==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 03-JUL-08 3DO9 . COMPND 2 MOLECULE: UPF0302 PROTEIN BA_1542/GBAA1542/BAS1430; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR Y.PATSKOVSKY,S.OZYURT,J.FREEMAN,M.IIZUKA,M.MALETIC,D.SMITH, . 520 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32145.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 366 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 6.0 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 . 3 0.6 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 . 37 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 213 41.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 1 0 3 0 1 0 2 4 0 0 4 1 0 0 0 0 0 0 0 0 0 0 1 1 0 1 0 RESIDUES PER ALPHA HELIX . 3 0 3 0 3 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 . 3 3 0 2 1 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 0 0 0 3 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 4 A P 0 0 180 0, 0.0 2,-0.4 0, 0.0 113,-0.0 0.000 360.0 360.0 360.0-111.6 36.0 19.9 99.4 2 5 A V - 0 0 41 110,-0.1 2,-0.2 4,-0.0 110,-0.1 -0.735 360.0-156.5-104.8 136.3 37.5 23.4 99.7 3 6 A S > - 0 0 46 -2,-0.4 4,-1.0 1,-0.1 5,-0.1 -0.491 26.2-114.1-104.2 173.8 40.1 24.6 102.2 4 7 A V H > S+ 0 0 15 2,-0.2 4,-2.7 1,-0.2 3,-0.3 0.905 113.0 49.6 -75.4 -46.8 41.1 28.0 103.7 5 8 A N H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.793 107.0 58.4 -63.3 -31.9 44.6 28.4 102.1 6 9 A E H > S+ 0 0 74 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.868 111.2 40.9 -62.6 -41.4 43.0 27.6 98.7 7 10 A K H X S+ 0 0 8 -4,-1.0 4,-2.1 -3,-0.3 -2,-0.2 0.896 114.4 52.2 -73.5 -44.3 40.7 30.6 99.1 8 11 A K H X S+ 0 0 55 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.899 113.2 43.5 -56.9 -47.6 43.4 32.8 100.5 9 12 A D H X S+ 0 0 97 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.759 109.4 58.4 -73.5 -27.7 45.8 32.1 97.6 10 13 A F H X S+ 0 0 4 -4,-1.0 4,-3.1 2,-0.2 -2,-0.2 0.921 108.8 43.8 -64.9 -46.7 42.9 32.5 95.1 11 14 A V H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.884 113.0 53.1 -64.6 -40.4 42.2 36.1 96.3 12 15 A K H X S+ 0 0 124 -4,-1.8 4,-0.7 -5,-0.2 -2,-0.2 0.863 114.4 42.3 -60.5 -39.7 45.9 36.7 96.3 13 16 A W H X S+ 0 0 55 -4,-2.0 4,-0.7 2,-0.2 3,-0.4 0.926 113.1 52.2 -69.9 -48.7 46.0 35.5 92.7 14 17 A F H >X S+ 0 0 1 -4,-3.1 4,-2.0 1,-0.2 3,-0.7 0.867 110.1 46.9 -58.5 -43.9 42.8 37.3 91.6 15 18 A L H 3< S+ 0 0 32 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.741 110.7 53.1 -72.4 -25.2 43.9 40.7 92.8 16 19 A N H 3< S+ 0 0 131 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.542 119.7 32.9 -85.6 -9.0 47.4 40.4 91.3 17 20 A N H << S+ 0 0 97 -3,-0.7 2,-0.4 -4,-0.7 -2,-0.2 0.620 116.0 49.5-119.4 -24.4 45.9 39.6 87.8 18 21 A Y < - 0 0 46 -4,-2.0 2,-0.7 -5,-0.2 -1,-0.2 -0.953 66.9-137.9-128.6 142.1 42.7 41.5 87.6 19 22 A Q - 0 0 122 -2,-0.4 41,-3.2 -3,-0.1 42,-0.2 -0.877 22.5-139.3-102.5 113.4 41.7 45.2 88.2 20 23 A L B -A 59 0A 9 -2,-0.7 39,-0.3 39,-0.3 6,-0.1 -0.385 11.3-130.3 -70.7 146.4 38.4 45.7 90.1 21 24 A K S S+ 0 0 74 37,-2.6 2,-0.4 45,-0.1 38,-0.1 0.872 95.2 47.2 -64.1 -42.0 36.1 48.5 89.0 22 25 A Q S > S- 0 0 59 36,-0.4 3,-0.9 44,-0.3 4,-0.5 -0.907 74.4-146.9-109.8 133.1 35.7 49.9 92.6 23 26 A R T >> S+ 0 0 69 -2,-0.4 4,-1.0 1,-0.2 3,-0.8 0.780 94.4 60.7 -69.8 -32.0 38.7 50.4 94.8 24 27 A E H 3> S+ 0 0 36 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.662 93.8 66.0 -73.3 -15.9 37.0 49.6 98.1 25 28 A C H <> S+ 0 0 1 -3,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.764 98.4 53.3 -72.2 -29.7 36.2 46.0 96.8 26 29 A V H <> S+ 0 0 25 -3,-0.8 4,-2.4 -4,-0.5 -2,-0.2 0.880 109.9 48.0 -66.6 -41.3 40.0 45.4 96.8 27 30 A W H X S+ 0 0 4 -4,-1.0 4,-1.3 2,-0.2 -2,-0.2 0.756 108.5 53.6 -74.1 -27.9 40.1 46.5 100.5 28 31 A I H X S+ 0 0 2 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.921 113.1 44.1 -65.8 -46.6 37.1 44.3 101.3 29 32 A L H X S+ 0 0 1 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.853 112.8 50.4 -67.0 -39.4 39.0 41.3 99.8 30 33 A N H X S+ 0 0 20 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.803 109.7 52.1 -68.1 -32.8 42.3 42.3 101.5 31 34 A Y H X S+ 0 0 5 -4,-1.3 4,-1.0 2,-0.2 -2,-0.2 0.898 110.9 47.0 -65.3 -44.9 40.4 42.5 104.8 32 35 A L H < S+ 0 0 0 -4,-1.9 7,-0.3 1,-0.2 6,-0.3 0.819 109.1 54.5 -69.7 -33.3 39.0 39.0 104.3 33 36 A M H < S+ 0 0 39 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.822 107.3 51.4 -65.2 -34.5 42.4 37.6 103.3 34 37 A S H < S+ 0 0 18 -4,-1.2 2,-0.8 1,-0.2 -2,-0.2 0.754 101.6 66.9 -74.4 -27.1 43.9 39.0 106.6 35 38 A H >X - 0 0 15 -4,-1.0 4,-1.4 1,-0.1 3,-1.1 -0.847 62.8-173.0-104.1 103.2 41.1 37.3 108.7 36 39 A D T 34 S+ 0 0 72 -2,-0.8 4,-0.3 1,-0.3 -1,-0.1 0.671 84.3 52.4 -74.0 -20.3 41.5 33.5 108.5 37 40 A Q T 34 S+ 0 0 78 2,-0.2 4,-0.3 1,-0.1 -1,-0.3 0.355 105.5 55.9 -97.2 5.2 38.3 32.7 110.4 38 41 A L T <> S+ 0 0 6 -3,-1.1 4,-1.0 -6,-0.3 3,-0.4 0.744 102.5 57.2 -85.0 -38.3 36.4 34.9 108.0 39 42 A M T < S+ 0 0 0 -4,-1.4 -2,-0.2 -7,-0.3 -3,-0.1 0.653 98.2 60.1 -67.6 -20.2 37.8 32.8 105.2 40 43 A H T 4 S+ 0 0 24 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.905 113.1 37.8 -63.1 -46.1 36.2 29.7 106.8 41 44 A K T 4 S+ 0 0 41 -3,-0.4 53,-1.4 -4,-0.3 2,-0.4 0.532 96.3 102.1 -86.9 -10.3 32.9 31.4 106.4 42 45 A V E < -b 94 0B 0 -4,-1.0 2,-0.4 51,-0.2 53,-0.2 -0.637 52.2-172.9 -76.7 127.7 33.8 32.9 103.0 43 46 A H E -b 95 0B 29 51,-2.5 53,-2.2 -2,-0.4 2,-0.5 -0.991 20.3-139.6-126.6 128.0 32.2 30.9 100.1 44 47 A F E +bc 96 113B 2 68,-0.6 70,-2.6 -2,-0.4 2,-0.3 -0.777 40.8 164.7 -89.4 126.2 33.0 31.5 96.4 45 48 A V - 0 0 1 51,-2.1 2,-0.5 -2,-0.5 3,-0.3 -0.900 41.1-125.0-145.5 151.0 29.7 31.2 94.5 46 49 A E S S+ 0 0 48 68,-0.4 70,-0.1 -2,-0.3 51,-0.0 -0.947 97.4 18.9-104.5 132.2 27.8 31.9 91.3 47 50 A H > + 0 0 85 -2,-0.5 3,-0.8 1,-0.1 -1,-0.2 0.976 69.0 174.2 72.6 66.2 24.6 33.8 91.7 48 51 A A G > + 0 0 0 -3,-0.3 3,-0.9 1,-0.2 22,-0.1 0.443 59.2 87.7 -84.2 0.6 25.3 35.3 95.1 49 52 A K G 3 S+ 0 0 117 1,-0.2 -1,-0.2 4,-0.1 5,-0.1 0.688 83.6 56.2 -72.6 -20.4 22.1 37.5 95.0 50 53 A Y G < S+ 0 0 75 -3,-0.8 -1,-0.2 3,-0.1 -2,-0.1 0.537 90.2 103.7 -84.3 -9.9 20.0 34.7 96.5 51 54 A C S X S- 0 0 6 -3,-0.9 3,-0.9 1,-0.1 44,-0.0 -0.511 78.0-126.4 -86.0 142.4 22.4 34.5 99.5 52 55 A P T 3 S+ 0 0 38 0, 0.0 20,-0.6 0, 0.0 21,-0.1 0.720 112.7 19.6 -49.3 -32.1 21.7 35.8 103.1 53 56 A R E 3 S+D 71 0B 8 18,-0.2 42,-2.7 -5,-0.1 2,-0.3 -0.551 90.8 173.7-141.6 74.1 25.0 37.8 102.9 54 57 A G E < -De 70 95B 0 16,-2.6 16,-3.7 -3,-0.9 2,-0.5 -0.675 15.8-164.7 -95.6 136.6 25.9 38.0 99.2 55 58 A L E -De 69 96B 4 40,-3.9 42,-2.9 -2,-0.3 2,-0.5 -0.972 2.7-171.7-122.6 121.9 28.7 40.0 97.7 56 59 A V E +De 68 97B 12 12,-2.8 12,-1.7 -2,-0.5 2,-0.4 -0.968 12.2 171.4-117.0 121.2 28.9 40.8 94.0 57 60 A M E -De 67 98B 0 40,-1.8 42,-2.6 -2,-0.5 2,-0.4 -0.987 12.6-157.6-135.4 142.1 32.1 42.4 92.6 58 61 A S E - e 0 99B 1 8,-1.5 -37,-2.6 -2,-0.4 -36,-0.4 -0.940 11.3-136.9-127.9 138.2 33.4 43.1 89.1 59 62 A A B -A 20 0A 0 40,-2.9 -39,-0.3 -2,-0.4 5,-0.3 -0.458 36.6-106.1 -81.0 162.3 36.7 43.6 87.3 60 63 A N S S+ 0 0 70 -41,-3.2 -40,-0.1 1,-0.2 40,-0.1 0.480 109.4 68.6 -73.3 -3.6 37.1 46.4 84.8 61 64 A C S S+ 0 0 36 -42,-0.2 -1,-0.2 38,-0.2 2,-0.2 0.972 94.8 51.8 -75.9 -62.7 37.1 44.0 81.8 62 65 A V S S- 0 0 42 37,-0.3 37,-0.1 -3,-0.2 39,-0.1 -0.515 86.3-126.1 -77.8 147.5 33.5 42.8 81.9 63 66 A K + 0 0 166 -2,-0.2 2,-0.1 2,-0.0 -1,-0.1 0.037 63.8 129.9 -88.3 27.0 30.7 45.5 82.0 64 67 A D S S- 0 0 72 -5,-0.3 -6,-0.1 1,-0.1 35,-0.0 -0.441 72.4 -81.1 -74.5 155.3 29.0 44.1 85.1 65 68 A T - 0 0 75 -2,-0.1 -1,-0.1 1,-0.1 34,-0.1 -0.336 38.1-127.1 -61.7 135.4 28.2 46.5 87.9 66 69 A P S S+ 0 0 43 0, 0.0 -8,-1.5 0, 0.0 2,-0.3 0.829 79.9 10.0 -54.4 -45.8 31.1 47.2 90.3 67 70 A F E +D 57 0B 3 -10,-0.2 2,-0.3 -46,-0.1 -10,-0.2 -0.998 52.6 166.5-146.7 139.5 29.5 46.4 93.7 68 71 A H E -D 56 0B 51 -12,-1.7 -12,-2.8 -2,-0.3 2,-0.5 -0.959 12.9-163.4-146.5 134.4 26.4 44.8 95.2 69 72 A F E -DF 55 76B 4 7,-2.8 7,-1.5 -2,-0.3 2,-0.8 -0.970 6.9-163.8-118.8 118.4 25.8 43.7 98.8 70 73 A F E +DF 54 75B 29 -16,-3.7 -16,-2.6 -2,-0.5 5,-0.2 -0.763 14.9 170.3-107.1 86.1 22.8 41.4 99.4 71 74 A K E -D 53 0B 66 3,-1.4 -18,-0.2 -2,-0.8 -2,-0.0 -0.373 54.7 -86.8 -79.0 172.9 21.8 41.2 103.0 72 75 A Q S S+ 0 0 160 -20,-0.6 -19,-0.1 1,-0.2 3,-0.1 0.743 121.9 12.5 -56.4 -31.4 18.5 39.5 104.0 73 76 A N S S+ 0 0 163 -21,-0.1 2,-0.3 1,-0.1 -1,-0.2 0.603 121.5 58.2-119.5 -20.7 16.3 42.5 103.5 74 77 A V - 0 0 94 2,-0.0 -3,-1.4 0, 0.0 2,-0.4 -0.868 51.6-158.9-119.4 147.5 18.4 45.1 101.7 75 78 A M E -F 70 0B 145 -2,-0.3 -5,-0.2 -5,-0.2 2,-0.2 -0.771 29.5-177.0-119.1 84.1 20.3 45.3 98.4 76 79 A T E -F 69 0B 41 -7,-1.5 -7,-2.8 -2,-0.4 -2,-0.0 -0.532 25.8-168.1 -86.7 147.7 22.9 48.1 98.9 77 80 A T + 0 0 94 -9,-0.2 2,-0.6 -2,-0.2 -1,-0.1 0.531 59.8 103.4-106.5 -13.9 25.3 49.4 96.3 78 81 A D > - 0 0 82 1,-0.2 4,-1.3 -9,-0.1 5,-0.1 -0.631 50.7-168.7 -76.7 116.3 27.5 51.5 98.7 79 82 A A H > S+ 0 0 0 -2,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.781 81.2 58.5 -77.3 -29.2 30.7 49.6 99.4 80 83 A E H > S+ 0 0 104 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.874 109.4 42.4 -69.5 -41.8 31.9 51.8 102.3 81 84 A K H > S+ 0 0 116 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.873 115.7 50.7 -70.6 -38.6 28.8 51.1 104.4 82 85 A S H X S+ 0 0 2 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.842 110.6 48.6 -66.7 -36.8 28.9 47.4 103.5 83 86 A F H X S+ 0 0 11 -4,-2.1 4,-1.1 2,-0.2 -1,-0.2 0.860 110.6 51.4 -69.5 -38.3 32.6 47.2 104.5 84 87 A H H X S+ 0 0 96 -4,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.775 113.5 46.4 -66.7 -28.1 31.7 49.0 107.8 85 88 A D H >X S+ 0 0 58 -4,-1.4 4,-2.4 2,-0.2 3,-0.6 0.900 110.2 48.1 -84.6 -41.6 29.0 46.4 108.3 86 89 A I H 3X S+ 0 0 3 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.696 103.7 67.3 -70.3 -20.3 30.9 43.2 107.5 87 90 A R H 3< S+ 0 0 25 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.880 116.5 22.6 -56.5 -45.3 33.6 44.6 109.8 88 91 A L H << S+ 0 0 112 -3,-0.6 3,-0.3 -4,-0.6 -2,-0.2 0.731 112.7 67.4 -97.7 -29.4 31.3 44.2 112.7 89 92 A N H < + 0 0 57 -4,-2.4 2,-0.8 1,-0.2 3,-0.2 0.815 67.4 145.1 -78.6 -33.1 28.9 41.5 111.6 90 93 A R < + 0 0 101 -4,-1.0 -1,-0.2 1,-0.2 2,-0.2 -0.119 43.8 68.0 63.2 -90.9 31.5 38.8 111.5 91 94 A D S S+ 0 0 110 -2,-0.8 2,-0.2 -3,-0.3 -1,-0.2 0.279 82.5 89.0 -79.2 11.8 30.2 35.5 112.6 92 95 A E S S- 0 0 103 -2,-0.2 2,-0.2 -3,-0.2 -51,-0.1 -0.682 84.7 -97.9 -99.1 157.9 27.9 34.9 109.5 93 96 A D - 0 0 68 -2,-0.2 2,-0.4 -51,-0.1 -51,-0.2 -0.525 33.5-150.3 -71.0 137.5 28.8 33.3 106.2 94 97 A I E -b 42 0B 1 -53,-1.4 -51,-2.5 -56,-0.3 2,-0.6 -0.936 2.2-155.0-111.3 136.5 29.7 35.6 103.3 95 98 A Y E -be 43 54B 19 -42,-2.7 -40,-3.9 -2,-0.4 2,-0.4 -0.926 15.0-171.7-116.0 109.4 29.0 34.6 99.7 96 99 A I E -be 44 55B 1 -53,-2.2 -51,-2.1 -2,-0.6 2,-0.4 -0.849 9.3-173.0-107.6 130.7 31.3 36.3 97.1 97 100 A Q E - e 0 56B 32 -42,-2.9 -40,-1.8 -2,-0.4 2,-0.4 -0.927 11.4-151.8-112.1 148.1 31.0 36.2 93.3 98 101 A L E - e 0 57B 3 -2,-0.4 2,-0.8 -53,-0.2 -40,-0.2 -0.977 3.7-154.1-121.6 131.5 33.6 37.7 91.0 99 102 A N E + e 0 58B 25 -42,-2.6 -40,-2.9 -2,-0.4 -37,-0.3 -0.830 34.5 148.0-106.1 94.5 32.9 39.0 87.5 100 103 A F - 0 0 3 -2,-0.8 -2,-0.1 -42,-0.2 -82,-0.0 -0.927 52.7-111.9-131.4 157.1 36.1 38.8 85.4 101 104 A K S S+ 0 0 133 -2,-0.3 3,-0.2 1,-0.2 -1,-0.1 0.854 109.2 31.0 -59.6 -49.6 36.7 38.2 81.7 102 105 A S S > S+ 0 0 15 1,-0.2 3,-1.6 2,-0.1 -1,-0.2 0.764 76.4 143.7 -89.9 -28.0 38.2 34.8 81.5 103 106 A S G > S+ 0 0 23 1,-0.3 3,-2.1 2,-0.2 6,-0.2 0.101 72.3 38.6 36.1 -94.0 36.5 33.3 84.6 104 107 A F G 3 S+ 0 0 8 1,-0.3 36,-0.5 -3,-0.2 -1,-0.3 0.192 102.9 72.8 -83.6 19.3 36.0 29.7 83.4 105 108 A Q G < S+ 0 0 67 -3,-1.6 2,-0.6 34,-0.2 -1,-0.3 0.629 85.2 77.7 -89.6 -22.7 39.3 29.6 81.7 106 109 A N X> - 0 0 17 -3,-2.1 4,-1.5 -4,-0.2 3,-0.7 -0.813 66.2-158.0-100.9 116.5 41.1 29.4 85.0 107 110 A A H 3> S+ 0 0 61 -2,-0.6 4,-2.0 1,-0.2 -1,-0.1 0.791 91.4 57.3 -59.9 -36.5 41.1 26.0 86.8 108 111 A N H 3> S+ 0 0 62 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.811 105.2 50.3 -65.1 -35.4 41.8 27.6 90.3 109 112 A Y H <> S+ 0 0 6 -3,-0.7 4,-0.7 -6,-0.2 -1,-0.2 0.865 112.8 46.7 -69.5 -38.3 38.6 29.8 90.1 110 113 A V H < S+ 0 0 25 -4,-1.5 -2,-0.2 -7,-0.2 3,-0.2 0.832 112.3 51.5 -72.1 -31.9 36.5 26.7 89.1 111 114 A A H < S+ 0 0 54 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.823 108.1 51.3 -69.9 -33.4 38.2 24.8 92.0 112 115 A V H < S+ 0 0 1 -4,-1.5 -68,-0.6 -5,-0.1 -1,-0.2 0.640 88.6 105.5 -81.6 -14.9 37.4 27.5 94.5 113 116 A L B < -c 44 0B 18 -4,-0.7 2,-0.3 -3,-0.2 -68,-0.2 -0.373 54.3-162.8 -68.5 143.4 33.7 27.6 93.5 114 117 A E - 0 0 52 -70,-2.6 2,-0.5 -2,-0.1 -68,-0.4 -0.821 29.9 -83.7-127.0 162.4 31.2 26.0 95.9 115 118 A E - 0 0 127 -2,-0.3 -70,-0.0 -70,-0.1 14,-0.0 -0.569 38.3-148.5 -67.7 114.9 27.6 24.7 95.8 116 119 A N > - 0 0 7 -2,-0.5 3,-0.9 -70,-0.1 2,-0.1 -0.811 8.2-165.0 -87.4 110.2 25.2 27.7 96.4 117 120 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.062 73.6 74.9 -92.8 34.0 22.2 26.3 98.3 118 121 A Y T 3 + 0 0 97 -71,-0.1 -2,-0.0 -2,-0.1 -71,-0.0 0.279 60.3 116.6-127.5 3.0 19.9 29.2 97.7 119 122 A L < - 0 0 23 -3,-0.9 -72,-0.0 1,-0.1 0, 0.0 -0.588 46.6-171.1 -61.5 135.3 19.1 28.5 94.1 120 123 A P - 0 0 81 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.924 56.1 -24.3-101.8 -59.1 15.4 27.8 94.0 121 124 A K S > S+ 0 0 138 2,-0.1 3,-1.2 3,-0.0 -2,-0.1 0.710 117.2 75.3-125.5 -92.6 13.9 26.5 90.8 122 125 A H T 3 S+ 0 0 65 1,-0.3 -3,-0.0 2,-0.1 0, 0.0 0.292 70.7 94.8 51.1 -57.5 15.9 27.4 88.2 123 126 A I T 3 + 0 0 63 1,-0.2 -1,-0.3 -2,-0.0 -2,-0.1 0.968 39.0 143.7 -48.5 -73.5 18.4 24.7 89.3 124 127 A E < + 0 0 175 -3,-1.2 2,-0.4 1,-0.1 -1,-0.2 0.579 48.7 89.1 48.9 8.2 17.0 22.2 86.8 125 128 A V > + 0 0 51 1,-0.0 3,-0.9 0, 0.0 -1,-0.1 -0.859 48.7 175.2-129.2 98.1 20.5 21.0 86.3 126 129 A N T 3 S+ 0 0 153 -2,-0.4 -2,-0.1 1,-0.2 -3,-0.0 0.125 82.9 58.2 -88.5 23.9 21.2 18.3 88.9 127 130 A E T 3> + 0 0 93 2,-0.1 4,-1.1 4,-0.0 3,-0.4 -0.160 62.7 121.3-133.1 34.2 24.5 17.8 87.2 128 131 A K T <4 S+ 0 0 63 -3,-0.9 -2,-0.1 1,-0.2 5,-0.1 0.709 74.2 61.2 -69.9 -21.3 25.7 21.4 87.6 129 132 A D T 4 S+ 0 0 130 1,-0.2 3,-0.3 2,-0.2 4,-0.3 0.818 110.8 39.2 -64.0 -36.5 28.6 19.7 89.5 130 133 A R T 4 S+ 0 0 192 -3,-0.4 4,-0.3 1,-0.2 -2,-0.2 0.526 115.3 51.6 -96.6 -10.5 29.4 18.0 86.2 131 134 A L S < S+ 0 0 64 -4,-1.1 4,-0.5 2,-0.2 -1,-0.2 0.013 84.1 77.4-121.9 30.8 28.7 20.9 83.9 132 135 A L S > S+ 0 0 45 -3,-0.3 4,-1.7 2,-0.1 -2,-0.1 0.689 99.6 55.4 -75.3 -38.1 30.8 23.6 85.5 133 136 A A H > S+ 0 0 54 -4,-0.3 4,-3.0 2,-0.2 -2,-0.2 0.854 99.0 57.2 -53.2 -47.9 33.2 21.4 83.6 134 137 A E H > S+ 0 0 103 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.900 113.1 39.2 -54.2 -47.5 31.4 21.8 80.2 135 138 A R H > S+ 0 0 90 -4,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.748 113.6 55.6 -78.4 -27.2 31.7 25.6 80.4 136 139 A F H X S+ 0 0 60 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.925 111.5 44.4 -66.3 -48.4 35.3 25.4 81.8 137 140 A L H X S+ 0 0 115 -4,-3.0 4,-2.7 2,-0.2 5,-0.3 0.948 113.2 50.7 -55.4 -56.1 36.3 23.2 78.8 138 141 A E H X S+ 0 0 87 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.857 115.1 43.2 -52.7 -43.8 34.5 25.5 76.3 139 142 A E H X S+ 0 0 35 -4,-1.9 4,-2.9 -35,-0.3 5,-0.2 0.878 113.8 48.5 -73.3 -41.8 36.2 28.6 77.8 140 143 A S H X S+ 0 0 34 -4,-2.6 4,-1.6 -36,-0.5 -2,-0.2 0.850 117.2 43.7 -67.5 -36.2 39.7 27.1 78.0 141 144 A V H X S+ 0 0 61 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.915 115.8 48.2 -70.7 -46.7 39.4 25.8 74.5 142 145 A F H X S+ 0 0 27 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.938 114.4 45.0 -57.1 -53.3 37.9 29.1 73.2 143 146 A S H X S+ 0 0 6 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.881 113.0 50.7 -62.3 -42.9 40.5 31.3 74.9 144 147 A F H X S+ 0 0 136 -4,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.946 111.4 46.5 -60.3 -52.7 43.5 29.1 73.8 145 148 A R H X S+ 0 0 143 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.879 116.1 47.0 -57.5 -40.2 42.4 29.1 70.1 146 149 A R H X S+ 0 0 79 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.894 113.2 47.2 -66.2 -44.3 41.9 32.9 70.4 147 150 A E H X S+ 0 0 122 -4,-3.1 4,-1.0 2,-0.2 -2,-0.2 0.845 114.8 48.4 -63.8 -37.1 45.3 33.3 72.1 148 151 A R H X S+ 0 0 93 -4,-3.0 4,-1.6 -5,-0.2 3,-0.3 0.936 113.9 45.7 -66.1 -50.4 46.8 31.1 69.4 149 152 A L H X S+ 0 0 20 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.930 111.6 50.9 -57.1 -51.5 45.0 33.1 66.6 150 153 A L H X S+ 0 0 35 -4,-3.0 4,-0.9 1,-0.2 -1,-0.2 0.707 107.7 54.9 -63.7 -24.3 46.0 36.5 68.0 151 154 A K H X S+ 0 0 126 -4,-1.0 4,-1.3 -3,-0.3 -1,-0.2 0.915 108.5 46.8 -70.8 -45.8 49.6 35.4 68.3 152 155 A Q H X S+ 0 0 70 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.777 105.2 59.2 -71.1 -31.3 49.8 34.4 64.6 153 156 A I H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.903 107.9 46.6 -61.1 -43.8 48.2 37.7 63.3 154 157 A D H X S+ 0 0 65 -4,-0.9 4,-1.1 2,-0.2 -2,-0.2 0.796 112.1 50.6 -69.6 -31.8 51.0 39.7 65.0 155 158 A E H X S+ 0 0 66 -4,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.791 110.8 49.5 -72.4 -32.5 53.6 37.3 63.5 156 159 A A H <>S+ 0 0 7 -4,-1.8 5,-2.1 2,-0.2 4,-0.2 0.834 110.0 49.9 -74.5 -36.0 51.9 37.8 60.0 157 160 A L H <5S+ 0 0 12 -4,-2.0 3,-0.3 3,-0.2 -2,-0.2 0.772 108.9 54.9 -69.8 -29.3 52.0 41.6 60.5 158 161 A D H <5S+ 0 0 110 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.870 114.2 38.1 -66.7 -40.8 55.7 41.2 61.4 159 162 A K T <5S- 0 0 144 -4,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.279 109.9-118.5 -99.1 8.5 56.5 39.3 58.2 160 163 A Q T 5 + 0 0 114 -3,-0.3 2,-1.6 -4,-0.2 -3,-0.2 0.699 55.2 160.7 59.0 25.9 54.2 41.4 55.9 161 164 A D >< + 0 0 74 -5,-2.1 4,-1.9 1,-0.2 -1,-0.2 -0.614 12.5 174.4 -79.7 87.4 52.1 38.3 55.1 162 165 A K H > S+ 0 0 110 -2,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.789 75.1 64.5 -67.2 -33.2 49.0 40.1 53.9 163 166 A E H > S+ 0 0 133 2,-0.2 4,-1.4 -3,-0.2 3,-0.3 0.979 107.3 36.9 -40.2 -72.4 47.7 36.6 53.0 164 167 A A H > S+ 0 0 9 1,-0.2 4,-3.9 2,-0.2 5,-0.3 0.829 108.1 64.6 -62.4 -39.8 47.6 35.2 56.5 165 168 A F H X S+ 0 0 11 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.934 110.5 37.3 -48.1 -56.1 46.5 38.5 58.2 166 169 A H H X S+ 0 0 100 -4,-1.6 4,-1.2 -3,-0.3 -1,-0.2 0.738 117.3 52.8 -71.4 -27.5 43.1 38.4 56.3 167 170 A R H X S+ 0 0 132 -4,-1.4 4,-1.4 -5,-0.2 -2,-0.2 0.967 116.3 38.4 -65.6 -54.3 42.9 34.6 56.6 168 171 A L H X S+ 0 0 15 -4,-3.9 4,-1.9 2,-0.2 -2,-0.2 0.757 112.5 55.6 -72.9 -30.6 43.5 34.7 60.4 169 172 A T H X S+ 0 0 10 -4,-2.4 4,-1.4 -5,-0.3 -1,-0.2 0.930 114.2 41.2 -65.6 -45.8 41.3 37.9 61.1 170 173 A A H X S+ 0 0 57 -4,-1.2 4,-0.9 1,-0.2 -2,-0.2 0.738 111.8 58.1 -72.0 -26.0 38.4 36.2 59.4 171 174 A E H X S+ 0 0 102 -4,-1.4 4,-0.7 2,-0.2 3,-0.2 0.886 108.7 43.7 -67.0 -42.5 39.3 32.9 61.1 172 175 A L H X S+ 0 0 0 -4,-1.9 4,-1.0 1,-0.2 3,-0.2 0.774 105.6 62.8 -75.8 -28.1 39.0 34.5 64.6 173 176 A K H < S+ 0 0 107 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.809 100.9 54.2 -63.0 -33.4 35.7 36.3 63.6 174 177 A M H < S+ 0 0 107 -4,-0.9 3,-0.4 -3,-0.2 -1,-0.2 0.821 100.2 63.2 -66.7 -35.4 34.2 32.9 63.1 175 178 A L H >< S+ 0 0 22 -4,-0.7 3,-1.2 1,-0.2 -2,-0.2 0.891 100.0 45.5 -64.1 -49.7 35.1 31.8 66.7 176 179 A E G >< S+ 0 0 69 -4,-1.0 3,-1.6 1,-0.2 -1,-0.2 0.623 92.6 83.4 -75.7 -9.7 33.1 34.2 68.9 177 180 A G G 3 S+ 0 0 60 -3,-0.4 -1,-0.2 -4,-0.4 -2,-0.2 0.662 103.8 31.7 -63.0 -17.8 30.0 33.6 66.7 178 181 A H G < 0 0 141 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 -0.077 360.0 360.0-128.1 31.1 29.4 30.5 68.8 179 182 A H < 0 0 121 -3,-1.6 -3,-0.1 -37,-0.0 -40,-0.1 -0.474 360.0 360.0 -74.7 360.0 30.8 31.7 72.1 180 !* 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 0.0 181 3 B T 0 0 184 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-140.1 66.4 66.6 70.7 182 4 B P - 0 0 112 0, 0.0 2,-0.4 0, 0.0 113,-0.0 -0.699 360.0-100.2 -90.9 176.8 64.7 65.7 67.4 183 5 B V - 0 0 39 -2,-0.3 2,-0.1 110,-0.1 110,-0.1 -0.769 28.7-147.7-107.4 136.0 63.3 62.2 67.3 184 6 B S > - 0 0 53 -2,-0.4 4,-0.9 1,-0.1 -1,-0.0 -0.451 23.3-116.3 -95.0 169.2 64.7 59.0 65.7 185 7 B V H > S+ 0 0 29 2,-0.2 4,-2.5 1,-0.2 3,-0.3 0.897 112.3 49.8 -72.5 -46.0 63.0 56.0 64.0 186 8 B N H > S+ 0 0 117 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.801 106.6 57.8 -64.0 -33.2 64.2 53.3 66.5 187 9 B E H > S+ 0 0 68 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.828 110.6 43.2 -64.5 -36.1 63.0 55.5 69.4 188 10 B K H X S+ 0 0 9 -4,-0.9 4,-1.8 -3,-0.3 -2,-0.2 0.901 113.2 51.0 -75.0 -45.1 59.5 55.5 67.8 189 11 B K H X S+ 0 0 57 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.890 112.3 46.0 -58.1 -46.0 59.5 51.7 67.0 190 12 B D H X S+ 0 0 101 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.774 108.7 57.1 -71.2 -29.7 60.5 50.8 70.5 191 13 B F H X S+ 0 0 4 -4,-0.9 4,-1.4 2,-0.2 -1,-0.2 0.870 107.6 46.8 -67.0 -40.1 57.9 53.1 72.0 192 14 B V H X S+ 0 0 1 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.861 110.6 56.0 -69.2 -34.3 55.1 51.3 70.0 193 15 B K H X S+ 0 0 116 -4,-1.5 4,-1.1 1,-0.2 -2,-0.2 0.951 111.0 38.9 -61.8 -55.4 56.5 48.0 71.2 194 16 B W H X S+ 0 0 51 -4,-2.0 4,-0.7 1,-0.2 5,-0.2 0.809 111.9 59.6 -67.2 -31.5 56.4 48.6 75.0 195 17 B F H X S+ 0 0 1 -4,-1.4 4,-2.2 1,-0.2 3,-0.4 0.880 109.3 41.7 -67.0 -41.0 53.1 50.5 74.7 196 18 B L H < S+ 0 0 37 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.728 115.0 53.4 -75.3 -23.9 51.3 47.4 73.3 197 19 B N H < S+ 0 0 118 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.536 121.9 28.2 -86.8 -9.3 53.2 45.2 75.8 198 20 B N H < S+ 0 0 103 -4,-0.7 2,-0.4 -3,-0.4 -2,-0.2 0.601 116.8 53.8-122.3 -24.2 52.0 47.3 78.8 199 21 B Y < - 0 0 43 -4,-2.2 2,-0.6 -5,-0.2 -1,-0.2 -0.950 65.7-140.9-125.2 138.6 48.7 48.8 77.7 200 22 B Q - 0 0 126 -2,-0.4 41,-3.0 -3,-0.1 42,-0.2 -0.858 22.5-140.3 -98.6 116.2 45.5 47.2 76.4 201 23 B L B -G 240 0C 9 -2,-0.6 39,-0.3 39,-0.3 6,-0.1 -0.404 10.3-131.6 -74.1 150.4 43.7 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-1,-0.2 0.926 108.0 47.0 -64.1 -46.8 46.7 50.6 103.0 333 157 B D H X S+ 0 0 58 -4,-1.3 4,-1.4 1,-0.2 -2,-0.2 0.767 111.9 51.6 -67.2 -28.7 47.1 46.9 102.1 334 158 B E H X S+ 0 0 100 -4,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.851 109.5 49.3 -71.4 -39.4 49.8 46.7 104.8 335 159 B A H X>S+ 0 0 8 -4,-1.9 5,-2.8 2,-0.2 4,-1.1 0.797 111.6 49.0 -69.9 -31.9 47.4 48.2 107.3 336 160 B L H <5S+ 0 0 6 -4,-1.9 -2,-0.2 3,-0.2 -1,-0.2 0.842 112.4 48.9 -72.0 -36.2 44.8 45.7 106.3 337 161 B D H <5S+ 0 0 121 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.2 0.888 116.9 40.4 -67.8 -43.1 47.4 42.9 106.6 338 162 B K H <5S- 0 0 155 -4,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.723 110.5-123.1 -75.8 -23.8 48.4 44.1 110.1 339 163 B Q T <5 + 0 0 111 -4,-1.1 2,-0.6 1,-0.2 -3,-0.2 0.957 53.4 156.1 67.4 61.8 44.8 44.9 111.1 340 164 B D >< + 0 0 51 -5,-2.8 4,-2.1 1,-0.1 -1,-0.2 -0.874 16.2 177.4-116.6 92.3 45.4 48.6 112.0 341 165 B K H > S+ 0 0 90 -2,-0.6 4,-2.1 1,-0.2 5,-0.2 0.821 81.3 55.7 -66.6 -34.9 41.9 50.2 111.6 342 166 B E H > S+ 0 0 167 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.875 111.0 44.6 -62.1 -41.4 43.3 53.6 112.8 343 167 B A H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.848 109.6 56.3 -72.4 -37.1 45.9 53.4 110.0 344 168 B F H X S+ 0 0 9 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.953 111.0 42.4 -58.7 -52.2 43.4 52.3 107.4 345 169 B H H X S+ 0 0 99 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.692 114.7 53.6 -70.5 -21.7 41.1 55.3 108.0 346 170 B R H X S+ 0 0 142 -4,-0.9 4,-1.6 -5,-0.2 -2,-0.2 0.951 114.2 38.1 -69.9 -55.9 44.2 57.6 108.1 347 171 B L H X S+ 0 0 7 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.760 115.1 54.2 -72.5 -28.8 45.7 56.5 104.8 348 172 B T H X S+ 0 0 15 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.905 112.2 44.1 -69.2 -42.9 42.2 56.2 103.1 349 173 B A H X S+ 0 0 46 -4,-1.0 4,-1.1 -5,-0.2 -2,-0.2 0.774 113.4 53.8 -70.8 -27.7 41.5 59.8 104.1 350 174 B E H X S+ 0 0 93 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.916 110.9 43.1 -68.4 -47.4 45.0 60.8 103.0 351 175 B L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.850 107.8 59.6 -71.1 -35.5 44.7 59.3 99.5 352 176 B K H X S+ 0 0 110 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.878 112.0 41.1 -58.9 -39.6 41.2 60.7 99.0 353 177 B M H < S+ 0 0 126 -4,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.851 111.8 56.9 -70.9 -39.0 42.7 64.2 99.6 354 178 B L H >< S+ 0 0 37 -4,-1.9 3,-0.5 1,-0.2 -2,-0.2 0.854 113.8 37.6 -64.7 -39.7 45.7 63.3 97.4 355 179 B E H >< S+ 0 0 56 -4,-2.6 3,-1.6 1,-0.2 -1,-0.2 0.819 109.3 62.7 -79.5 -34.7 43.6 62.4 94.4 356 180 B G T 3< S+ 0 0 61 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.229 100.9 55.7 -76.0 15.1 41.1 65.2 95.0 357 181 B H T < 0 0 164 -3,-0.5 -1,-0.3 -5,-0.0 -2,-0.1 0.118 360.0 360.0-128.3 13.9 44.0 67.7 94.5 358 182 B H < 0 0 123 -3,-1.6 -3,-0.1 -37,-0.0 -40,-0.0 -0.269 360.0 360.0-143.1 360.0 45.0 66.5 91.1 359 !* 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 0.0 360 4 C P 0 0 178 0, 0.0 2,-0.3 0, 0.0 113,-0.0 0.000 360.0 360.0 360.0-122.7 27.7 24.8 129.5 361 5 C V - 0 0 39 110,-0.1 2,-0.2 1,-0.0 110,-0.1 -0.659 360.0-155.1 -96.0 133.7 30.9 25.2 127.5 362 6 C S > - 0 0 53 -2,-0.3 4,-1.1 1,-0.1 5,-0.1 -0.494 25.5-114.8-103.1 171.3 31.4 27.6 124.5 363 7 C V H > S+ 0 0 32 2,-0.2 4,-2.6 1,-0.2 3,-0.2 0.902 114.5 49.0 -70.9 -46.7 33.6 27.7 121.5 364 8 C N H > S+ 0 0 119 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.770 107.6 57.4 -65.5 -29.8 35.6 30.9 122.4 365 9 C E H > S+ 0 0 74 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.853 111.6 41.2 -66.5 -39.8 36.1 29.4 125.9 366 10 C K H X S+ 0 0 8 -4,-1.1 4,-2.0 -3,-0.2 -2,-0.2 0.888 113.9 52.5 -74.9 -43.6 37.8 26.4 124.3 367 11 C K H X S+ 0 0 39 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.897 111.8 44.9 -57.4 -47.5 39.8 28.5 121.7 368 12 C D H X S+ 0 0 105 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.762 109.5 56.9 -72.7 -28.3 41.2 30.8 124.3 369 13 C F H X S+ 0 0 6 -4,-0.9 4,-2.8 2,-0.2 -2,-0.2 0.908 109.1 45.0 -66.4 -45.1 42.1 27.9 126.6 370 14 C V H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.892 113.4 51.0 -64.6 -42.0 44.2 26.2 123.8 371 15 C K H X S+ 0 0 118 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.859 114.3 44.3 -62.8 -38.5 45.8 29.6 123.0 372 16 C W H >X S+ 0 0 61 -4,-1.9 4,-0.6 2,-0.2 3,-0.5 0.913 111.7 52.9 -68.9 -46.1 46.6 30.0 126.7 373 17 C F H >X S+ 0 0 1 -4,-2.8 4,-2.2 1,-0.2 3,-0.6 0.856 109.2 47.8 -60.3 -41.4 47.9 26.4 127.1 374 18 C L H 3< S+ 0 0 35 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.686 110.9 52.5 -75.2 -20.0 50.4 26.7 124.2 375 19 C N H << S+ 0 0 121 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.497 121.3 29.9 -92.3 -6.5 51.7 30.0 125.5 376 20 C N H << S+ 0 0 101 -3,-0.6 2,-0.4 -4,-0.6 -2,-0.2 0.597 116.1 52.9-123.8 -24.9 52.4 28.7 129.0 377 21 C Y < - 0 0 42 -4,-2.2 2,-0.7 -5,-0.2 -1,-0.2 -0.957 66.7-141.1-124.8 137.5 53.2 25.0 128.6 378 22 C Q - 0 0 124 -2,-0.4 41,-2.9 -3,-0.1 42,-0.2 -0.859 22.9-137.2 -98.8 113.7 55.7 23.2 126.3 379 23 C L B -M 418 0E 8 -2,-0.7 39,-0.3 39,-0.3 6,-0.1 -0.386 9.5-131.3 -69.9 145.4 54.4 20.0 124.8 380 24 C K S S+ 0 0 72 37,-2.7 2,-0.5 45,-0.1 38,-0.1 0.878 95.4 47.4 -63.2 -42.5 56.7 16.9 124.7 381 25 C Q S > S- 0 0 55 36,-0.5 3,-0.7 44,-0.3 4,-0.5 -0.905 73.5-149.4-109.3 132.6 55.9 16.2 121.1 382 26 C R T >> S+ 0 0 165 -2,-0.5 4,-0.9 1,-0.2 3,-0.6 0.761 93.7 60.7 -72.9 -30.0 56.1 19.0 118.5 383 27 C E H 3> S+ 0 0 35 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.696 94.9 65.0 -72.4 -18.9 53.4 17.7 116.1 384 28 C C H <> S+ 0 0 1 -3,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.760 97.8 54.3 -71.6 -29.8 50.9 17.8 119.0 385 29 C V H <> S+ 0 0 28 -3,-0.6 4,-2.6 -4,-0.5 -1,-0.2 0.870 109.1 48.9 -64.6 -39.4 51.3 21.6 119.0 386 30 C W H X S+ 0 0 118 -4,-0.9 4,-1.3 2,-0.2 -2,-0.2 0.747 107.2 54.0 -76.4 -27.4 50.4 21.5 115.2 387 31 C I H X S+ 0 0 1 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.917 113.6 43.5 -65.5 -46.1 47.4 19.3 116.0 388 32 C L H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.867 111.2 52.6 -67.5 -41.4 46.2 22.0 118.4 389 33 C N H X S+ 0 0 76 -4,-2.6 4,-1.0 2,-0.2 -1,-0.2 0.816 110.7 49.3 -64.1 -34.5 47.0 24.9 116.1 390 34 C Y H X S+ 0 0 16 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.888 113.5 45.9 -66.0 -44.5 45.0 23.2 113.4 391 35 C L H < S+ 0 0 0 -4,-1.8 7,-0.2 1,-0.2 -2,-0.2 0.816 110.3 52.9 -71.4 -32.5 42.1 22.7 115.8 392 36 C M H < S+ 0 0 39 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.766 108.3 52.6 -73.1 -29.0 42.3 26.3 117.1 393 37 C S H < S+ 0 0 43 -4,-1.0 2,-0.8 -5,-0.2 -2,-0.2 0.974 101.7 63.7 -65.4 -56.2 42.1 27.5 113.5 394 38 C H X - 0 0 22 -4,-1.9 4,-1.2 1,-0.2 3,-0.3 -0.603 56.4-179.0 -83.3 106.6 39.0 25.5 112.6 395 39 C D H > S+ 0 0 18 -2,-0.8 4,-0.7 2,-0.2 -1,-0.2 0.554 83.5 65.7 -79.7 -10.1 36.0 26.7 114.7 396 40 C Q H 4 S+ 0 0 117 2,-0.2 -1,-0.2 1,-0.1 3,-0.2 0.817 106.7 42.6 -73.5 -35.5 33.8 24.0 113.0 397 41 C L H >> S+ 0 0 1 -3,-0.3 3,-1.7 1,-0.2 4,-0.8 0.816 102.4 71.0 -73.6 -33.9 36.1 21.5 114.7 398 42 C M H 3< S+ 0 0 1 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.708 95.2 50.7 -68.5 -25.4 36.0 23.5 118.0 399 43 C H T 3< S+ 0 0 116 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.1 -0.170 111.5 48.2-102.8 43.8 32.4 22.6 118.8 400 44 C K T <4 S+ 0 0 63 -3,-1.7 53,-1.5 53,-0.1 2,-0.4 0.141 95.1 95.4-134.5 -9.4 33.1 19.0 118.3 401 45 C V E < -n 453 0F 0 -4,-0.8 2,-0.4 51,-0.2 53,-0.2 -0.694 55.9-172.3 -83.3 131.8 36.2 19.2 120.5 402 46 C H E -n 454 0F 33 51,-2.2 53,-2.5 -2,-0.4 2,-0.5 -0.996 20.0-138.4-129.3 131.7 35.7 18.2 124.2 403 47 C F E -no 455 472F 2 68,-0.6 70,-2.8 -2,-0.4 2,-0.3 -0.794 37.6-178.5 -92.5 127.0 38.2 18.6 127.0 404 48 C V - 0 0 1 51,-2.3 3,-0.3 -2,-0.5 53,-0.3 -0.849 41.3-136.2-138.8 149.9 38.1 15.5 129.1 405 49 C E S S+ 0 0 47 68,-0.5 2,-0.5 -2,-0.3 -1,-0.1 0.968 102.7 19.0 -68.6 -58.8 39.4 13.7 132.2 406 50 C H > + 0 0 89 1,-0.1 3,-0.7 69,-0.0 -1,-0.2 -0.878 65.7 171.6-122.9 97.6 39.9 10.2 130.8 407 51 C A G > + 0 0 0 -2,-0.5 3,-1.3 -3,-0.3 22,-0.1 0.550 62.3 81.9 -85.9 -9.6 40.0 10.3 126.9 408 52 C K G 3 S+ 0 0 117 1,-0.3 -1,-0.2 5,-0.1 5,-0.1 0.670 87.4 57.5 -71.6 -17.2 41.1 6.6 126.4 409 53 C Y G < S+ 0 0 92 -3,-0.7 -1,-0.3 3,-0.1 -2,-0.1 0.466 91.3 101.0 -87.9 -3.5 37.5 5.4 126.7 410 54 C C S X S- 0 0 8 -3,-1.3 3,-0.8 44,-0.1 -3,-0.0 -0.453 80.2-122.7 -91.4 153.2 36.3 7.7 123.9 411 55 C P T 3 S+ 0 0 43 0, 0.0 20,-0.4 0, 0.0 2,-0.2 0.861 114.8 18.6 -56.7 -41.1 35.5 6.9 120.2 412 56 C R T 3 S+ 0 0 5 40,-0.2 42,-3.0 18,-0.2 2,-0.4 -0.653 88.7 175.3-131.2 77.1 38.1 9.5 119.1 413 57 C G E < -Pq 429 454F 0 16,-2.3 16,-3.5 -3,-0.8 2,-0.5 -0.704 12.7-164.7 -90.8 130.9 40.3 10.1 122.2 414 58 C L E -Pq 428 455F 2 40,-3.9 42,-2.8 -2,-0.4 2,-0.5 -0.960 3.5-171.9-117.2 124.2 43.4 12.3 122.0 415 59 C V E +Pq 427 456F 12 12,-2.6 12,-2.0 -2,-0.5 2,-0.3 -0.970 12.1 166.8-120.4 119.0 46.0 12.1 124.8 416 60 C M E -Pq 426 457F 0 40,-2.2 42,-2.2 -2,-0.5 2,-0.4 -0.972 14.2-158.0-134.1 147.9 48.8 14.7 124.8 417 61 C S E - q 0 458F 1 8,-1.6 -37,-2.7 -2,-0.3 -36,-0.5 -0.965 11.8-134.3-133.7 141.1 51.4 15.7 127.5 418 62 C A B -M 379 0E 0 40,-3.2 -39,-0.3 -2,-0.4 5,-0.3 -0.393 36.8-104.8 -81.4 166.8 53.6 18.6 128.4 419 63 C N S S+ 0 0 98 -41,-2.9 -40,-0.1 1,-0.2 40,-0.1 0.341 108.0 69.0 -79.9 6.8 57.3 18.2 129.3 420 64 C C S S+ 0 0 49 38,-0.2 -1,-0.2 -42,-0.2 2,-0.2 0.929 93.9 50.9 -87.5 -58.7 56.8 18.7 133.0 421 65 C V S S- 0 0 37 37,-0.3 37,-0.1 -3,-0.2 39,-0.1 -0.523 87.2-122.7 -79.1 152.0 54.9 15.6 134.0 422 66 C K + 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