==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE, METAL-BINDING PROTEIN 19-JUN-06 2HCV . COMPND 2 MOLECULE: L-RHAMNOSE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS STUTZERI; . AUTHOR H.YOSHIDA,M.YAMADA,G.TAKADA,K.IZUMORI,S.KAMITORI . 1679 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52118.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1195 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 140 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 1.5 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 . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 161 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 699 41.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 34 2.0 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 0 0 1 0 11 4 8 8 3 1 0 4 4 4 0 0 1 7 0 0 0 0 0 0 4 0 0 RESIDUES PER ALPHA HELIX . 7 10 0 18 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 PARALLEL BRIDGES PER LADDER . 7 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 0 0 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 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 F 0 0 160 0, 0.0 4,-0.1 0, 0.0 83,-0.1 0.000 360.0 360.0 360.0 116.8 19.8 30.7 32.2 2 5 A R + 0 0 33 1,-0.1 2,-0.5 114,-0.1 82,-0.1 0.856 360.0 47.7 -65.7 -35.1 21.1 33.3 34.7 3 6 A I S S- 0 0 2 80,-0.1 -1,-0.1 81,-0.1 5,-0.1 -0.941 102.4-109.3-110.3 125.7 24.6 32.3 33.7 4 7 A A >> - 0 0 45 -2,-0.5 4,-1.7 1,-0.1 3,-0.9 -0.272 20.0-138.3 -53.6 129.2 25.4 31.9 30.0 5 8 A Q H 3> S+ 0 0 118 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.846 101.3 61.4 -60.6 -34.7 25.9 28.3 29.1 6 9 A D H 3> S+ 0 0 95 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.821 104.7 49.4 -62.8 -29.9 28.9 29.1 26.8 7 10 A V H <> S+ 0 0 14 -3,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.926 111.6 47.6 -73.4 -45.0 30.7 30.4 29.9 8 11 A V H X S+ 0 0 13 -4,-1.7 4,-1.9 1,-0.2 389,-0.3 0.914 113.9 48.6 -60.9 -42.8 29.8 27.3 31.9 9 12 A A H X S+ 0 0 60 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.923 111.3 48.6 -63.9 -46.1 31.0 25.1 29.0 10 13 A R H X S+ 0 0 117 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.914 113.1 47.0 -62.3 -43.3 34.3 27.0 28.5 11 14 A E H X S+ 0 0 15 -4,-2.5 4,-0.7 2,-0.2 -1,-0.2 0.840 114.0 47.6 -69.1 -32.7 35.1 26.9 32.2 12 15 A N H >X S+ 0 0 25 -4,-1.9 3,-0.7 -5,-0.2 4,-0.7 0.907 111.7 49.9 -72.8 -42.5 34.3 23.2 32.5 13 16 A D H >< S+ 0 0 127 -4,-2.7 3,-0.8 1,-0.2 4,-0.5 0.892 105.9 57.7 -61.1 -39.3 36.3 22.3 29.4 14 17 A R H 3< S+ 0 0 154 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.765 116.4 34.6 -62.5 -25.7 39.2 24.3 30.9 15 18 A R H S+ 0 0 87 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.918 113.3 44.9 -58.9 -48.3 41.7 17.2 32.1 18 21 A A H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.890 113.2 51.5 -64.5 -40.4 42.6 17.9 35.7 19 22 A L H X S+ 0 0 17 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.914 109.0 51.2 -62.3 -43.4 39.2 16.7 36.9 20 23 A K H X S+ 0 0 110 -4,-2.6 4,-2.3 1,-0.2 5,-0.3 0.932 111.5 47.0 -60.4 -46.6 39.6 13.5 34.9 21 24 A E H X S+ 0 0 92 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.910 117.8 41.7 -63.0 -42.7 43.0 12.8 36.5 22 25 A D H X S+ 0 0 37 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.904 115.3 48.4 -72.5 -43.0 41.9 13.5 40.0 23 26 A Y H X S+ 0 0 32 -4,-3.2 4,-2.8 -5,-0.2 -2,-0.2 0.928 115.0 44.9 -64.1 -45.3 38.5 11.7 39.8 24 27 A E H X S+ 0 0 98 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.876 113.0 50.9 -68.1 -35.9 40.1 8.6 38.3 25 28 A A H X S+ 0 0 34 -4,-1.6 4,-2.1 -5,-0.3 -2,-0.2 0.928 114.5 43.9 -66.3 -44.0 43.0 8.6 40.8 26 29 A L H X S+ 0 0 20 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.903 110.6 56.1 -65.6 -41.1 40.5 8.9 43.6 27 30 A G H X S+ 0 0 13 -4,-2.8 4,-2.1 1,-0.2 10,-0.3 0.881 107.8 47.7 -58.5 -40.3 38.3 6.3 42.0 28 31 A A H X S+ 0 0 42 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.933 112.0 49.9 -66.8 -45.7 41.2 3.8 42.0 29 32 A N H X S+ 0 0 30 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.938 112.5 46.4 -58.1 -48.6 42.0 4.6 45.6 30 33 A L H ><>S+ 0 0 0 -4,-3.1 5,-2.7 1,-0.2 3,-0.8 0.886 108.6 56.9 -61.8 -39.0 38.4 4.1 46.7 31 34 A A H ><5S+ 0 0 60 -4,-2.1 3,-2.8 1,-0.3 -1,-0.2 0.943 103.5 52.2 -57.0 -49.3 38.2 0.9 44.6 32 35 A R H 3<5S+ 0 0 109 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.720 107.5 54.8 -59.5 -19.8 41.2 -0.5 46.6 33 36 A R T <<5S- 0 0 82 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.306 124.2-107.1 -95.6 6.8 39.2 0.4 49.7 34 37 A G T < 5S+ 0 0 71 -3,-2.8 2,-0.4 1,-0.3 -3,-0.2 0.758 79.8 128.6 74.2 24.7 36.2 -1.7 48.4 35 38 A V < - 0 0 35 -5,-2.7 2,-0.9 -8,-0.1 -1,-0.3 -0.942 56.2-138.9-117.6 135.3 34.2 1.4 47.5 36 39 A D >> - 0 0 104 -2,-0.4 4,-1.3 1,-0.2 3,-0.7 -0.811 9.1-160.7 -91.9 105.3 32.5 2.1 44.2 37 40 A I H 3> S+ 0 0 18 -2,-0.9 4,-2.6 -10,-0.3 5,-0.2 0.833 90.7 61.0 -54.3 -33.2 33.1 5.8 43.5 38 41 A E H 3> S+ 0 0 77 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.917 100.3 53.1 -59.9 -45.5 30.2 5.7 41.0 39 42 A A H <> S+ 0 0 54 -3,-0.7 4,-1.0 1,-0.2 -1,-0.2 0.856 111.7 46.4 -59.1 -36.4 27.8 4.7 43.8 40 43 A V H >X S+ 0 0 10 -4,-1.3 4,-2.5 2,-0.2 3,-0.5 0.949 111.2 49.4 -72.3 -49.6 28.9 7.7 45.9 41 44 A T H 3X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.879 106.7 57.7 -57.0 -40.2 28.7 10.2 43.0 42 45 A A H 3< S+ 0 0 41 -4,-2.4 -1,-0.2 1,-0.2 4,-0.2 0.858 111.7 40.8 -60.3 -37.3 25.2 9.0 42.1 43 46 A K H X< S+ 0 0 84 -4,-1.0 3,-0.8 -3,-0.5 -1,-0.2 0.857 112.8 54.5 -80.0 -35.6 24.0 9.8 45.6 44 47 A V H >< S+ 0 0 0 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.909 102.3 56.1 -63.8 -42.6 25.9 13.0 45.9 45 48 A E T 3< S+ 0 0 32 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.664 109.2 50.9 -65.5 -11.5 24.4 14.5 42.7 46 49 A K T < S+ 0 0 132 -3,-0.8 2,-0.6 -4,-0.2 -1,-0.3 0.361 83.1 105.2-106.3 2.0 21.0 13.8 44.3 47 50 A F < - 0 0 19 -3,-2.0 2,-0.3 -4,-0.1 297,-0.1 -0.773 50.0-176.7 -89.3 120.5 21.6 15.5 47.7 48 51 A F - 0 0 86 -2,-0.6 2,-0.4 44,-0.1 273,-0.3 -0.864 15.3-172.2-118.7 150.8 19.8 18.9 47.9 49 52 A V - 0 0 4 42,-2.4 45,-0.3 -2,-0.3 273,-0.3 -0.997 29.9-114.5-139.1 135.6 19.7 21.6 50.5 50 53 A A B -a 322 0A 2 271,-2.8 273,-2.7 -2,-0.4 45,-0.2 -0.444 22.7-135.0 -74.0 145.3 17.3 24.6 50.4 51 54 A V E -h 95 0B 0 43,-2.2 45,-2.8 271,-0.2 2,-0.4 -0.846 19.0-122.9-100.8 134.2 18.7 28.1 49.9 52 55 A P E > -h 96 0B 1 0, 0.0 3,-2.1 0, 0.0 4,-0.4 -0.611 8.1-144.2 -78.0 128.2 17.3 30.9 52.2 53 56 A S G > S+ 0 0 0 43,-2.5 3,-0.9 -2,-0.4 4,-0.1 0.862 103.9 55.5 -58.0 -34.7 15.9 33.8 50.2 54 57 A W G 3 S+ 0 0 49 42,-0.3 3,-0.3 1,-0.2 -1,-0.3 0.486 95.6 70.3 -77.8 -1.5 17.2 36.1 52.9 55 58 A G G < S+ 0 0 1 -3,-2.1 -1,-0.2 1,-0.2 272,-0.2 0.637 82.2 66.7 -91.1 -15.0 20.7 34.7 52.3 56 59 A V S < S+ 0 0 0 -3,-0.9 2,-0.3 -4,-0.4 277,-0.3 0.484 92.0 74.8 -84.5 -2.5 21.4 36.2 48.9 57 60 A G S S- 0 0 14 -3,-0.3 270,-0.5 -4,-0.1 2,-0.1 -0.812 98.5 -95.2-105.9 151.4 21.5 39.7 50.4 58 61 A T B -j 327 0C 5 -2,-0.3 270,-0.2 268,-0.1 2,-0.1 -0.408 43.0-150.4 -66.2 136.4 24.4 41.0 52.5 59 62 A G - 0 0 14 268,-2.0 7,-0.5 -4,-0.1 2,-0.3 -0.392 14.2-174.6 -99.8-179.0 23.9 40.6 56.2 60 63 A G B -K 65 0D 18 5,-0.2 5,-0.2 -2,-0.1 2,-0.2 -0.913 19.7-111.0-159.1-176.3 25.2 42.6 59.1 61 64 A T - 0 0 21 3,-2.5 3,-0.3 -2,-0.3 422,-0.0 -0.565 47.3 -88.1-116.4-177.0 25.4 42.9 62.9 62 65 A R S S+ 0 0 73 1,-0.2 3,-0.1 -2,-0.2 420,-0.1 0.701 127.1 55.7 -67.2 -16.1 23.8 45.3 65.4 63 66 A F S S- 0 0 45 1,-0.3 2,-0.3 537,-0.0 -1,-0.2 0.837 122.3 -38.8 -84.8 -35.7 26.8 47.5 64.8 64 67 A A - 0 0 24 -3,-0.3 -3,-2.5 487,-0.1 2,-0.4 -0.971 39.2-130.5-180.0 166.6 26.6 47.9 61.1 65 68 A R B -K 60 0D 119 -2,-0.3 487,-0.2 -5,-0.2 -5,-0.2 -0.998 13.5-163.7-134.5 126.0 25.8 46.4 57.7 66 69 A F - 0 0 32 -7,-0.5 -7,-0.1 -2,-0.4 -2,-0.0 -0.742 17.7-160.3-113.7 81.4 28.2 46.8 54.8 67 70 A P - 0 0 62 0, 0.0 2,-0.1 0, 0.0 494,-0.1 -0.176 3.1-145.4 -61.5 151.8 26.2 46.0 51.6 68 71 A G - 0 0 34 1,-0.2 3,-0.4 262,-0.1 2,-0.2 -0.128 38.3 -65.4 -97.8-159.5 28.0 45.1 48.4 69 72 A T S S+ 0 0 88 1,-0.2 -1,-0.2 -2,-0.1 344,-0.1 -0.598 110.3 23.0 -93.3 154.9 26.8 45.9 44.8 70 73 A G S S- 0 0 6 343,-0.4 -1,-0.2 346,-0.4 343,-0.1 0.858 74.6-177.0 63.2 37.7 23.7 44.6 43.2 71 74 A E - 0 0 23 -3,-0.4 -1,-0.2 345,-0.2 -14,-0.1 -0.443 37.5-100.9 -65.0 137.4 21.8 43.9 46.4 72 75 A P - 0 0 19 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.367 25.0-153.5 -62.0 138.8 18.5 42.3 45.5 73 76 A R - 0 0 161 1,-0.1 2,-0.3 -3,-0.1 -2,-0.1 0.626 69.7 -19.6 -87.5 -13.7 15.6 44.8 45.8 74 77 A G S > S- 0 0 28 1,-0.1 4,-2.2 28,-0.0 3,-0.3 -0.958 85.9 -64.5-171.2-173.6 13.1 42.1 46.5 75 78 A I H > S+ 0 0 10 26,-0.3 4,-2.8 -2,-0.3 5,-0.2 0.866 123.3 57.4 -59.2 -39.5 12.1 38.5 46.4 76 79 A F H > S+ 0 0 55 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.901 109.0 45.5 -61.6 -38.7 12.0 38.3 42.6 77 80 A D H > S+ 0 0 10 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.912 111.8 53.4 -68.1 -40.7 15.7 39.5 42.5 78 81 A K H X S+ 0 0 33 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.882 107.2 50.7 -60.9 -39.2 16.5 37.0 45.2 79 82 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.913 107.7 54.0 -65.2 -41.2 14.9 34.2 43.2 80 83 A D H X S+ 0 0 19 -4,-1.8 4,-0.9 1,-0.2 -2,-0.2 0.909 111.1 45.4 -58.3 -43.4 17.0 35.2 40.2 81 84 A D H >X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 3,-0.5 0.879 109.1 54.3 -69.3 -38.8 20.2 35.0 42.3 82 85 A C H 3X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.844 101.9 60.9 -62.7 -31.2 19.1 31.6 43.8 83 86 A A H 3X S+ 0 0 8 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.856 101.7 52.7 -62.9 -35.4 18.8 30.4 40.2 84 87 A V H S+ 0 0 0 -4,-1.7 4,-2.9 1,-0.2 5,-0.5 0.930 115.0 45.2 -56.4 -48.1 23.5 29.1 42.8 86 89 A Q H X5S+ 0 0 24 -4,-2.5 4,-2.9 6,-0.3 -2,-0.2 0.936 111.3 51.9 -62.0 -49.0 21.3 26.2 41.6 87 90 A Q H <5S+ 0 0 16 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.892 119.1 36.1 -55.7 -43.1 22.5 26.4 38.0 88 91 A L H <5S+ 0 0 0 -4,-2.4 308,-2.4 307,-0.2 -2,-0.2 0.855 132.5 25.1 -82.5 -37.2 26.2 26.3 39.1 89 92 A T H <5S- 0 0 1 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.720 79.1-154.4 -98.8 -25.1 26.0 23.9 42.0 90 93 A R S < -b 124 0A 14 -2,-0.2 4,-3.0 25,-0.2 5,-0.2 -0.983 26.0-115.1-126.4 121.0 10.5 34.3 54.7 99 102 A I T 4 S+ 0 0 0 25,-2.7 27,-0.4 -2,-0.5 62,-0.1 -0.833 89.5 11.0-104.2 142.2 7.2 36.3 55.3 100 103 A P T >4 S+ 0 0 45 0, 0.0 3,-1.3 0, 0.0 -1,-0.3 -0.976 122.6 62.9 -84.8 6.0 6.6 39.2 55.3 101 104 A W T 34 S+ 0 0 126 1,-0.3 -26,-0.3 -27,-0.0 -2,-0.2 0.895 116.4 32.4 -56.1 -40.5 10.0 40.0 53.6 102 105 A D T 3< S+ 0 0 1 -4,-3.0 -1,-0.3 -28,-0.1 -3,-0.2 0.225 85.6 146.1-101.2 13.8 9.1 37.9 50.5 103 106 A K < + 0 0 90 -3,-1.3 2,-0.3 -5,-0.2 -28,-0.2 -0.238 20.4 123.7 -55.4 135.2 5.3 38.6 50.6 104 107 A A S S- 0 0 27 -29,-0.1 5,-0.1 0, 0.0 -2,-0.1 -0.949 70.4 -49.6-177.4 169.8 3.9 38.8 47.0 105 108 A D >> - 0 0 68 -2,-0.3 4,-2.0 1,-0.2 3,-0.9 -0.402 48.1-143.2 -59.0 118.5 1.2 37.2 44.8 106 109 A P H 3> S+ 0 0 25 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.844 98.8 58.6 -51.5 -40.0 1.7 33.4 45.2 107 110 A K H 3> S+ 0 0 168 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.874 109.0 45.0 -60.7 -36.8 0.9 32.8 41.5 108 111 A E H <> S+ 0 0 104 -3,-0.9 4,-2.6 2,-0.2 5,-0.2 0.875 111.8 51.0 -74.5 -39.0 3.7 35.1 40.5 109 112 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.960 114.3 44.9 -60.8 -50.2 6.2 33.6 43.0 110 113 A K H X S+ 0 0 72 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.902 111.9 53.2 -59.4 -44.1 5.3 30.1 41.7 111 114 A A H X S+ 0 0 55 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.914 111.1 44.7 -60.1 -45.7 5.5 31.4 38.1 112 115 A R H X S+ 0 0 80 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.909 112.5 53.1 -66.8 -41.0 9.0 32.8 38.5 113 116 A G H X>S+ 0 0 0 -4,-2.5 5,-2.8 -5,-0.2 4,-1.5 0.963 110.9 44.8 -57.6 -53.5 10.1 29.7 40.4 114 117 A D H <5S+ 0 0 93 -4,-2.8 3,-0.3 1,-0.2 -1,-0.2 0.897 111.3 54.9 -57.9 -40.6 8.9 27.4 37.6 115 118 A A H <5S+ 0 0 82 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.847 114.3 39.9 -61.5 -35.1 10.5 29.7 35.0 116 119 A L H <5S- 0 0 48 -4,-1.9 -1,-0.2 -3,-0.4 -2,-0.2 0.577 115.2-112.1 -90.9 -12.0 13.9 29.5 36.8 117 120 A G T <5S+ 0 0 53 -4,-1.5 2,-0.3 -3,-0.3 -3,-0.2 0.791 73.8 132.6 84.3 29.7 13.6 25.8 37.5 118 121 A L < - 0 0 6 -5,-2.8 -1,-0.3 -6,-0.2 -24,-0.2 -0.854 38.4-161.4-116.0 150.6 13.4 26.3 41.3 119 122 A G E -i 94 0B 22 -26,-3.0 -24,-2.6 -2,-0.3 2,-0.5 -0.549 23.6-106.6-116.1-176.3 10.9 24.9 43.8 120 123 A F E -i 95 0B 17 -26,-0.3 -24,-0.2 48,-0.2 51,-0.1 -0.967 26.6-169.9-124.5 129.1 10.0 26.1 47.3 121 124 A D - 0 0 35 -26,-2.8 -24,-0.3 -2,-0.5 51,-0.2 0.049 53.9 -22.4 -90.5-156.2 11.0 24.5 50.6 122 125 A A - 0 0 2 48,-0.1 -25,-0.4 49,-0.1 -1,-0.3 -0.149 65.3-122.1 -55.6 142.3 9.6 25.3 54.1 123 126 A M E - c 0 173A 0 49,-3.1 51,-3.3 -27,-0.2 2,-0.4 -0.484 21.4-145.6 -80.3 156.8 8.0 28.7 54.7 124 127 A N E -bc 98 174A 7 -27,-1.2 -25,-2.7 49,-0.2 51,-0.2 -0.981 6.7-149.8-130.9 120.3 9.4 30.9 57.5 125 128 A S - 0 0 3 49,-1.6 2,-0.5 -2,-0.4 51,-0.4 -0.502 6.0-145.0 -86.2 157.9 7.3 33.1 59.7 126 129 A N + 0 0 6 -27,-0.4 5,-0.1 -2,-0.2 51,-0.1 -0.880 43.7 135.8-129.4 100.1 8.5 36.4 61.1 127 130 A T + 0 0 1 -2,-0.5 51,-0.2 49,-0.4 52,-0.1 -0.118 59.3 85.1-129.0 32.9 7.3 37.5 64.6 128 131 A F S S+ 0 0 16 49,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.179 96.0 35.6-115.2 10.6 10.7 38.6 65.8 129 132 A S S S- 0 0 22 -3,-0.1 2,-0.5 357,-0.1 -1,-0.1 -0.966 90.2-102.9-156.9 155.3 10.4 42.1 64.3 130 133 A D - 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0 0 89 19,-0.4 4,-2.6 1,-0.2 5,-0.2 -0.615 29.0-173.5 -76.6 90.8 37.6 43.4 106.9 777 358 B R H > S+ 0 0 50 -2,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.829 78.8 53.8 -57.0 -38.0 41.0 43.6 105.0 778 359 B A H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.958 112.1 43.4 -63.4 -50.5 43.0 42.8 108.1 779 360 B A H > S+ 0 0 31 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.934 113.5 51.8 -60.5 -46.7 41.1 39.6 108.8 780 361 B L H X S+ 0 0 5 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.930 107.9 51.9 -55.2 -48.3 41.1 38.6 105.1 781 362 B S H X S+ 0 0 44 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.904 109.8 50.4 -56.4 -42.6 44.9 39.1 105.0 782 363 B G H X S+ 0 0 30 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.940 111.1 46.7 -62.4 -47.7 45.2 36.8 108.0 783 364 B Y H <>S+ 0 0 65 -4,-2.6 5,-2.8 1,-0.2 4,-0.2 0.831 111.7 52.9 -64.5 -31.5 43.1 34.1 106.5 784 365 B Q H ><5S+ 0 0 14 -4,-2.5 3,-1.1 -5,-0.2 -1,-0.2 0.938 109.7 47.1 -69.5 -45.3 45.0 34.3 103.2 785 366 B E H 3<5S+ 0 0 83 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.852 115.3 45.6 -64.4 -35.0 48.3 33.9 104.9 786 367 B D T 3<5S- 0 0 126 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.391 110.1-122.7 -89.0 3.6 47.2 31.0 107.0 787 368 B N T < 5 + 0 0 22 -3,-1.1 2,-1.1 -4,-0.2 -3,-0.2 0.902 56.3 154.4 55.2 45.1 45.5 29.4 104.0 788 369 B D >< + 0 0 32 -5,-2.8 4,-2.1 1,-0.2 -1,-0.2 -0.731 13.7 174.4-101.5 77.1 42.1 29.3 105.7 789 370 B A H > S+ 0 0 1 -2,-1.1 4,-2.6 383,-0.4 5,-0.3 0.860 71.3 55.6 -53.7 -42.7 40.1 29.3 102.4 790 371 B L H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.957 112.7 38.5 -58.7 -55.3 36.8 28.9 104.1 791 372 B M H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.813 114.0 57.7 -67.1 -29.8 37.1 31.9 106.5 792 373 B A H X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.943 111.0 40.6 -65.2 -46.6 38.7 33.9 103.7 793 374 B T H X S+ 0 0 13 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.843 114.8 54.0 -70.9 -30.7 35.7 33.4 101.4 794 375 B E H X S+ 0 0 26 -4,-2.1 4,-2.5 -5,-0.3 -1,-0.2 0.822 101.7 58.4 -71.1 -31.2 33.4 33.9 104.4 795 376 B T H X S+ 0 0 8 -4,-2.0 4,-0.9 2,-0.2 -19,-0.4 0.881 109.4 44.6 -66.4 -35.7 35.1 37.2 105.1 796 377 B L H X S+ 0 0 0 -4,-1.3 4,-2.6 653,-0.2 3,-0.4 0.915 112.0 53.0 -72.2 -42.5 34.2 38.4 101.6 797 378 B K H X S+ 0 0 8 -4,-2.1 4,-3.4 1,-0.2 5,-0.3 0.869 99.7 60.7 -60.9 -39.5 30.6 37.0 102.0 798 379 B R H < S+ 0 0 93 -4,-2.5 4,-0.5 2,-0.2 -1,-0.2 0.891 112.4 40.8 -56.1 -37.2 30.0 38.9 105.2 799 380 B A H >< S+ 0 0 2 -4,-0.9 3,-1.3 -3,-0.4 -2,-0.2 0.970 117.0 46.2 -73.5 -56.3 30.5 42.1 103.3 800 381 B Y H 3< S+ 0 0 18 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.813 108.4 57.1 -56.5 -35.3 28.7 41.0 100.1 801 382 B R T 3< S+ 0 0 34 -4,-3.4 -1,-0.3 -5,-0.2 2,-0.2 0.697 84.3 102.9 -71.8 -19.1 25.7 39.7 102.1 802 383 B T S < S- 0 0 2 -3,-1.3 2,-1.0 -4,-0.5 421,-0.1 -0.482 75.7-129.8 -69.8 128.9 25.1 43.1 103.8 803 384 B D + 0 0 41 -2,-0.2 4,-0.1 1,-0.2 -1,-0.1 -0.702 29.9 176.4 -81.5 104.8 22.3 45.1 102.3 804 385 B V >> + 0 0 0 -2,-1.0 4,-2.0 1,-0.2 3,-0.8 0.291 45.1 111.7 -93.1 9.8 23.9 48.5 101.7 805 386 B E H 3> S+ 0 0 41 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.878 73.9 57.8 -50.6 -42.6 20.8 50.0 100.1 806 387 B P H 3> S+ 0 0 11 0, 0.0 4,-2.7 0, 0.0 -1,-0.3 0.891 106.9 48.2 -57.2 -39.0 20.4 52.4 103.2 807 388 B I H <> S+ 0 0 0 -3,-0.8 4,-2.1 2,-0.2 -2,-0.2 0.935 113.2 46.8 -66.4 -45.9 23.9 53.8 102.6 808 389 B L H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.931 115.7 46.3 -60.9 -45.7 23.3 54.3 98.9 809 390 B A H X S+ 0 0 4 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.904 112.5 48.3 -64.9 -44.7 19.9 55.9 99.6 810 391 B E H X S+ 0 0 16 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.861 108.5 55.4 -66.2 -34.7 21.2 58.2 102.4 811 392 B A H X S+ 0 0 1 -4,-2.1 4,-0.9 -5,-0.2 6,-0.2 0.927 111.4 44.2 -63.0 -42.1 24.1 59.3 100.2 812 393 B R H ><>S+ 0 0 1 -4,-1.8 5,-3.2 2,-0.2 3,-0.5 0.917 111.4 53.5 -67.7 -43.2 21.6 60.3 97.5 813 394 B R H ><5S+ 0 0 107 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.910 110.6 46.2 -58.5 -44.9 19.3 62.0 100.0 814 395 B R H 3<5S+ 0 0 111 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.672 114.3 48.6 -72.6 -19.0 22.1 64.2 101.5 815 396 B T T <<5S- 0 0 46 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.198 124.7 -88.9-109.8 16.7 23.4 65.2 98.1 816 397 B G T < 5S+ 0 0 37 -3,-0.9 -3,-0.2 -4,-0.3 -304,-0.1 0.471 90.4 116.9 93.6 2.4 20.3 66.3 96.3 817 398 B G < - 0 0 0 -5,-3.2 2,-0.4 -6,-0.2 -1,-0.3 -0.170 67.5 -87.6 -92.2-171.0 19.3 62.9 94.9 818 399 B A - 0 0 0 -308,-2.6 -5,-0.1 1,-0.1 -6,-0.1 -0.801 15.0-139.9-104.7 142.9 16.3 60.6 95.5 819 400 B V S S+ 0 0 12 -2,-0.4 -1,-0.1 1,-0.3 -7,-0.1 0.914 108.7 22.2 -61.1 -44.4 15.9 57.9 98.2 820 401 B D S > S- 0 0 43 1,-0.2 4,-2.1 -387,-0.1 -1,-0.3 -0.862 80.7-170.5-126.2 90.3 14.3 55.6 95.6 821 402 B P H > S+ 0 0 3 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.898 82.4 43.6 -47.8 -56.8 15.5 57.0 92.2 822 403 B V H > S+ 0 0 5 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.925 113.1 52.3 -61.9 -43.3 13.2 54.9 89.9 823 404 B A H > S+ 0 0 23 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.874 113.0 44.8 -60.2 -38.9 10.2 55.5 92.1 824 405 B T H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.882 110.4 55.2 -71.9 -38.8 10.7 59.2 92.0 825 406 B Y H X>S+ 0 0 2 -4,-2.5 5,-1.1 -5,-0.2 4,-0.7 0.925 112.8 42.3 -58.5 -46.2 11.4 59.1 88.3 826 407 B R H ><5S+ 0 0 96 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.902 112.0 53.1 -69.3 -41.8 8.1 57.4 87.7 827 408 B A H 3<5S+ 0 0 56 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.829 105.2 57.0 -62.5 -30.4 6.2 59.7 90.1 828 409 B S H 3<5S- 0 0 35 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.719 99.6-137.7 -73.6 -22.5 7.6 62.7 88.2 829 410 B G T < + 0 0 3 -5,-1.1 4,-2.5 1,-0.2 5,-0.3 0.906 65.9 54.3 -54.5 -47.8 9.3 62.4 83.1 831 412 B R H > S+ 0 0 35 -6,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.907 110.7 45.1 -55.3 -45.9 8.8 59.8 80.4 832 413 B A H > S+ 0 0 69 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.862 110.6 57.2 -66.2 -35.7 5.3 61.0 79.5 833 414 B R H X S+ 0 0 92 -4,-2.1 4,-0.9 1,-0.2 3,-0.4 0.950 112.2 37.7 -60.5 -52.0 6.6 64.5 79.6 834 415 B V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.760 109.1 64.0 -72.9 -23.5 9.3 63.9 77.0 835 416 B A H < S+ 0 0 31 -4,-1.7 -343,-0.3 -5,-0.3 -1,-0.2 0.846 104.2 48.2 -66.2 -31.8 7.0 61.6 75.1 836 417 B A H < S+ 0 0 90 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.754 116.1 42.6 -77.9 -25.9 4.8 64.7 74.5 837 418 B E H < S+ 0 0 107 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.711 111.5 58.5 -91.2 -25.1 7.8 66.8 73.4 838 419 B R S < S- 0 0 7 -4,-2.4 -346,-0.5 -5,-0.1 -345,-0.2 -0.897 84.6-133.8-113.0 106.8 9.4 64.1 71.2 839 420 B P - 0 0 107 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.340 19.1-131.9 -59.4 126.7 7.2 62.7 68.4 840 421 B A - 0 0 60 -5,-0.2 -349,-0.1 1,-0.1 -350,-0.0 -0.431 20.6-117.2 -73.5 155.6 7.3 58.9 68.2 841 422 B S 0 0 110 -2,-0.1 -1,-0.1 1,-0.1 0, 0.0 0.854 360.0 360.0 -63.0 -31.5 7.9 57.6 64.7 842 423 B V 0 0 130 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.513 360.0 360.0-141.3 360.0 4.4 56.0 64.9 843 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 844 4 C F 0 0 168 0, 0.0 4,-0.1 0, 0.0 83,-0.1 0.000 360.0 360.0 360.0 126.4 26.1 14.4 120.9 845 5 C R + 0 0 27 114,-0.1 2,-0.5 1,-0.1 82,-0.1 0.854 360.0 47.5 -67.7 -36.1 29.3 14.8 118.8 846 6 C I S S- 0 0 2 81,-0.1 -1,-0.1 1,-0.0 5,-0.1 -0.928 103.3-104.7-109.9 129.6 29.7 18.3 120.1 847 7 C A >> - 0 0 45 -2,-0.5 4,-1.7 1,-0.2 3,-0.7 -0.239 22.8-137.2 -51.6 131.2 29.4 19.0 123.9 848 8 C Q H 3> S+ 0 0 117 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.814 103.7 58.0 -62.7 -29.6 26.1 20.6 124.6 849 9 C D H 3> S+ 0 0 87 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.796 104.0 51.9 -71.3 -28.1 27.7 23.0 127.0 850 10 C V H <> S+ 0 0 20 -3,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.917 111.6 46.3 -72.7 -42.0 30.0 24.2 124.2 851 11 C V H X S+ 0 0 11 -4,-1.7 4,-1.3 2,-0.2 389,-0.3 0.912 114.5 48.4 -64.8 -42.4 27.0 24.9 121.9 852 12 C A H X S+ 0 0 46 -4,-2.5 4,-2.7 1,-0.2 3,-0.3 0.936 113.3 46.7 -62.4 -48.4 25.2 26.6 124.8 853 13 C R H X S+ 0 0 124 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.873 112.6 49.4 -63.1 -39.5 28.3 28.8 125.6 854 14 C E H < S+ 0 0 9 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.717 112.9 47.9 -75.1 -20.1 28.9 29.7 122.0 855 15 C N H >X S+ 0 0 17 -4,-1.3 3,-1.5 -3,-0.3 4,-1.0 0.907 108.8 52.0 -82.8 -46.7 25.3 30.7 121.5 856 16 C D H 3X S+ 0 0 118 -4,-2.7 4,-0.5 1,-0.3 3,-0.5 0.857 104.2 59.1 -56.3 -36.7 25.0 32.8 124.7 857 17 C R H 3< S+ 0 0 157 -4,-1.6 -1,-0.3 1,-0.2 4,-0.2 0.736 117.6 31.3 -64.7 -23.4 28.1 34.7 123.6 858 18 C R H <> S+ 0 0 65 -3,-1.5 4,-1.9 -4,-0.3 -1,-0.2 0.358 92.0 97.5-116.5 2.4 26.3 35.7 120.4 859 19 C A H X S+ 0 0 39 -4,-1.0 4,-2.4 -3,-0.5 5,-0.2 0.890 81.3 52.4 -60.4 -43.9 22.7 35.9 121.7 860 20 C S H X S+ 0 0 89 -4,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.953 112.2 42.7 -59.5 -54.4 22.7 39.7 122.3 861 21 C A H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.866 113.9 53.6 -60.7 -37.3 23.8 40.6 118.8 862 22 C L H X S+ 0 0 11 -4,-1.9 4,-3.1 2,-0.2 5,-0.3 0.900 106.0 52.5 -64.8 -40.6 21.5 38.0 117.3 863 23 C K H X S+ 0 0 112 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.924 110.7 48.1 -60.7 -43.6 18.6 39.5 119.1 864 24 C E H X S+ 0 0 88 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.918 115.3 43.9 -63.0 -45.9 19.4 42.9 117.8 865 25 C D H X S+ 0 0 35 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.906 114.2 49.1 -67.3 -42.8 19.8 41.7 114.2 866 26 C Y H X S+ 0 0 26 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.910 114.1 44.9 -64.9 -43.1 16.7 39.5 114.3 867 27 C E H X S+ 0 0 101 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.858 114.0 50.4 -69.2 -35.2 14.4 42.3 115.7 868 28 C A H X S+ 0 0 33 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.956 114.9 42.3 -66.4 -50.6 15.9 44.8 113.2 869 29 C L H X S+ 0 0 18 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.905 111.1 57.9 -61.6 -41.2 15.3 42.5 110.3 870 30 C G H X S+ 0 0 14 -4,-2.7 4,-1.8 -5,-0.2 10,-0.3 0.896 107.7 46.4 -55.9 -41.6 11.9 41.6 111.8 871 31 C A H X S+ 0 0 41 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.895 111.8 50.5 -68.8 -40.9 10.9 45.3 111.7 872 32 C N H X S+ 0 0 25 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.922 111.8 47.6 -63.2 -43.7 12.1 45.7 108.2 873 33 C L H <>S+ 0 0 0 -4,-2.9 5,-3.2 1,-0.2 3,-0.4 0.861 108.6 55.4 -65.9 -34.6 10.2 42.7 107.0 874 34 C A H ><5S+ 0 0 65 -4,-1.8 3,-2.6 -5,-0.3 -1,-0.2 0.933 102.6 55.0 -63.0 -44.9 7.1 44.0 108.8 875 35 C R H 3<5S+ 0 0 102 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.763 108.9 51.1 -58.4 -22.8 7.4 47.3 106.9 876 36 C R T 3<5S- 0 0 88 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.295 122.7-107.0 -96.2 6.7 7.3 45.0 103.8 877 37 C G T < 5S+ 0 0 75 -3,-2.6 2,-0.4 1,-0.3 -3,-0.2 0.772 80.2 129.4 73.4 24.6 4.2 43.1 105.0 878 38 C V < - 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0 0 90 19,-0.4 4,-2.9 1,-0.2 5,-0.2 -0.649 28.4-174.6 -82.1 89.6 6.5 39.3 96.8 1198 358 C R H > S+ 0 0 43 -2,-1.6 4,-2.7 1,-0.2 -1,-0.2 0.831 78.8 52.0 -54.8 -40.6 4.8 36.8 94.4 1199 359 C A H > S+ 0 0 79 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.951 112.7 44.4 -63.8 -49.5 1.7 39.0 93.8 1200 360 C A H > S+ 0 0 30 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.928 113.6 51.0 -61.2 -45.3 3.8 42.0 92.9 1201 361 C L H X S+ 0 0 4 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.943 108.1 51.8 -57.5 -49.7 6.1 39.9 90.7 1202 362 C S H X S+ 0 0 41 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.881 109.8 51.4 -53.8 -41.0 3.1 38.3 88.9 1203 363 C G H X S+ 0 0 29 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.914 110.1 46.6 -64.3 -45.0 1.8 41.9 88.2 1204 364 C Y H <>S+ 0 0 63 -4,-2.3 5,-3.0 2,-0.2 4,-0.3 0.820 112.3 52.1 -68.2 -30.2 5.1 43.1 86.8 1205 365 C Q H ><5S+ 0 0 13 -4,-2.3 3,-1.0 -5,-0.2 -2,-0.2 0.942 110.5 46.4 -70.1 -48.2 5.4 40.0 84.6 1206 366 C E H 3<5S+ 0 0 86 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.802 115.6 47.0 -64.5 -29.1 1.9 40.4 83.1 1207 367 C D T 3<5S- 0 0 117 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.494 109.0-125.4 -89.3 -4.5 2.6 44.1 82.5 1208 368 C N T < 5 + 0 0 22 -3,-1.0 2,-1.4 -4,-0.3 -3,-0.2 0.876 55.6 154.4 60.6 37.5 6.0 43.3 80.9 1209 369 C D >< + 0 0 30 -5,-3.0 4,-2.0 1,-0.2 -1,-0.2 -0.685 15.4 176.1 -94.8 76.6 7.6 45.7 83.4 1210 370 C A H > S+ 0 0 2 -2,-1.4 4,-2.3 -459,-0.4 5,-0.2 0.847 71.0 53.7 -52.5 -41.4 11.0 43.9 83.2 1211 371 C L H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.939 111.9 40.8 -63.8 -50.7 12.8 46.3 85.4 1212 372 C M H > S+ 0 0 17 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.804 112.8 58.6 -69.5 -25.8 10.4 46.2 88.4 1213 373 C A H X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.949 110.3 40.0 -66.3 -49.4 10.1 42.4 87.9 1214 374 C T H X S+ 0 0 14 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.857 114.7 53.7 -69.6 -32.7 13.8 41.8 88.3 1215 375 C E H X S+ 0 0 21 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.782 102.3 59.4 -71.1 -26.0 14.0 44.4 91.1 1216 376 C T H X S+ 0 0 7 -4,-1.4 4,-0.9 2,-0.2 -19,-0.4 0.883 109.3 42.9 -69.0 -37.4 11.2 42.5 92.9 1217 377 C L H X S+ 0 0 0 -4,-1.3 4,-2.6 -1033,-0.2 3,-0.5 0.925 113.3 52.7 -72.5 -43.8 13.5 39.4 92.9 1218 378 C K H X S+ 0 0 8 -4,-2.4 4,-3.6 1,-0.2 5,-0.3 0.860 99.4 61.7 -60.6 -37.9 16.5 41.5 94.0 1219 379 C R H X S+ 0 0 96 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.905 111.9 40.0 -56.3 -38.5 14.7 43.1 96.9 1220 380 C A H >< S+ 0 0 1 -4,-0.9 3,-0.9 -3,-0.5 -2,-0.2 0.943 117.3 47.7 -73.8 -49.2 14.3 39.6 98.3 1221 381 C Y H 3< S+ 0 0 18 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.835 107.5 56.3 -61.0 -36.3 17.9 38.5 97.3 1222 382 C R H 3< S+ 0 0 33 -4,-3.6 -1,-0.2 -5,-0.2 2,-0.2 0.694 85.0 104.3 -69.8 -20.7 19.5 41.6 98.7 1223 383 C T S << S- 0 0 4 -3,-0.9 2,-1.1 -4,-0.5 -28,-0.1 -0.456 73.9-132.4 -68.4 129.7 18.0 40.9 102.1 1224 384 C D + 0 0 39 -2,-0.2 4,-0.1 1,-0.2 -1,-0.1 -0.719 29.2 175.3 -83.9 101.0 20.5 39.5 104.7 1225 385 C V >> + 0 0 0 -2,-1.1 4,-2.0 1,-0.2 3,-0.9 0.249 44.9 111.6 -92.0 12.9 18.5 36.6 106.1 1226 386 C E H 3> S+ 0 0 45 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.863 72.7 59.1 -54.4 -38.7 21.4 35.4 108.3 1227 387 C P H 3> S+ 0 0 13 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.878 107.1 47.4 -60.3 -34.4 19.5 36.4 111.5 1228 388 C I H <> S+ 0 0 0 -3,-0.9 4,-2.6 2,-0.2 -2,-0.2 0.927 112.2 48.5 -70.7 -45.2 16.7 34.0 110.4 1229 389 C L H X S+ 0 0 1 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.907 115.1 45.5 -60.1 -44.1 19.1 31.2 109.7 1230 390 C A H X S+ 0 0 3 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.923 114.2 46.7 -67.1 -46.4 20.9 31.7 113.0 1231 391 C E H X S+ 0 0 14 -4,-2.3 4,-2.7 -5,-0.3 -2,-0.2 0.880 109.5 55.7 -63.7 -38.0 17.7 32.0 115.1 1232 392 C A H X S+ 0 0 0 -4,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.915 111.9 43.4 -60.1 -42.9 16.3 28.9 113.3 1233 393 C R H ><>S+ 0 0 1 -4,-1.8 5,-3.7 2,-0.2 3,-0.7 0.932 113.0 51.2 -67.6 -47.0 19.4 27.0 114.4 1234 394 C R H ><5S+ 0 0 102 -4,-2.9 3,-0.9 1,-0.2 -2,-0.2 0.888 110.7 49.2 -58.4 -41.0 19.3 28.4 117.9 1235 395 C R H 3<5S+ 0 0 103 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.690 113.0 47.2 -72.9 -19.9 15.6 27.5 118.4 1236 396 C T T <<5S- 0 0 45 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.2 0.200 126.3 -89.3-109.2 16.9 16.2 23.9 117.1 1237 397 C G T < 5S+ 0 0 39 -3,-0.9 -3,-0.2 -4,-0.2 -304,-0.1 0.552 90.2 119.7 90.7 7.9 19.2 23.0 119.2 1238 398 C G < - 0 0 0 -5,-3.7 2,-0.4 -6,-0.2 -1,-0.2 -0.167 66.6 -86.3 -93.8-169.7 21.8 24.2 116.6 1239 399 C A - 0 0 0 -308,-2.5 -5,-0.1 1,-0.1 -6,-0.1 -0.816 16.3-139.4-105.3 141.7 24.5 26.8 116.8 1240 400 C V S S+ 0 0 12 -2,-0.4 -1,-0.1 1,-0.3 -7,-0.1 0.918 108.0 21.1 -59.3 -45.9 24.1 30.5 116.2 1241 401 C D S > S- 0 0 40 1,-0.2 4,-2.3 -387,-0.1 -1,-0.3 -0.880 80.2-169.4-126.1 93.9 27.5 30.5 114.3 1242 402 C P H > S+ 0 0 4 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.916 83.6 43.4 -48.6 -60.8 28.1 26.8 113.3 1243 403 C V H > S+ 0 0 5 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.885 113.1 53.3 -59.0 -39.7 31.7 27.1 112.1 1244 404 C A H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.934 113.4 43.0 -60.6 -46.1 32.7 29.2 115.1 1245 405 C T H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.916 111.0 56.0 -65.4 -44.0 31.2 26.7 117.5 1246 406 C Y H X>S+ 0 0 3 -4,-3.1 5,-1.1 1,-0.2 4,-0.7 0.927 111.9 42.6 -54.0 -48.5 32.8 23.8 115.5 1247 407 C R H ><5S+ 0 0 97 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.898 111.4 53.9 -67.9 -39.5 36.2 25.4 115.9 1248 408 C A H 3<5S+ 0 0 55 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.803 104.6 57.0 -64.2 -28.3 35.6 26.3 119.6 1249 409 C S H 3<5S- 0 0 35 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.725 100.3-138.5 -74.7 -21.8 34.7 22.6 120.2 1250 410 C G T < + 0 0 3 -5,-1.1 4,-2.6 1,-0.2 5,-0.3 0.859 65.1 52.4 -58.2 -42.4 36.4 18.6 117.1 1252 412 C R H > S+ 0 0 38 -6,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.909 111.6 46.8 -63.0 -41.6 38.9 18.4 114.2 1253 413 C A H > S+ 0 0 70 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.886 111.6 54.9 -65.7 -37.7 41.8 18.1 116.6 1254 414 C R H >X S+ 0 0 92 -4,-2.1 3,-0.7 1,-0.2 4,-0.6 0.969 111.5 39.4 -59.8 -58.8 39.7 15.5 118.5 1255 415 C V H >X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 3,-0.6 0.807 108.6 63.8 -64.7 -27.9 39.1 13.1 115.7 1256 416 C A H 3< S+ 0 0 30 -4,-1.8 -343,-0.3 -5,-0.3 -1,-0.2 0.886 106.0 45.4 -61.9 -35.9 42.6 13.7 114.4 1257 417 C A H << S+ 0 0 90 -4,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.581 114.2 48.5 -82.6 -11.8 43.8 12.1 117.7 1258 418 C E H << S+ 0 0 112 -3,-0.6 -2,-0.2 -4,-0.6 -1,-0.2 0.498 109.7 59.3-103.3 -8.3 41.3 9.3 117.4 1259 419 C R S < S- 0 0 17 -4,-1.2 -346,-0.3 -3,-0.2 3,-0.1 -0.896 89.7 -94.8-125.3 154.0 42.1 8.4 113.8 1260 420 C P - 0 0 79 0, 0.0 -346,-0.4 0, 0.0 -347,-0.2 -0.131 47.5 -99.1 -59.1 156.8 45.2 7.3 111.8 1261 421 C A - 0 0 97 -348,-0.1 2,-0.2 -349,-0.1 -349,-0.1 -0.534 39.4-125.6 -78.3 145.7 47.3 9.9 110.0 1262 422 C S - 0 0 48 -351,-0.3 2,-0.3 -2,-0.2 -1,-0.1 -0.553 18.2-143.4 -92.6 159.5 46.7 10.3 106.3 1263 423 C V 0 0 124 -2,-0.2 -352,-0.0 1,-0.0 -1,-0.0 -0.855 360.0 360.0-122.1 157.1 49.2 10.0 103.5 1264 424 C A 0 0 73 -2,-0.3 -355,-0.1 -355,-0.1 -356,-0.1 0.008 360.0 360.0 -31.4 360.0 49.7 11.8 100.1 1265 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 1266 4 D F 0 0 166 0, 0.0 4,-0.1 0, 0.0 83,-0.1 0.000 360.0 360.0 360.0 110.5 64.5 -3.3 67.8 1267 5 D R + 0 0 29 1,-0.2 2,-0.5 114,-0.1 82,-0.1 0.883 360.0 48.6 -64.2 -37.5 61.3 -3.6 69.8 1268 6 D I S S- 0 0 2 81,-0.0 -1,-0.2 2,-0.0 5,-0.1 -0.921 103.0-109.7-107.7 121.5 59.4 -4.6 66.7 1269 7 D A >> - 0 0 43 -2,-0.5 4,-1.7 1,-0.2 3,-1.0 -0.209 20.3-136.4 -49.9 127.5 61.1 -7.4 64.6 1270 8 D Q H 3> S+ 0 0 118 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.838 103.5 60.4 -56.7 -34.6 62.4 -5.9 61.4 1271 9 D D H 3> S+ 0 0 88 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.826 105.0 49.0 -63.4 -32.4 61.1 -8.8 59.4 1272 10 D V H <> S+ 0 0 23 -3,-1.0 4,-2.6 2,-0.2 -1,-0.2 0.890 111.5 48.6 -74.1 -39.5 57.6 -7.9 60.6 1273 11 D V H X S+ 0 0 11 -4,-1.7 4,-1.4 2,-0.2 389,-0.3 0.942 115.0 44.3 -64.7 -47.0 58.1 -4.3 59.6 1274 12 D A H X S+ 0 0 46 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.902 113.4 52.3 -63.3 -41.4 59.4 -5.2 56.2 1275 13 D R H X S+ 0 0 126 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.932 111.9 44.1 -60.4 -49.2 56.6 -7.8 55.7 1276 14 D E H < S+ 0 0 14 -4,-2.6 4,-0.3 2,-0.2 -1,-0.2 0.699 113.8 51.5 -71.9 -19.9 53.8 -5.3 56.6 1277 15 D N H >X S+ 0 0 18 -4,-1.4 3,-1.5 -5,-0.2 4,-1.0 0.922 109.0 48.8 -79.8 -47.4 55.4 -2.7 54.4 1278 16 D D H 3X S+ 0 0 119 -4,-2.7 4,-0.5 1,-0.3 3,-0.4 0.848 103.9 62.4 -58.7 -34.9 55.7 -5.0 51.3 1279 17 D R H 3< S+ 0 0 154 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.747 118.3 27.2 -62.7 -23.6 52.1 -5.9 51.9 1280 18 D R H <> S+ 0 0 67 -3,-1.5 4,-2.1 -4,-0.3 -1,-0.2 0.362 91.9 102.2-120.1 1.9 51.1 -2.3 51.2 1281 19 D A H X S+ 0 0 38 -4,-1.0 4,-2.2 -3,-0.4 5,-0.2 0.875 80.3 51.1 -55.2 -45.6 54.0 -1.1 49.0 1282 20 D S H X S+ 0 0 90 -4,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.929 111.0 46.3 -61.6 -48.5 52.0 -1.3 45.7 1283 21 D A H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.903 112.2 52.0 -61.5 -41.8 49.0 0.7 46.9 1284 22 D L H X S+ 0 0 11 -4,-2.1 4,-3.4 2,-0.2 5,-0.3 0.902 107.0 52.2 -61.8 -43.3 51.3 3.3 48.4 1285 23 D K H X S+ 0 0 110 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.934 111.6 47.9 -58.7 -45.3 53.3 3.7 45.2 1286 24 D E H X S+ 0 0 85 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.935 116.0 42.6 -60.8 -49.4 49.9 4.3 43.4 1287 25 D D H X S+ 0 0 33 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.904 115.1 49.2 -65.7 -42.5 48.7 6.8 45.9 1288 26 D Y H X S+ 0 0 28 -4,-3.4 4,-2.6 -5,-0.2 -2,-0.2 0.911 112.6 47.6 -64.9 -42.3 52.0 8.6 46.2 1289 27 D E H X S+ 0 0 105 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.906 112.1 49.3 -66.0 -41.4 52.4 8.9 42.5 1290 28 D A H X S+ 0 0 33 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.946 114.4 44.6 -62.1 -48.8 48.8 10.2 42.0 1291 29 D L H X S+ 0 0 17 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.890 110.8 56.1 -62.1 -39.1 49.3 12.8 44.7 1292 30 D G H X S+ 0 0 13 -4,-2.6 4,-2.0 -5,-0.2 10,-0.3 0.926 109.7 44.5 -58.6 -45.6 52.6 13.6 43.2 1293 31 D A H X S+ 0 0 43 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.918 113.4 51.0 -64.7 -44.4 51.0 14.3 39.9 1294 32 D N H X S+ 0 0 25 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.930 112.1 45.7 -59.4 -47.2 48.2 16.3 41.5 1295 33 D L H <>S+ 0 0 0 -4,-3.1 5,-3.3 1,-0.2 -1,-0.2 0.858 109.1 57.0 -65.4 -33.6 50.7 18.4 43.5 1296 34 D A H ><5S+ 0 0 66 -4,-2.0 3,-1.5 -5,-0.3 -1,-0.2 0.891 104.0 52.3 -64.1 -38.4 52.7 18.9 40.3 1297 35 D R H 3<5S+ 0 0 100 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.790 109.5 50.5 -67.2 -25.9 49.7 20.3 38.6 1298 36 D R T 3<5S- 0 0 90 -4,-1.1 -1,-0.3 2,-0.2 -2,-0.2 0.299 124.8-105.5 -93.2 8.1 49.4 22.7 41.6 1299 37 D G T < 5S+ 0 0 71 -3,-1.5 2,-0.4 1,-0.2 -3,-0.2 0.776 79.8 127.0 74.7 28.3 53.0 23.7 41.2 1300 38 D V < - 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