 36 -3,-0.7 4,-2.6 159,-0.3 -1,-0.2 0.884 109.3 52.9 -67.1 -37.8 57.6 39.7 60.1 8 9 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.874 106.8 53.4 -63.6 -38.7 59.0 43.2 59.3 9 10 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.938 110.4 46.8 -59.7 -48.7 59.0 42.4 55.6 10 11 A V H X S+ 0 0 7 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.915 110.9 51.7 -62.4 -43.5 55.4 41.4 55.7 11 12 A E H X S+ 0 0 35 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.899 110.6 48.5 -59.8 -41.7 54.5 44.5 57.7 12 13 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.941 110.2 51.1 -63.8 -45.2 56.2 46.7 55.1 13 14 A L H <>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 -2,-0.2 0.911 112.3 47.0 -60.4 -40.1 54.5 45.0 52.2 14 15 A E H ><5S+ 0 0 86 -4,-2.4 3,-1.5 1,-0.2 -1,-0.2 0.909 108.1 55.8 -65.9 -41.5 51.1 45.5 53.9 15 16 A E H 3<5S+ 0 0 66 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.867 107.0 50.6 -58.2 -36.7 51.9 49.2 54.6 16 17 A Y T 3<5S- 0 0 26 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.266 125.6 -95.5 -95.4 15.1 52.6 49.9 50.9 17 18 A G T < 5 + 0 0 31 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.589 56.0 172.5 95.0 14.5 49.3 48.3 49.7 18 19 A T < + 0 0 13 -5,-2.3 -1,-0.2 1,-0.1 52,-0.2 -0.343 6.0 170.1 -60.7 133.8 50.1 44.7 48.8 19 20 A E + 0 0 75 50,-3.0 2,-0.3 1,-0.3 51,-0.2 0.576 62.4 30.3-110.3 -29.0 47.0 42.8 47.9 20 21 A Q E -c 70 0B 7 49,-1.9 51,-2.1 2,-0.0 2,-0.4 -0.991 61.1-156.8-143.8 130.4 48.3 39.5 46.4 21 22 A V E -c 71 0B 0 -2,-0.3 25,-2.3 20,-0.3 2,-0.5 -0.924 1.6-166.4-107.4 135.7 51.5 37.5 47.0 22 23 A V E +cd 72 46B 2 49,-2.6 51,-2.0 -2,-0.4 2,-0.3 -0.996 29.4 170.6-115.8 115.8 52.9 35.1 44.4 23 24 A G E -c 73 0B 0 23,-2.4 2,-0.4 -2,-0.5 51,-0.2 -0.950 30.4-153.6-136.4 151.3 55.5 33.0 46.3 24 25 A F E -c 74 0B 6 49,-2.0 51,-1.2 -2,-0.3 2,-0.1 -0.992 25.2-128.5-129.3 128.3 57.7 30.0 45.9 25 26 A I + 0 0 8 1059,-0.5 2,-0.3 -2,-0.4 1046,-0.1 -0.372 42.5 128.6 -78.8 151.5 59.0 27.9 48.9 26 27 A G S >> S- 0 0 3 -2,-0.1 3,-1.7 1045,-0.1 4,-0.8 -0.867 71.8 -81.1 178.0 167.8 62.4 26.8 49.8 27 28 A H G >4 S+ 0 0 18 1,-0.3 3,-0.5 -2,-0.3 4,-0.4 0.806 127.9 54.8 -54.6 -31.9 64.5 27.0 53.0 28 29 A T G 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.753 113.7 40.7 -73.6 -22.9 65.5 30.7 52.2 29 30 A S G <> S+ 0 0 0 -3,-1.7 4,-2.8 1,-0.1 -1,-0.2 0.381 87.9 99.2-100.3 4.8 61.8 31.7 52.0 30 31 A H H S+ 0 0 14 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.912 113.9 49.5 -67.1 -39.0 60.6 32.4 57.5 32 33 A V H > S+ 0 0 1 -4,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.923 111.7 48.9 -62.6 -43.7 58.8 34.8 55.0 33 34 A A H X S+ 0 0 0 -4,-2.8 4,-1.5 2,-0.2 -2,-0.2 0.914 111.6 49.8 -61.5 -44.2 56.2 32.1 54.2 34 35 A D H < S+ 0 0 8 -4,-2.4 4,-0.5 -5,-0.2 3,-0.2 0.920 111.5 49.0 -58.3 -46.1 55.6 31.5 58.0 35 36 A A H >< S+ 0 0 3 -4,-2.6 3,-1.4 1,-0.2 4,-0.3 0.921 108.2 53.3 -62.9 -42.0 55.3 35.3 58.5 36 37 A F H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.3 6,-0.8 0.835 98.0 65.8 -61.3 -29.4 52.8 35.6 55.7 37 38 A S T 3< S+ 0 0 49 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.678 99.6 52.3 -67.2 -19.9 50.7 32.8 57.3 38 39 A K T < S+ 0 0 147 -3,-1.4 2,-0.3 -4,-0.5 -1,-0.3 0.411 102.9 74.3 -90.2 -5.8 50.0 35.2 60.2 39 40 A S S X S- 0 0 16 -3,-1.6 3,-1.6 -4,-0.3 4,-0.5 -0.728 91.9-114.5-106.1 157.3 48.8 37.9 57.9 40 41 A H G > S+ 0 0 188 -2,-0.3 3,-0.6 1,-0.3 4,-0.3 0.780 114.2 69.0 -63.8 -18.3 45.6 38.3 56.0 41 42 A L G > S+ 0 0 22 1,-0.2 3,-0.6 2,-0.1 -20,-0.3 0.743 85.8 71.4 -69.2 -22.5 47.8 38.0 52.8 42 43 A G G X S+ 0 0 18 -3,-1.6 3,-2.1 -6,-0.8 -1,-0.2 0.929 80.0 70.6 -56.0 -42.6 48.5 34.3 53.6 43 44 A K G < S+ 0 0 201 -3,-0.6 -1,-0.2 -4,-0.5 -2,-0.1 0.734 111.3 26.8 -60.7 -25.7 45.1 32.9 52.9 44 45 A R G < S+ 0 0 92 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.2 0.022 76.9 149.8-129.8 35.2 45.4 33.3 49.2 45 46 A V < - 0 0 11 -3,-2.1 2,-0.6 -4,-0.2 -23,-0.2 -0.339 42.6-132.4 -61.8 137.7 49.1 33.2 48.3 46 47 A I B -d 22 0B 0 -25,-2.3 -23,-2.4 8,-0.0 -1,-0.1 -0.887 15.7-165.2 -95.5 123.5 49.6 31.8 44.8 47 48 A N - 0 0 31 -2,-0.6 -23,-0.1 -25,-0.2 -25,-0.1 -0.906 20.7-154.4-105.8 100.3 52.3 29.1 44.6 48 49 A P - 0 0 0 0, 0.0 3,-0.1 0, 0.0 411,-0.1 -0.267 25.5-115.3 -78.8 161.9 53.0 28.8 40.9 49 50 A A S S+ 0 0 0 1,-0.2 2,-0.3 407,-0.1 994,-0.1 0.868 102.0 9.4 -59.7 -36.5 54.4 25.7 39.0 50 51 A T S > S- 0 0 8 1,-0.1 4,-2.4 406,-0.1 -1,-0.2 -0.979 74.9-118.9-140.2 158.6 57.5 27.8 38.2 51 52 A E H > S+ 0 0 6 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.854 114.6 52.7 -66.0 -35.3 58.9 31.2 39.3 52 53 A L H > S+ 0 0 10 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.936 108.7 50.7 -67.4 -43.7 58.8 32.6 35.7 53 54 A G H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.938 112.0 47.7 -54.6 -46.5 55.1 31.6 35.4 54 55 A G H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.897 107.8 54.5 -62.2 -38.2 54.5 33.3 38.7 55 56 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.866 106.9 51.9 -65.4 -33.6 56.4 36.4 37.6 56 57 A W H X S+ 0 0 1 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.874 106.7 53.9 -66.7 -37.7 54.1 36.6 34.5 57 58 A M H X S+ 0 0 2 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.913 106.4 52.0 -60.2 -44.9 51.1 36.4 36.9 58 59 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.928 109.9 50.2 -55.1 -44.7 52.5 39.4 38.8 59 60 A N H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.903 111.2 46.7 -61.7 -45.0 52.7 41.2 35.5 60 61 A G H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.912 114.4 47.5 -64.5 -41.3 49.2 40.5 34.4 61 62 A Y H X S+ 0 0 14 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.952 117.2 41.8 -61.9 -48.9 47.7 41.4 37.8 62 63 A N H X>S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.2 5,-0.6 0.802 106.7 61.7 -77.0 -28.0 49.7 44.7 38.0 63 64 A Y H <5S+ 0 0 18 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.934 111.2 40.1 -61.1 -45.2 49.1 45.7 34.3 64 65 A V H <5S+ 0 0 13 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.774 119.4 46.5 -77.0 -23.4 45.4 45.8 35.0 65 66 A K H <5S- 0 0 66 -4,-1.3 -2,-0.2 2,-0.2 -1,-0.2 0.684 92.0-141.7 -89.1 -22.4 45.7 47.4 38.4 66 67 A D T <5S+ 0 0 39 -4,-2.2 2,-0.3 1,-0.2 -3,-0.1 0.792 75.9 69.6 59.9 32.2 48.3 50.2 37.5 67 68 A R S > - e 0 101B 20 -51,-1.2 3,-2.0 -2,-0.4 4,-0.6 -0.470 55.1 -90.4 -59.4 131.9 63.6 31.3 47.4 76 77 A C G >4 S+ 0 0 0 25,-2.0 3,-2.1 1,-0.3 4,-0.3 0.561 118.7 34.7 -9.9 -87.2 67.2 32.1 46.3 77 78 A V G >4 S+ 0 0 5 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.705 106.6 69.4 -66.0 -19.2 67.8 30.2 43.1 78 79 A G G X4 S+ 0 0 2 -3,-2.0 3,-1.7 1,-0.2 -1,-0.3 0.770 85.6 69.9 -63.0 -24.4 64.2 30.6 41.9 79 80 A N G X< S+ 0 0 0 -3,-2.1 3,-1.8 -4,-0.6 4,-0.3 0.769 83.1 73.4 -59.2 -25.8 65.0 34.3 41.4 80 81 A L G < S+ 0 0 3 -3,-1.3 592,-0.5 -4,-0.3 3,-0.3 0.637 91.5 56.7 -66.2 -13.5 67.3 33.2 38.5 81 82 A L G < S+ 0 0 18 -3,-1.7 4,-0.3 1,-0.2 3,-0.3 0.392 87.3 80.7 -93.1 1.2 64.1 32.5 36.5 82 83 A L <> + 0 0 0 -3,-1.8 4,-2.4 1,-0.2 3,-0.3 0.677 61.4 92.0 -80.6 -22.1 62.7 36.0 36.8 83 84 A H H > S+ 0 0 0 -3,-0.3 4,-2.3 -4,-0.3 -1,-0.2 0.791 82.6 50.4 -56.1 -40.9 64.6 37.9 34.1 84 85 A A H > S+ 0 0 0 584,-0.5 4,-1.8 -3,-0.3 -1,-0.2 0.958 116.2 40.7 -63.1 -52.1 62.2 37.6 31.1 85 86 A A H > S+ 0 0 1 -4,-0.3 4,-2.0 -3,-0.3 -1,-0.2 0.878 113.9 54.9 -60.9 -37.6 59.1 38.7 33.0 86 87 A M H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.900 104.9 53.3 -65.0 -38.2 61.1 41.5 34.7 87 88 A Q H X S+ 0 0 10 -4,-2.3 4,-2.0 -5,-0.2 5,-0.4 0.921 107.8 50.4 -62.3 -46.5 62.3 42.9 31.4 88 89 A E H X S+ 0 0 2 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.906 108.2 53.5 -56.3 -42.7 58.7 43.1 30.1 89 90 A A H <>S+ 0 0 0 -4,-2.0 5,-2.4 2,-0.2 4,-0.3 0.871 109.2 50.5 -61.6 -35.7 57.7 45.0 33.3 90 91 A R H ><5S+ 0 0 71 -4,-1.6 3,-1.2 65,-0.2 -2,-0.2 0.994 121.2 28.2 -65.7 -64.0 60.6 47.5 32.7 91 92 A T H 3<5S+ 0 0 12 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.822 121.2 56.0 -72.1 -26.5 59.9 48.5 29.1 92 93 A G T 3<5S- 0 0 17 -4,-2.3 -1,-0.3 -5,-0.4 -2,-0.2 0.401 107.9-123.5 -86.5 4.7 56.2 47.8 29.4 93 94 A R T < 5 + 0 0 55 -3,-1.2 62,-0.3 -4,-0.3 -3,-0.2 0.902 54.1 154.9 58.1 46.7 55.8 50.2 32.4 94 95 A I < - 0 0 3 -5,-2.4 2,-0.2 60,-0.2 -1,-0.2 -0.912 42.2-132.0-107.2 116.0 54.3 47.6 34.8 95 96 A P + 0 0 2 0, 0.0 2,-0.2 0, 0.0 -28,-0.2 -0.492 40.9 159.9 -63.3 134.1 54.8 48.3 38.5 96 97 A A E - f 0 156B 0 59,-1.8 61,-2.1 -2,-0.2 2,-0.4 -0.721 28.1-159.0-165.9 112.8 56.1 45.2 40.2 97 98 A V E -ef 71 157B 0 -27,-0.5 -25,-2.1 -2,-0.2 2,-0.4 -0.746 12.2-171.4 -94.8 128.7 58.0 44.5 43.4 98 99 A H E -ef 72 158B 1 59,-2.6 61,-2.5 -2,-0.4 2,-0.6 -0.990 8.3-158.9-122.5 126.8 60.0 41.3 43.8 99 100 A I E -ef 73 159B 1 -27,-2.9 -25,-2.4 -2,-0.4 2,-0.5 -0.937 9.4-166.6-106.9 112.4 61.6 40.1 47.0 100 101 A G E -ef 74 160B 0 59,-2.8 61,-2.9 -2,-0.6 2,-0.8 -0.894 10.1-150.6-102.3 125.5 64.4 37.6 46.6 101 102 A L E -ef 75 161B 0 -27,-2.7 -25,-2.0 -2,-0.5 -22,-0.1 -0.867 21.1-163.3 -95.8 105.2 65.6 35.7 49.7 102 103 A N E - f 0 162B 1 59,-1.6 61,-2.5 -2,-0.8 3,-0.1 -0.287 26.5 -84.0 -80.2 175.2 69.2 34.9 49.1 103 104 A S S S- 0 0 8 12,-0.7 61,-0.2 59,-0.2 -1,-0.2 -0.099 73.6 -50.7 -70.5 174.6 71.4 32.3 51.0 104 105 A D >> - 0 0 28 58,-0.2 3,-1.4 1,-0.2 4,-0.7 -0.235 44.0-139.7 -56.0 130.4 73.1 33.1 54.3 105 106 A G T 34 S+ 0 0 26 1,-0.3 3,-0.3 2,-0.2 -1,-0.2 0.737 100.8 67.3 -62.5 -24.5 75.1 36.3 54.2 106 107 A R T 34 S+ 0 0 179 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.844 105.2 42.2 -59.2 -35.0 77.8 34.6 56.2 107 108 A L T X4 S+ 0 0 24 -3,-1.4 3,-1.8 2,-0.1 -1,-0.2 0.583 86.7 118.7 -90.7 -12.1 78.5 32.3 53.2 108 109 A A T 3< S+ 0 0 38 -4,-0.7 3,-0.1 -3,-0.3 -3,-0.0 -0.297 74.6 23.5 -61.3 137.7 78.3 35.0 50.5 109 110 A G T 3 S+ 0 0 83 1,-0.3 2,-0.4 2,-0.1 -1,-0.3 0.268 83.6 130.2 90.2 -10.2 81.5 35.5 48.5 110 111 A R X - 0 0 64 -3,-1.8 3,-1.8 1,-0.1 -1,-0.3 -0.607 59.3-135.5 -75.4 134.1 82.9 32.0 49.2 111 112 A S T 3 S+ 0 0 56 -2,-0.4 -1,-0.1 1,-0.3 783,-0.1 0.825 99.9 42.7 -66.6 -30.1 84.0 30.6 45.9 112 113 A E T 3 S+ 0 0 9 757,-0.1 759,-2.2 756,-0.1 760,-0.3 0.135 85.9 133.3-102.6 23.3 82.5 27.1 46.4 113 114 A A < - 0 0 8 -3,-1.8 2,-0.4 757,-0.2 3,-0.3 -0.365 49.9-132.9 -71.4 149.3 79.3 28.3 48.0 114 115 A A S S+ 0 0 4 1,-0.2 896,-0.2 -2,-0.1 3,-0.1 -0.832 78.5 5.4-101.1 141.1 75.9 26.9 46.8 115 116 A Q S S+ 0 0 3 894,-0.4 2,-1.0 -2,-0.4 -12,-0.7 0.763 73.8 150.1 64.6 28.0 72.9 29.0 45.9 116 117 A Q - 0 0 31 -3,-0.3 -1,-0.2 -14,-0.1 -14,-0.1 -0.813 42.2-143.0 -90.2 100.9 74.6 32.4 46.3 117 118 A V - 0 0 5 -2,-1.0 2,-1.9 -3,-0.1 3,-0.1 -0.504 8.4-127.4 -77.3 132.8 72.4 34.3 43.8 118 119 A P > + 0 0 21 0, 0.0 3,-2.2 0, 0.0 4,-0.2 -0.539 31.0 177.4 -77.5 81.8 74.1 36.9 41.6 119 120 A W G > S+ 0 0 68 -2,-1.9 3,-2.0 1,-0.3 4,-0.3 0.744 71.7 74.4 -58.1 -24.6 71.7 39.7 42.3 120 121 A Q G > S+ 0 0 114 1,-0.3 3,-1.0 2,-0.2 -1,-0.3 0.685 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S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.874 114.4 52.6 -70.6 -35.1 50.1 33.1 33.1 431 432 A M H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.895 108.6 52.3 -60.3 -38.6 49.3 36.8 32.4 432 433 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.3 -1,-0.2 0.915 108.2 50.4 -61.7 -42.5 45.7 35.7 31.9 433 434 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.906 110.5 50.3 -61.7 -41.3 45.7 34.0 35.3 434 435 A G H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.921 110.5 48.1 -63.3 -43.3 47.1 37.1 36.9 435 436 A A H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.902 110.4 52.7 -61.6 -40.5 44.5 39.3 35.3 436 437 A Q H < S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.892 108.1 51.1 -63.0 -38.9 41.8 36.8 36.5 437 438 A L H < S+ 0 0 6 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.886 110.0 50.2 -62.3 -39.1 43.2 37.0 40.1 438 439 A A H < S+ 0 0 9 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.821 124.1 28.3 -68.9 -36.2 43.0 40.8 39.9 439 440 A E >< + 0 0 47 -4,-1.8 3,-1.8 -5,-0.1 -1,-0.3 -0.714 69.5 178.8-129.6 80.2 39.4 40.8 38.7 440 441 A P T 3 S+ 0 0 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A F H <> S+ 0 0 0 -3,-2.4 4,-2.7 1,-0.2 5,-0.3 0.793 75.4 68.5 -53.8 -27.9 46.9 24.7 34.9 461 462 A R H <> S+ 0 0 1 -3,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.920 103.6 40.5 -55.8 -47.4 47.7 23.5 38.4 462 463 A V H <> S+ 0 0 2 -3,-0.8 4,-2.6 2,-0.2 -2,-0.2 0.919 113.9 52.8 -65.4 -46.9 47.1 27.1 39.7 463 464 A A H <>S+ 0 0 0 -4,-2.1 5,-2.5 1,-0.2 4,-0.3 0.900 114.7 41.3 -59.7 -42.1 44.0 27.6 37.5 464 465 A V H ><5S+ 0 0 41 -4,-2.7 3,-0.8 3,-0.2 -1,-0.2 0.932 116.6 46.8 -74.7 -45.7 42.3 24.4 38.7 465 466 A E H 3<5S+ 0 0 103 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.907 121.1 37.3 -62.4 -43.0 43.2 24.8 42.4 466 467 A H T 3<5S- 0 0 27 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.356 106.8-125.5 -90.7 3.8 42.1 28.4 42.6 467 468 A K T < 5 + 0 0 157 -3,-0.8 -3,-0.2 -4,-0.3 -4,-0.1 0.928 42.7 171.9 51.5 56.1 39.2 27.9 40.2 468 469 A L < - 0 0 10 -5,-2.5 2,-1.8 -6,-0.2 -1,-0.2 -0.825 22.5-153.2 -98.3 103.4 40.3 30.7 37.8 469 470 A P + 0 0 43 0, 0.0 -25,-0.3 0, 0.0 2,-0.1 -0.145 28.4 163.3 -86.0 52.9 37.8 30.2 34.9 470 471 A 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54.2 25.2 14.1 480 481 A Y > - 0 0 16 17,-2.8 4,-2.6 -2,-0.3 3,-0.4 -0.813 53.8-169.6 -81.6 84.7 55.7 28.5 15.0 481 482 A G H > S+ 0 0 7 -2,-1.4 4,-2.5 1,-0.3 5,-0.3 0.846 74.0 54.4 -63.6 -39.9 53.5 29.8 12.1 482 483 A A H > S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.918 114.8 42.6 -55.2 -46.0 54.8 33.3 11.8 483 484 A N H > S+ 0 0 29 -3,-0.4 4,-2.6 2,-0.2 5,-0.3 0.888 111.1 54.6 -70.6 -39.1 58.3 31.9 11.4 484 485 A W H X S+ 0 0 60 -4,-2.6 4,-1.5 13,-0.2 -2,-0.2 0.949 115.3 40.2 -54.6 -50.2 57.2 29.1 9.0 485 486 A T H X S+ 0 0 19 -4,-2.5 4,-1.6 61,-0.4 -2,-0.2 0.928 117.4 45.6 -71.0 -45.7 55.6 31.6 6.7 486 487 A L H X S+ 0 0 34 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.892 110.4 52.7 -73.2 -35.9 58.2 34.3 6.8 487 488 A M H X>S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 6,-0.8 0.891 105.2 56.0 -63.6 -38.9 61.2 32.0 6.4 488 489 A N H X5S+ 0 0 51 -4,-1.5 4,-1.5 -5,-0.3 -1,-0.2 0.939 112.3 44.1 -57.0 -39.8 59.6 30.5 3.3 489 490 A H H <5S+ 0 0 147 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.925 118.2 42.7 -68.3 -46.1 59.4 34.1 2.0 490 491 A Q H <5S+ 0 0 39 -4,-2.7 -2,-0.2 1,-0.1 -1,-0.2 0.869 136.8 6.9 -70.6 -39.6 63.0 35.0 3.0 491 492 A F H <5S- 0 0 44 -4,-2.9 -3,-0.2 2,-0.3 -2,-0.2 0.471 92.8-113.2-124.0 -14.2 64.9 31.8 2.0 492 493 A G S < - 0 0 92 595,-2.0 4,-2.1 1,-0.2 5,-0.1 -0.722 51.9-165.8 -71.1 96.2 46.4 15.9 22.6 504 505 A W H > S+ 0 0 4 -2,-1.3 4,-2.5 1,-0.2 -1,-0.2 0.861 84.2 53.7 -64.7 -35.8 45.5 19.3 24.2 505 506 A V H > S+ 0 0 19 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.937 109.0 50.7 -60.8 -42.2 42.0 18.2 25.2 506 507 A G H > S+ 0 0 17 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.867 107.8 52.5 -61.3 -38.7 43.7 15.2 26.9 507 508 A I H X S+ 0 0 0 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.957 110.4 47.7 -60.6 -49.7 46.1 17.6 28.7 508 509 A A H >X>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 4,-0.8 0.933 112.7 48.3 -56.8 -48.8 43.2 19.7 30.0 509 510 A K H ><5S+ 0 0 141 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.879 105.3 58.7 -61.2 -38.0 41.3 16.6 31.2 510 511 A A H 3<5S+ 0 0 12 -4,-2.2 581,-2.2 1,-0.3 -1,-0.2 0.788 111.0 43.3 -62.8 -26.1 44.4 15.3 33.0 511 512 A F H <<5S- 0 0 2 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.530 118.9-109.8 -90.3 -12.0 44.4 18.5 35.0 512 513 A G T <<5S+ 0 0 34 -3,-0.8 -3,-0.2 -4,-0.8 2,-0.2 0.624 75.2 133.3 85.9 14.1 40.7 18.5 35.7 513 514 A A < - 0 0 4 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.3 -0.537 67.5 -94.4 -86.8 162.1 40.1 21.6 33.4 514 515 A Y E -q 538 0D 50 23,-2.5 25,-2.4 -2,-0.2 2,-0.4 -0.627 48.9-174.1 -72.7 134.6 37.3 21.7 30.8 515 516 A G E +q 539 0D 9 -2,-0.3 2,-0.3 23,-0.2 25,-0.2 -0.999 13.5 158.3-135.3 139.4 38.6 20.6 27.3 516 517 A E E -q 540 0D 27 23,-2.1 25,-2.5 -2,-0.4 2,-0.4 -0.972 23.0-149.2-154.2 143.7 37.0 20.5 23.8 517 518 A S E -q 541 0D 39 -2,-0.3 3,-0.2 23,-0.2 25,-0.2 -0.917 4.3-164.4-109.7 137.7 38.2 20.4 20.2 518 519 A V >> + 0 0 0 23,-2.6 4,-3.0 -2,-0.4 3,-0.8 0.237 59.2 112.8 -97.6 12.9 36.3 22.0 17.3 519 520 A R T 34 S+ 0 0 95 22,-0.3 -1,-0.1 1,-0.3 23,-0.1 0.860 86.7 31.6 -53.0 -39.4 38.3 20.1 14.7 520 521 A E T 34 S+ 0 0 171 -3,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.555 132.3 30.3 -93.9 -13.0 35.3 17.9 13.6 521 522 A T T <4 S- 0 0 93 -3,-0.8 -2,-0.2 -4,-0.1 -3,-0.1 0.636 75.5-143.1-119.8 -32.3 32.5 20.5 14.2 522 523 A G < + 0 0 17 -4,-3.0 2,-2.1 1,-0.2 3,-0.3 0.603 50.8 147.4 65.1 10.3 33.6 24.0 13.8 523 524 A D > + 0 0 63 1,-0.2 4,-2.2 -6,-0.1 -1,-0.2 -0.375 3.3 148.2 -87.4 67.4 31.3 24.7 16.8 524 525 A I H > S+ 0 0 1 -2,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.908 72.6 56.1 -63.0 -41.1 33.2 27.6 18.5 525 526 A A H > S+ 0 0 30 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.937 111.3 42.4 -57.0 -50.2 29.9 29.1 19.7 526 527 A G H > S+ 0 0 11 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.886 111.8 54.8 -66.3 -39.1 28.9 25.9 21.5 527 528 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.914 107.5 50.2 -61.1 -40.8 32.4 25.3 22.9 528 529 A L H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.932 111.3 48.8 -64.6 -41.4 32.4 28.8 24.4 529 530 A Q H X S+ 0 0 115 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.928 114.3 44.5 -63.2 -45.4 29.0 28.1 26.0 530 531 A R H X S+ 0 0 97 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.898 113.1 51.8 -66.6 -38.5 30.0 24.7 27.4 531 532 A A H X>S+ 0 0 1 -4,-2.7 4,-0.6 -5,-0.2 5,-0.5 0.937 112.7 44.7 -64.1 -46.7 33.4 26.2 28.6 532 533 A I H ><5S+ 0 0 40 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.936 111.3 53.6 -61.6 -45.7 31.6 29.0 30.4 533 534 A D H 3<5S+ 0 0 144 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.818 97.6 67.4 -56.6 -33.0 29.0 26.6 31.9 534 535 A S H 3<5S- 0 0 35 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.762 89.8-146.0 -61.5 -32.4 31.7 24.4 33.3 535 536 A G T <<5 + 0 0 49 -3,-1.3 -1,-0.1 -4,-0.6 -3,-0.1 0.549 65.1 103.7 73.7 5.6 32.8 27.0 35.8 536 537 A K S > S+ 0 0 0 1,-0.2 4,-2.7 -147,-0.1 3,-1.8 -0.877 117.8 9.7 114.5-142.6 47.6 36.5 10.7 550 551 A L T 34 S+ 0 0 49 -151,-1.7 -1,-0.2 -2,-0.4 -151,-0.1 0.856 126.5 49.4 -45.1 -48.7 50.8 38.6 11.1 551 552 A A T 34 S+ 0 0 22 -3,-0.2 -1,-0.3 1,-0.2 -3,-0.1 0.699 127.2 19.3 -69.3 -20.1 52.7 36.9 8.2 552 553 A S T <4 S+ 0 0 61 -3,-1.8 -2,-0.2 -5,-0.4 -1,-0.2 0.580 98.9 88.2-126.6 -19.5 50.0 37.1 5.6 553 554 A D < - 0 0 24 -4,-2.7 2,-0.3 -6,-0.1 -1,-0.1 -0.798 63.6-142.6-102.1 116.1 47.3 39.8 6.5 554 555 A P + 0 0 94 0, 0.0 -292,-0.1 0, 0.0 -3,-0.0 -0.578 28.3 164.8 -80.3 128.2 47.9 43.3 5.3 555 556 A V - 0 0 5 -2,-0.3 -290,-0.3 -297,-0.2 -298,-0.1 0.118 68.0 -87.9-126.5 21.2 46.8 46.1 7.8 556 557 A G S S+ 0 0 35 1,-0.2 -298,-0.1 -291,-0.1 -299,-0.1 0.595 74.3 158.4 80.5 14.8 48.6 49.0 6.3 557 558 A G - 0 0 40 -299,-0.2 -1,-0.2 1,-0.1 -299,-0.1 -0.297 31.5-169.9 -68.1 154.3 51.9 48.5 8.2 558 559 A V - 0 0 84 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.0 0.442 51.8-102.7-115.0 -12.6 55.2 49.9 7.1 559 560 A G - 0 0 15 2,-0.1 -270,-0.2 -275,-0.0 2,-0.2 -0.825 25.9-123.4-163.3-163.4 57.5 48.0 9.6 560 561 A P - 0 0 18 0, 0.0 2,-1.5 0, 0.0 3,-0.3 0.678 53.4-131.3 -69.0 170.3 59.3 47.0 11.7 561 562 A N + 0 0 85 1,-0.2 3,-0.3 -2,-0.2 -2,-0.1 -0.607 54.1 141.8 -90.1 72.7 62.1 45.8 9.4 562 563 A L + 0 0 38 -2,-1.5 2,-0.9 1,-0.2 -1,-0.2 0.716 65.1 59.1 -89.2 -24.2 62.5 42.3 10.9 563 564 A L S S- 0 0 44 -3,-0.3 -1,-0.2 55,-0.0 53,-0.0 -0.504 89.4-178.0 -98.6 56.3 63.3 40.5 7.5 564 565 A L - 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2.9 47.9 963 376 B S > - 0 0 18 -6,-0.4 4,-2.0 -2,-0.2 3,-0.2 -0.695 14.0-140.2 -75.6 133.0 60.0 3.4 49.4 964 377 B M H > S+ 0 0 2 -2,-0.4 4,-2.0 1,-0.2 -1,-0.1 0.794 105.0 58.6 -66.2 -29.8 62.2 5.3 47.0 965 378 B F H > S+ 0 0 0 -11,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.872 105.1 49.7 -64.3 -38.3 65.1 3.0 48.0 966 379 B R H > S+ 0 0 77 -12,-0.5 4,-2.0 -3,-0.2 -2,-0.2 0.915 107.2 54.8 -65.4 -41.1 62.9 0.0 46.8 967 380 B A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.927 109.9 46.9 -55.0 -46.5 62.3 1.8 43.5 968 381 B M H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.863 106.7 56.9 -67.3 -31.7 66.1 2.1 43.1 969 382 B A H X S+ 0 0 21 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.880 108.1 48.9 -63.0 -36.6 66.6 -1.6 44.0 970 383 B E H X S+ 0 0 28 -4,-2.0 4,-0.6 2,-0.2 3,-0.4 0.904 109.2 51.6 -67.5 -43.4 64.2 -2.4 41.1 971 384 B V H >< S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.2 4,-0.3 0.925 103.7 59.4 -55.6 -45.0 66.1 -0.1 38.8 972 385 B R H >< S+ 0 0 65 -4,-2.5 3,-1.0 1,-0.3 -1,-0.2 0.829 95.9 61.5 -58.2 -31.1 69.3 -1.9 39.8 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44.4 993 406 B F H < S+ 0 0 22 -4,-2.5 -1,-0.2 1,-0.2 3,-0.2 0.870 118.3 48.3 -67.3 -38.0 72.1 9.1 45.6 994 407 B G H < S+ 0 0 2 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.784 115.7 42.6 -77.0 -24.8 71.9 6.3 48.2 995 408 B G H < S+ 0 0 0 -4,-2.0 2,-0.7 -5,-0.2 -1,-0.2 0.464 89.8 97.6 -99.6 -4.8 70.4 3.7 45.7 996 409 B A < - 0 0 2 -4,-0.8 2,-0.5 -3,-0.2 -27,-0.0 -0.791 51.3-178.1 -82.5 115.7 72.7 4.6 42.8 997 410 B I - 0 0 40 -2,-0.7 2,-0.3 -167,-0.0 -161,-0.1 -0.974 16.1-167.3-120.2 110.8 75.6 2.0 42.9 998 411 B L + 0 0 5 -2,-0.5 -163,-2.5 -165,-0.1 -167,-0.3 -0.779 32.8 179.9-118.7 148.9 77.9 3.0 40.0 999 412 B Q S S+ 0 0 68 -22,-0.3 -1,-0.1 -2,-0.3 -168,-0.1 0.403 72.7 44.2-121.3 -8.1 80.8 1.4 38.2 1000 413 B R S S- 0 0 133 -23,-0.2 3,-0.5 -167,-0.1 -168,-0.2 -0.940 86.4 -94.9-138.6 159.3 81.8 4.0 35.6 1001 414 B P S S+ 0 0 40 0, 0.0 -170,-0.1 0, 0.0 -172,-0.1 -0.268 95.9 22.2 -75.4 161.1 82.3 7.9 35.7 1002 415 B R S S+ 0 0 24 -174,-0.4 -171,-0.1 -172,-0.4 -173,-0.1 0.807 80.9 122.2 57.8 36.8 79.8 10.6 34.9 1003 416 B R + 0 0 13 -3,-0.5 -22,-3.2 -173,-0.5 2,-0.5 0.314 55.5 72.5-105.0 3.0 76.8 8.3 35.4 1004 417 B L E -f 981 0I 7 -174,-0.2 2,-0.4 -24,-0.2 -22,-0.2 -0.990 65.6-177.2-125.2 118.8 75.0 10.5 38.1 1005 418 B V E +f 982 0I 1 -24,-2.3 -22,-1.9 -2,-0.5 2,-0.3 -0.970 19.3 111.4-130.2 130.8 73.4 13.7 36.9 1006 419 B T S S- 0 0 6 -2,-0.4 2,-1.9 -24,-0.2 3,-0.2 -0.936 78.6 -65.1-165.9-174.5 71.6 16.7 38.5 1007 420 B S > + 0 0 2 -2,-0.3 4,-2.0 -24,-0.3 5,-0.1 -0.629 65.8 169.4 -78.6 75.1 72.0 20.4 39.2 1008 421 B M T 4 + 0 0 41 -2,-1.9 -1,-0.2 1,-0.2 -136,-0.1 0.894 64.8 39.5 -61.9 -45.6 74.8 19.5 41.5 1009 422 B A T 4 S+ 0 0 6 -3,-0.2 -894,-0.4 -333,-0.2 -1,-0.2 0.785 130.6 21.0 -81.7 -28.7 76.3 22.9 42.2 1010 423 B E T 4 S- 0 0 3 -896,-0.2 -2,-0.2 -895,-0.1 -1,-0.1 0.480 84.6-134.2-121.8 -10.8 73.1 25.0 42.6 1011 424 B G < - 0 0 6 -4,-2.0 2,-0.7 1,-0.2 -3,-0.1 0.906 34.6-179.9 54.8 46.7 70.2 22.7 43.4 1012 425 B I > - 0 0 4 -5,-0.1 3,-1.4 -340,-0.1 -1,-0.2 -0.722 26.1-124.6 -88.3 116.0 67.9 24.3 40.8 1013 426 B L T 3 S+ 0 0 32 -2,-0.7 -1,-0.1 1,-0.2 -27,-0.0 -0.265 90.0 32.1 -59.8 141.1 64.5 22.6 40.8 1014 427 B G T 3 S+ 0 0 1 -29,-0.1 3,-0.3 29,-0.0 -1,-0.2 0.157 82.1 113.1 99.5 -15.1 63.2 21.2 37.5 1015 428 B C <> + 0 0 0 -3,-1.4 4,-2.4 1,-0.2 5,-0.3 0.733 57.4 76.6 -54.3 -30.5 66.7 20.4 36.1 1016 429 B G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.929 90.8 44.5 -64.5 -53.9 66.2 16.6 36.1 1017 430 B F H > S+ 0 0 4 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.950 119.7 40.2 -58.7 -51.7 64.0 15.8 33.1 1018 431 B P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.876 114.5 52.5 -70.5 -33.8 65.8 18.1 30.5 1019 432 B M H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.910 108.3 53.0 -61.8 -37.0 69.3 17.2 31.8 1020 433 B A H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.906 108.0 50.0 -63.7 -42.0 68.2 13.6 31.4 1021 434 B L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.923 111.5 48.7 -62.7 -40.9 67.3 14.3 27.7 1022 435 B G H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.931 111.6 49.0 -64.5 -42.7 70.7 16.0 27.1 1023 436 B A H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.903 110.1 51.9 -62.3 -40.6 72.5 13.1 28.7 1024 437 B Q H < S+ 0 0 6 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.904 107.7 51.8 -62.4 -42.4 70.5 10.7 26.5 1025 438 B L H < S+ 0 0 28 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.841 113.5 45.1 -60.5 -37.0 71.4 12.7 23.4 1026 439 B A H < S+ 0 0 5 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.813 122.4 35.4 -73.6 -32.0 75.1 12.5 24.3 1027 440 B E >< + 0 0 56 -4,-2.0 3,-2.0 -5,-0.2 -1,-0.2 -0.646 61.5 167.7-129.6 71.1 75.0 8.8 25.2 1028 441 B P T 3 S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.771 78.4 58.8 -63.0 -21.4 72.6 7.0 22.8 1029 442 B N T 3 S+ 0 0 131 -3,-0.1 2,-0.3 2,-0.1 -51,-0.1 0.465 93.5 86.7 -84.2 -6.3 73.9 3.6 24.0 1030 443 B S S < S- 0 0 8 -3,-2.0 2,-0.4 -6,-0.2 -51,-0.1 -0.751 74.1-133.9 -92.6 140.9 72.9 4.3 27.7 1031 444 B R - 0 0 59 -2,-0.3 -51,-2.6 -55,-0.1 2,-0.5 -0.770 26.3-149.3 -79.6 137.9 69.6 3.7 29.3 1032 445 B V E -e 980 0I 0 -2,-0.4 27,-2.8 25,-0.3 2,-0.5 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1072 485 B W H X S+ 0 0 59 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.950 114.6 43.4 -55.5 -47.9 56.7 20.2 54.2 1073 486 B T H X S+ 0 0 22 -4,-2.6 4,-1.7 61,-0.4 -2,-0.2 0.948 117.5 42.9 -67.2 -48.4 58.9 18.2 56.4 1074 487 B L H X S+ 0 0 17 -4,-2.6 4,-2.8 -5,-0.3 -2,-0.2 0.902 114.8 48.4 -69.7 -42.5 61.4 20.9 57.4 1075 488 B M H X>S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 6,-1.0 0.872 107.3 56.2 -65.6 -39.0 58.8 23.6 57.9 1076 489 B N H X5S+ 0 0 70 -4,-1.9 4,-1.4 -5,-0.4 -1,-0.2 0.932 114.3 41.6 -56.7 -43.6 56.6 21.3 60.1 1077 490 B H H <5S+ 0 0 155 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.924 118.0 44.7 -69.0 -43.0 59.7 20.9 62.3 1078 491 B Q H <5S+ 0 0 46 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.886 136.0 7.7 -69.1 -41.6 60.8 24.5 62.2 1079 492 B F H <5S- 0 0 50 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.2 0.434 95.0-112.0-122.3 -12.1 57.5 26.2 62.8 1080 493 B G S < - 0 0 85 -581,-2.2 4,-2.1 1,-0.2 3,-0.2 -0.703 50.4-164.3 -69.7 98.0 46.9 12.4 36.0 1092 505 B W H > S+ 0 0 0 -2,-1.3 4,-2.5 1,-0.2 5,-0.2 0.823 84.7 56.6 -65.4 -31.1 50.5 11.9 35.0 1093 506 B V H > S+ 0 0 23 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.944 107.6 48.9 -61.3 -44.9 49.7 8.8 33.1 1094 507 B G H > S+ 0 0 18 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.877 109.3 53.1 -62.3 -38.3 47.2 10.8 31.0 1095 508 B I H X S+ 0 0 0 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.963 110.6 46.3 -59.6 -50.9 49.9 13.5 30.5 1096 509 B A H ><>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 3,-1.0 0.946 113.1 49.2 -59.2 -47.6 52.4 11.0 29.1 1097 510 B K H ><5S+ 0 0 131 -4,-2.7 3,-1.4 1,-0.3 -1,-0.2 0.880 103.7 59.5 -61.2 -36.1 49.7 9.4 26.9 1098 511 B A H 3<5S+ 0 0 14 -4,-2.2 -595,-2.0 1,-0.3 -1,-0.3 0.769 109.6 45.1 -64.4 -24.5 48.7 12.8 25.5 1099 512 B F T <<5S- 0 0 13 -4,-1.1 -1,-0.3 -3,-1.0 -2,-0.2 0.438 120.3-108.2 -92.2 -4.5 52.3 13.2 24.3 1100 513 B G T < 5S+ 0 0 35 -3,-1.4 -3,-0.2 -4,-0.4 2,-0.2 0.663 77.1 133.7 78.3 16.1 52.6 9.6 22.8 1101 514 B A < - 0 0 3 -5,-2.6 2,-0.3 -6,-0.2 -1,-0.3 -0.575 67.3 -96.3 -86.7 162.3 54.9 8.6 25.7 1102 515 B Y E -i 1126 0I 44 23,-2.6 25,-2.5 -2,-0.2 2,-0.4 -0.642 48.0-174.0 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52.6 -58.6 -46.6 57.3 -1.3 40.0 1113 526 B A H > S+ 0 0 37 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.935 112.5 44.2 -59.4 -46.4 59.2 -4.2 38.5 1114 527 B G H > S+ 0 0 13 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.870 111.2 53.5 -65.3 -40.6 56.6 -4.8 35.8 1115 528 B A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.893 108.0 50.6 -63.7 -41.4 56.2 -1.1 35.0 1116 529 B L H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.917 112.0 48.0 -60.5 -44.4 60.0 -0.8 34.4 1117 530 B Q H X S+ 0 0 81 -4,-1.9 4,-2.8 -5,-0.2 -2,-0.2 0.938 113.8 45.2 -60.7 -49.3 59.9 -3.8 32.1 1118 531 B R H X S+ 0 0 103 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.892 113.5 51.4 -61.1 -39.4 56.9 -2.5 30.1 1119 532 B A H X S+ 0 0 1 -4,-2.5 4,-0.6 -5,-0.2 5,-0.5 0.938 112.8 44.6 -63.5 -49.4 58.5 0.9 29.9 1120 533 B I H >< S+ 0 0 23 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.950 113.2 50.9 -60.2 -45.7 61.8 -0.5 28.6 1121 534 B D H 3< S+ 0 0 116 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.753 98.0 67.7 -69.3 -25.3 60.1 -2.7 26.1 1122 535 B S H 3< S- 0 0 40 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.773 90.2-145.2 -63.9 -25.6 58.0 0.1 24.7 1123 536 B G << + 0 0 54 -3,-1.4 -3,-0.1 -4,-0.6 -2,-0.1 0.489 64.1 107.9 68.5 7.1 61.1 1.8 23.2 1124 537 B K S S- 0 0 101 -5,-0.5 -1,-0.3 -67,-0.1 -2,-0.1 -0.695 87.3 -85.5-102.4 163.6 59.4 5.2 24.0 1125 538 B P - 0 0 6 0, 0.0 -23,-2.6 0, 0.0 2,-0.3 -0.456 59.7-152.5 -55.4 144.2 60.2 7.8 26.7 1126 539 B A E -hi10591102I 0 -68,-2.6 -66,-2.3 -25,-0.2 2,-0.4 -0.929 23.2-160.1-132.5 150.3 58.2 6.6 29.7 1127 540 B L E -hi10601103I 1 -25,-2.5 -23,-2.1 -2,-0.3 2,-0.6 -0.984 8.4-172.5-131.6 119.5 56.6 8.0 32.8 1128 541 B I E -hi10611104I 0 -68,-2.9 -66,-2.4 -2,-0.4 2,-0.6 -0.960 16.9-144.6-114.8 114.9 55.9 5.7 35.8 1129 542 B E E +hi10621105I 12 -25,-2.4 -23,-2.7 -2,-0.6 -22,-0.4 -0.753 22.2 179.3 -85.9 117.4 53.8 7.3 38.6 1130 543 B I E -h 1063 0I 0 -68,-2.9 -66,-1.7 -2,-0.6 2,-0.1 -0.930 21.1-139.8-125.2 106.0 55.0 6.0 42.0 1131 544 B P E +h 1064 0I 11 0, 0.0 -169,-2.5 0, 0.0 2,-0.3 -0.424 30.3 171.5 -66.1 138.7 53.3 7.3 45.2 1132 545 B V - 0 0 10 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