==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 03-NOV-10 3PHC . COMPND 2 MOLECULE: PURINE NUCLEOSIDE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR M.HO,A.A.EDWARDS,S.C.ALMO,V.L.SCHRAMM . 1458 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48396.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1087 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 202 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 180 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 12 0.8 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 . 99 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 142 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 385 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 2.1 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 6 6 0 5 0 4 3 6 6 0 0 0 0 0 3 2 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 6 12 0 0 0 10 2 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 . 9 12 0 6 0 6 6 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 0 0 0 0 0 4 2 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 3 A N 0 0 189 0, 0.0 9,-0.6 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 19.1 8.1 31.3 -25.8 2 4 A L B -A 9 0A 104 7,-0.1 7,-0.2 1,-0.1 2,-0.2 -0.559 360.0-106.9 -94.6 150.2 5.2 28.9 -26.1 3 5 A L > - 0 0 16 5,-2.7 4,-1.6 -2,-0.2 -1,-0.1 -0.518 36.6-119.7 -68.3 142.7 3.8 26.4 -23.6 4 6 A R T 4 S+ 0 0 43 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 0.791 100.9 15.8 -58.6 -40.2 4.7 22.9 -24.7 5 7 A H T 4 S+ 0 0 10 66,-0.2 40,-0.2 3,-0.1 37,-0.2 0.760 128.2 47.5-108.8 -33.8 1.2 21.4 -25.2 6 8 A L T 4 S- 0 0 0 65,-0.1 41,-0.2 2,-0.1 -2,-0.2 0.747 86.9-151.1 -79.5 -24.9 -1.2 24.4 -25.3 7 9 A K < + 0 0 63 -4,-1.6 2,-0.3 1,-0.2 -3,-0.1 0.836 56.7 112.0 56.0 36.3 1.1 26.2 -27.8 8 10 A I - 0 0 1 32,-0.1 -5,-2.7 -5,-0.1 -1,-0.2 -0.845 69.4-105.7-124.9 166.0 0.0 29.6 -26.5 9 11 A S B > -A 2 0A 17 -2,-0.3 3,-1.3 -7,-0.2 4,-0.2 -0.551 23.7-114.0 -91.7 160.4 2.1 32.2 -24.6 10 12 A K G > S+ 0 0 115 -9,-0.6 3,-1.3 1,-0.2 -1,-0.1 0.806 116.3 62.7 -53.2 -35.7 2.0 33.1 -20.9 11 13 A E G 3 S+ 0 0 146 1,-0.3 -1,-0.2 69,-0.0 69,-0.0 0.668 98.3 56.2 -69.0 -19.4 0.8 36.5 -21.9 12 14 A Q G < S+ 0 0 68 -3,-1.3 2,-0.5 2,-0.1 -1,-0.3 0.445 81.9 105.4 -92.1 -5.2 -2.4 35.0 -23.5 13 15 A I < - 0 0 18 -3,-1.3 4,-0.1 -4,-0.2 36,-0.0 -0.706 60.3-152.2 -81.7 120.1 -3.4 33.2 -20.2 14 16 A T - 0 0 10 -2,-0.5 68,-0.2 2,-0.2 43,-0.1 -0.475 26.5-112.0 -85.0 158.4 -6.3 34.9 -18.5 15 17 A P S S+ 0 0 51 0, 0.0 67,-2.9 0, 0.0 68,-2.4 0.885 107.2 50.0 -55.6 -37.8 -7.0 34.9 -14.8 16 18 A V E -b 83 0B 0 40,-0.4 42,-1.3 66,-0.2 2,-0.4 -0.883 69.2-179.0-108.1 133.7 -10.1 32.8 -15.5 17 19 A V E -bc 84 58B 0 66,-2.6 68,-2.2 -2,-0.4 2,-0.6 -0.998 16.0-154.6-132.0 129.4 -10.1 29.6 -17.6 18 20 A L E -bc 85 59B 0 40,-2.9 42,-2.2 -2,-0.4 2,-0.3 -0.914 19.7-165.6 -99.2 116.1 -12.9 27.3 -18.6 19 21 A V E +bc 86 60B 0 66,-2.5 68,-2.5 -2,-0.6 2,-0.3 -0.784 10.3 177.0-105.4 148.3 -11.7 23.8 -19.4 20 22 A V E - c 0 61B 0 40,-1.6 42,-2.6 -2,-0.3 43,-0.5 -0.946 32.0-128.8-142.3 159.8 -13.6 21.0 -21.1 21 23 A G S S+ 0 0 3 66,-0.4 42,-1.4 -2,-0.3 -1,-0.1 0.931 88.9 65.0 -76.9 -44.0 -12.7 17.4 -22.2 22 24 A D >> - 0 0 26 1,-0.1 3,-0.9 40,-0.1 4,-0.8 -0.678 66.2-151.8 -92.0 120.8 -13.8 17.5 -25.8 23 25 A P H >> S+ 0 0 2 0, 0.0 4,-0.8 0, 0.0 3,-0.6 0.833 100.1 61.0 -56.4 -31.7 -12.1 19.9 -28.3 24 26 A G H 3> S+ 0 0 29 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.828 94.8 61.4 -62.0 -34.4 -15.4 20.0 -30.2 25 27 A R H <> S+ 0 0 7 -3,-0.9 4,-2.1 1,-0.2 -1,-0.2 0.806 94.0 63.2 -65.8 -29.8 -17.1 21.4 -27.1 26 28 A V H X S+ 0 0 2 -4,-2.1 3,-2.5 1,-0.2 4,-0.9 0.949 108.1 56.1 -67.1 -50.8 -19.1 27.3 -26.2 30 32 A K H 3< S+ 0 0 18 -4,-2.7 3,-0.3 1,-0.3 21,-0.2 0.770 102.1 56.1 -58.6 -27.7 -17.3 30.0 -28.3 31 33 A V T 3< S+ 0 0 102 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.459 103.1 56.7 -84.7 0.2 -20.3 30.6 -30.6 32 34 A V T <4 S+ 0 0 58 -3,-2.5 -1,-0.2 -4,-0.1 -2,-0.2 0.637 94.2 85.7 -98.1 -22.0 -22.4 31.3 -27.5 33 35 A C S < S- 0 0 15 -4,-0.9 19,-0.2 -3,-0.3 3,-0.1 -0.167 93.8-108.5 -73.4 170.6 -20.1 34.1 -26.4 34 36 A D S S- 0 0 110 17,-2.2 2,-0.3 1,-0.3 18,-0.2 0.874 95.4 -25.5 -68.7 -39.5 -20.2 37.8 -27.5 35 37 A S E -D 51 0B 61 16,-1.2 16,-2.3 2,-0.0 2,-0.3 -0.952 64.9-158.5-157.6 170.1 -17.1 37.2 -29.6 36 38 A Y E -D 50 0B 95 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.941 12.2-143.3-142.6 170.4 -14.0 34.9 -29.5 37 39 A V E -D 49 0B 69 12,-1.7 12,-2.8 -2,-0.3 2,-0.2 -0.957 23.0-133.5-133.9 117.5 -10.4 34.7 -30.8 38 40 A D E +D 48 0B 93 -2,-0.4 10,-0.2 10,-0.2 3,-0.1 -0.505 29.7 174.2 -63.0 134.5 -9.1 31.3 -31.9 39 41 A L E - 0 0 45 8,-2.4 2,-0.3 1,-0.4 9,-0.2 0.810 47.9 -26.6-112.6 -55.4 -5.6 30.8 -30.4 40 42 A A E -D 47 0B 22 7,-1.4 7,-2.4 2,-0.0 -1,-0.4 -0.983 35.0-158.6-159.5 158.9 -4.1 27.4 -31.0 41 43 A Y E +D 46 0B 101 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.762 26.7 157.4-147.0 99.4 -5.0 23.8 -31.6 42 44 A N E > -D 45 0B 34 3,-2.0 3,-2.3 -2,-0.2 -2,-0.0 -0.990 66.4 -37.5-126.1 130.1 -2.2 21.3 -30.8 43 45 A R T 3 S- 0 0 35 -2,-0.4 223,-0.1 1,-0.3 20,-0.1 -0.287 123.9 -28.4 50.6-134.6 -3.0 17.6 -30.1 44 46 A E T 3 S+ 0 0 0 18,-0.1 2,-0.9 -3,-0.1 19,-0.4 0.364 116.5 102.6 -89.1 4.3 -6.3 17.5 -28.1 45 47 A Y E < +D 42 0B 0 -3,-2.3 -3,-2.0 -40,-0.2 2,-0.5 -0.810 46.7 177.6 -97.7 103.4 -5.8 20.9 -26.6 46 48 A K E -D 41 0B 28 -2,-0.9 15,-2.0 -5,-0.2 2,-0.4 -0.939 9.1-164.9-105.5 125.0 -7.9 23.6 -28.3 47 49 A S E +DE 40 60B 1 -7,-2.4 -8,-2.4 -2,-0.5 -7,-1.4 -0.945 12.2 169.8-116.4 132.7 -7.6 27.1 -26.9 48 50 A V E -DE 38 59B 0 11,-2.6 11,-2.8 -2,-0.4 2,-0.6 -0.978 31.4-128.9-135.3 145.3 -10.0 30.0 -27.6 49 51 A E E -DE 37 58B 33 -12,-2.8 -12,-1.7 -2,-0.3 2,-0.3 -0.886 29.7-154.3 -95.2 120.5 -10.3 33.5 -25.9 50 52 A C E -DE 36 57B 0 7,-2.9 7,-2.1 -2,-0.6 2,-0.5 -0.749 9.6-159.7 -98.2 141.6 -13.9 34.0 -25.0 51 53 A H E +DE 35 56B 48 -16,-2.3 -17,-2.2 -2,-0.3 -16,-1.2 -0.987 24.7 160.9-118.8 124.1 -15.6 37.4 -24.6 52 54 A Y E > - E 0 55B 19 3,-2.4 3,-1.8 -2,-0.5 -19,-0.1 -0.927 61.1 -16.2-155.3 121.8 -18.7 37.4 -22.5 53 55 A K T 3 S- 0 0 138 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.886 127.9 -50.2 50.7 44.3 -20.7 40.0 -20.7 54 56 A G T 3 S+ 0 0 76 1,-0.3 -1,-0.3 186,-0.0 2,-0.2 0.384 117.4 109.6 82.7 -1.4 -17.8 42.4 -20.9 55 57 A Q E < - E 0 52B 38 -3,-1.8 -3,-2.4 2,-0.0 2,-0.4 -0.678 57.0-140.9-109.3 163.1 -15.2 39.9 -19.5 56 58 A K E + E 0 51B 116 -2,-0.2 -40,-0.4 -5,-0.2 2,-0.3 -0.984 31.8 147.4-126.0 120.9 -12.3 38.0 -21.1 57 59 A F E - E 0 50B 0 -7,-2.1 -7,-2.9 -2,-0.4 -40,-0.2 -0.988 40.4-109.6-151.3 149.9 -11.4 34.4 -20.3 58 60 A L E -cE 17 49B 0 -42,-1.3 -40,-2.9 -2,-0.3 2,-0.4 -0.400 15.6-157.8 -73.8 149.9 -9.8 31.3 -22.0 59 61 A C E +cE 18 48B 0 -11,-2.8 -11,-2.6 -42,-0.2 2,-0.4 -0.997 23.0 174.0-121.4 125.2 -11.7 28.2 -22.9 60 62 A V E -cE 19 47B 0 -42,-2.2 -40,-1.6 -2,-0.4 2,-0.3 -0.998 27.5-134.1-135.4 134.2 -9.3 25.2 -23.4 61 63 A S E -c 20 0B 0 -15,-2.0 -40,-0.2 -2,-0.4 -39,-0.1 -0.656 13.6-170.6 -85.1 144.3 -9.9 21.5 -24.0 62 64 A H - 0 0 0 -42,-2.6 10,-0.2 -2,-0.3 -41,-0.2 0.453 33.2-128.7-114.5 -5.1 -7.9 19.1 -21.8 63 65 A G - 0 0 0 -42,-1.4 2,-0.4 -43,-0.5 -1,-0.2 -0.018 41.1 -44.0 79.2 174.6 -8.6 15.7 -23.4 64 66 A V S S+ 0 0 4 -43,-0.1 248,-0.4 4,-0.1 4,-0.3 -0.653 100.3 18.4 -79.7 124.6 -9.8 12.4 -22.0 65 67 A G S > S- 0 0 0 -2,-0.4 4,-2.2 246,-0.2 5,-0.2 0.279 81.9 -85.9 99.7 149.9 -8.2 11.2 -18.8 66 68 A S H > S+ 0 0 0 115,-0.5 4,-2.0 1,-0.2 -1,-0.1 0.791 116.0 53.0 -61.1 -41.7 -6.1 12.4 -15.8 67 69 A A H > S+ 0 0 0 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.953 115.3 40.6 -64.2 -47.3 -2.6 12.2 -17.2 68 70 A G H > S+ 0 0 0 240,-0.5 4,-1.1 -4,-0.3 3,-0.2 0.853 115.5 49.9 -68.4 -37.7 -3.4 14.2 -20.3 69 71 A C H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.834 103.0 63.4 -69.5 -30.9 -5.6 16.8 -18.5 70 72 A A H X S+ 0 0 5 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.841 99.2 52.1 -62.4 -35.2 -2.8 17.3 -15.9 71 73 A V H X S+ 0 0 2 -4,-1.0 4,-2.1 -3,-0.2 -1,-0.2 0.918 111.4 48.1 -69.4 -39.3 -0.4 18.6 -18.5 72 74 A C H X S+ 0 0 0 -4,-1.1 4,-2.3 -10,-0.2 -2,-0.2 0.933 113.9 46.2 -58.2 -50.5 -3.0 21.1 -19.6 73 75 A F H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 -2,-0.2 0.878 111.9 50.6 -66.6 -39.4 -3.8 22.2 -15.9 74 76 A E H X S+ 0 0 6 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.928 109.7 50.2 -63.3 -45.3 -0.1 22.5 -15.0 75 77 A E H < S+ 0 0 5 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.926 116.4 42.7 -61.2 -42.8 0.6 24.7 -18.0 76 78 A L H ><>S+ 0 0 0 -4,-2.3 5,-2.1 1,-0.2 3,-1.0 0.941 115.7 47.7 -63.2 -49.1 -2.3 26.9 -17.0 77 79 A C H 3<5S+ 0 0 12 -4,-3.2 3,-0.5 1,-0.3 -2,-0.2 0.793 113.4 45.6 -68.7 -32.6 -1.6 26.9 -13.3 78 80 A Q T 3<5S+ 0 0 89 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.456 112.2 53.3 -91.1 -1.6 2.1 27.8 -13.5 79 81 A N T < 5S- 0 0 43 -3,-1.0 -66,-0.2 -4,-0.4 -1,-0.2 0.195 129.1 -67.8-122.3 17.3 1.5 30.5 -16.1 80 82 A G T 5S+ 0 0 36 -3,-0.5 -3,-0.2 1,-0.3 -4,-0.1 0.258 78.0 139.3 126.4 -14.0 -1.1 32.8 -14.5 81 83 A A < + 0 0 3 -5,-2.1 -1,-0.3 1,-0.2 -65,-0.2 -0.405 18.4 175.3 -63.5 137.7 -4.5 31.1 -14.2 82 84 A K + 0 0 107 -67,-2.9 114,-3.1 1,-0.3 2,-0.4 0.628 69.1 32.4-110.2 -31.2 -6.2 31.9 -10.9 83 85 A V E -bf 16 196B 0 -68,-2.4 -66,-2.6 112,-0.2 2,-0.5 -0.996 62.0-175.8-133.9 125.7 -9.5 30.2 -11.5 84 86 A I E -bf 17 197B 0 112,-2.7 114,-1.5 -2,-0.4 2,-0.5 -0.983 3.3-171.3-123.3 121.6 -10.2 27.0 -13.5 85 87 A I E -bf 18 198B 0 -68,-2.2 -66,-2.5 -2,-0.5 2,-0.5 -0.950 10.9-151.3-110.2 121.8 -13.7 25.7 -14.0 86 88 A R E -bf 19 199B 5 112,-2.5 114,-2.5 -2,-0.5 2,-0.6 -0.799 8.3-170.4 -87.6 126.8 -14.2 22.3 -15.6 87 89 A A E + f 0 200B 2 -68,-2.5 -66,-0.4 -2,-0.5 114,-0.2 -0.938 32.7 142.5-117.1 106.6 -17.5 21.9 -17.5 88 90 A G E - f 0 201B 0 112,-2.8 114,-1.7 -2,-0.6 2,-0.2 -0.487 48.2-102.2-129.5-171.4 -17.7 18.3 -18.3 89 91 A S E + f 0 202B 19 112,-0.3 2,-0.3 -2,-0.2 114,-0.2 -0.679 35.7 179.4-109.5 174.6 -19.9 15.2 -18.7 90 92 A C E - f 0 203B 4 112,-2.0 114,-3.3 -2,-0.2 115,-0.5 -0.973 27.8-112.5-163.6 166.1 -20.3 12.4 -16.2 91 93 A G E -Gf 179 205B 7 88,-2.6 88,-2.1 -2,-0.3 2,-0.4 -0.761 39.5-111.3-101.9 156.5 -22.1 9.1 -15.5 92 94 A S E -G 178 0B 1 113,-2.7 116,-0.5 -2,-0.3 86,-0.2 -0.753 24.8-175.7 -92.6 136.7 -24.7 8.8 -12.7 93 95 A L S S+ 0 0 0 84,-2.5 85,-0.2 -2,-0.4 82,-0.1 0.230 85.8 54.6-107.4 7.6 -23.9 6.8 -9.6 94 96 A Q >> + 0 0 50 83,-0.4 4,-3.4 4,-0.2 3,-2.5 -0.543 65.2 170.8-134.8 65.5 -27.4 7.4 -8.2 95 97 A P T 34 S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.733 75.6 58.3 -59.7 -24.8 -29.6 6.2 -11.1 96 98 A D T 34 S+ 0 0 147 1,-0.1 3,-0.1 -3,-0.1 -2,-0.0 0.732 124.8 20.8 -69.3 -24.5 -32.8 6.4 -9.0 97 99 A L T <4 S+ 0 0 111 -3,-2.5 2,-0.6 1,-0.2 -1,-0.1 0.778 119.5 53.3-113.1 -43.6 -32.1 10.1 -8.4 98 100 A I < - 0 0 7 -4,-3.4 -4,-0.2 79,-0.1 2,-0.2 -0.884 68.6-172.7-111.6 116.2 -29.8 11.5 -11.1 99 101 A K > - 0 0 118 -2,-0.6 3,-2.5 1,-0.1 104,-0.3 -0.667 37.3 -73.8-109.7 158.6 -30.7 10.9 -14.7 100 102 A R T 3 S+ 0 0 107 1,-0.3 104,-0.2 -2,-0.2 -1,-0.1 -0.176 121.0 27.6 -40.8 130.8 -29.2 11.4 -18.2 101 103 A G T 3 S+ 0 0 4 102,-2.5 -1,-0.3 1,-0.3 103,-0.1 0.040 90.9 127.2 97.8 -26.1 -29.3 15.1 -18.9 102 104 A D < - 0 0 41 -3,-2.5 101,-2.5 100,-0.1 2,-0.4 -0.175 54.2-129.2 -66.7 156.4 -29.1 16.3 -15.3 103 105 A I E -H 202 0B 1 43,-0.4 45,-3.4 99,-0.2 2,-0.4 -0.918 18.9-167.5-113.9 131.3 -26.5 18.8 -14.1 104 106 A C E -Hi 201 148B 0 97,-2.4 97,-2.3 -2,-0.4 2,-0.6 -0.976 10.3-158.5-119.2 132.7 -24.2 18.3 -11.1 105 107 A I E -Hi 200 149B 0 43,-3.0 45,-0.9 -2,-0.4 2,-0.4 -0.959 23.7-155.4-106.6 115.0 -22.1 21.0 -9.4 106 108 A C E -Hi 199 150B 2 93,-1.5 93,-0.6 -2,-0.6 45,-0.2 -0.766 25.7-176.7-105.8 136.1 -19.4 19.1 -7.5 107 109 A N E S+ 0 0 15 43,-1.0 21,-4.0 -2,-0.4 2,-0.3 0.650 73.8 13.7 -97.5 -22.2 -17.4 20.3 -4.5 108 110 A A E -Ji 127 151B 0 42,-0.6 44,-2.1 19,-0.3 2,-0.3 -0.943 64.1-150.6-152.2 165.4 -15.0 17.4 -4.0 109 111 A A E -Ji 126 152B 0 17,-2.5 17,-0.6 -2,-0.3 2,-0.4 -0.992 23.2-112.0-147.6 151.6 -13.8 14.2 -5.8 110 112 A V E - i 0 153B 0 42,-2.6 2,-1.9 -2,-0.3 44,-1.7 -0.723 32.8-133.1 -81.2 127.3 -12.5 10.7 -5.3 111 113 A R E + i 0 154B 1 1232,-2.7 2,-0.5 -2,-0.4 44,-0.1 -0.405 47.6 149.2 -84.9 64.0 -8.8 10.5 -6.4 112 114 A E E + i 0 155B 3 -2,-1.9 44,-2.3 42,-1.3 45,-0.2 -0.227 49.1 87.1 -91.7 46.3 -8.8 7.3 -8.5 113 115 A D S S- 0 0 0 -2,-0.5 69,-0.0 42,-0.2 244,-0.0 -0.416 73.2-133.2-115.1-164.3 -6.0 8.5 -10.8 114 116 A R S > S+ 0 0 38 -2,-0.2 4,-1.3 286,-0.1 3,-0.4 0.596 91.7 67.7-118.1 -39.5 -2.2 8.3 -10.5 115 117 A V H >> S+ 0 0 5 1,-0.3 4,-0.8 2,-0.2 3,-0.6 0.871 97.7 52.4 -58.1 -42.7 -0.9 11.8 -11.2 116 118 A S H >> S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 3,-0.9 0.907 109.3 52.5 -56.9 -39.9 -2.4 13.4 -8.1 117 119 A H H 34 S+ 0 0 43 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.735 104.8 54.0 -70.1 -22.9 -0.7 10.7 -6.0 118 120 A L H << S+ 0 0 19 -4,-1.3 287,-0.3 -3,-0.6 -1,-0.3 0.599 115.8 42.0 -82.2 -12.4 2.7 11.5 -7.8 119 121 A L H << S+ 0 0 1 -3,-0.9 289,-0.4 -4,-0.8 2,-0.3 0.782 129.7 1.0 -98.7 -40.2 2.1 15.1 -6.6 120 122 A I S < S- 0 0 0 -4,-2.9 -1,-0.3 -5,-0.1 68,-0.0 -0.996 86.5 -80.7-152.6 150.6 0.8 14.6 -3.1 121 123 A H > - 0 0 27 -2,-0.3 3,-1.9 1,-0.1 -3,-0.1 -0.100 44.2-113.8 -52.0 146.0 0.1 11.7 -0.6 122 124 A G T 3 S+ 0 0 22 1,-0.3 -11,-0.2 -5,-0.1 -1,-0.1 0.716 110.2 69.4 -53.7 -30.2 -3.3 9.9 -1.1 123 125 A D T 3 S+ 0 0 16 1207,-0.1 1208,-2.6 2,-0.1 -1,-0.3 0.656 77.2 101.4 -64.9 -20.1 -4.7 11.1 2.2 124 126 A F S < S- 0 0 2 -3,-1.9 2,-0.2 1206,-0.2 1206,-0.1 -0.457 78.2-117.8 -69.0 135.9 -4.9 14.7 0.8 125 127 A P - 0 0 2 0, 0.0 2,-0.9 0, 0.0 -15,-0.1 -0.537 5.0-138.0 -82.1 141.2 -8.4 15.7 -0.3 126 128 A A E +J 109 0B 0 -17,-0.6 -17,-2.5 1217,-0.2 2,-0.4 -0.883 46.1 159.3 -90.1 102.7 -9.5 16.6 -3.8 127 129 A V E -J 108 0B 7 -2,-0.9 -19,-0.3 -19,-0.3 70,-0.1 -0.984 34.1-135.7-131.6 136.8 -11.7 19.5 -2.9 128 130 A G - 0 0 4 -21,-4.0 2,-0.4 -2,-0.4 70,-0.2 -0.452 38.2 -88.3 -84.7 166.3 -12.9 22.5 -5.0 129 131 A D > - 0 0 35 68,-2.0 4,-2.3 -2,-0.1 3,-0.4 -0.626 28.3-136.9 -77.6 128.3 -12.9 26.1 -3.9 130 132 A F H > S+ 0 0 22 -2,-0.4 4,-3.6 1,-0.2 5,-0.2 0.825 102.1 55.2 -51.0 -43.4 -16.1 27.1 -2.1 131 133 A D H > S+ 0 0 72 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.901 110.1 45.2 -58.5 -45.6 -16.3 30.5 -3.9 132 134 A V H > S+ 0 0 0 -3,-0.4 4,-2.2 65,-0.2 -2,-0.2 0.922 116.2 47.1 -63.0 -42.2 -16.2 28.8 -7.3 133 135 A Y H X S+ 0 0 32 -4,-2.3 4,-2.1 64,-0.3 -2,-0.2 0.943 112.4 50.2 -63.6 -48.3 -18.8 26.2 -6.1 134 136 A D H X S+ 0 0 33 -4,-3.6 4,-2.4 1,-0.2 -2,-0.2 0.901 111.2 47.8 -58.3 -45.7 -21.0 29.0 -4.6 135 137 A T H X S+ 0 0 15 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.884 109.0 53.1 -70.4 -33.7 -21.0 31.1 -7.8 136 138 A L H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.914 112.8 45.5 -60.5 -42.3 -21.8 28.0 -10.0 137 139 A N H X S+ 0 0 31 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.887 112.1 51.6 -66.7 -41.5 -24.8 27.4 -7.7 138 140 A K H X S+ 0 0 95 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.897 109.9 48.1 -62.8 -44.3 -25.8 31.0 -7.7 139 141 A C H X S+ 0 0 6 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.915 109.2 54.5 -62.9 -41.0 -25.8 31.2 -11.6 140 142 A A H <>S+ 0 0 1 -4,-1.9 5,-3.8 1,-0.2 -1,-0.2 0.859 111.3 43.5 -59.9 -41.4 -27.8 28.0 -11.9 141 143 A Q H ><5S+ 0 0 132 -4,-1.7 3,-0.7 3,-0.2 -1,-0.2 0.818 111.8 54.1 -75.5 -32.2 -30.6 29.4 -9.6 142 144 A E H 3<5S+ 0 0 109 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.870 112.6 43.8 -66.5 -35.9 -30.5 32.7 -11.4 143 145 A L T 3<5S- 0 0 78 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.362 114.4-123.2 -87.4 5.7 -31.0 30.9 -14.7 144 146 A N T < 5 + 0 0 143 -3,-0.7 -3,-0.2 1,-0.2 -4,-0.1 0.852 60.4 148.6 53.6 39.5 -33.6 28.7 -13.0 145 147 A V < - 0 0 10 -5,-3.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.911 46.2-132.1-105.3 112.2 -31.8 25.5 -13.9 146 148 A P + 0 0 108 0, 0.0 -43,-0.4 0, 0.0 2,-0.3 -0.401 33.9 178.2 -59.9 135.2 -32.2 22.7 -11.3 147 149 A V - 0 0 37 -45,-0.1 2,-0.3 -2,-0.1 -43,-0.2 -0.949 23.3-131.6-135.8 156.2 -28.8 21.2 -10.4 148 150 A F E -i 104 0B 61 -45,-3.4 -43,-3.0 -2,-0.3 2,-0.4 -0.700 16.8-149.5-101.2 159.9 -27.6 18.4 -8.1 149 151 A N E +i 105 0B 78 -2,-0.3 2,-0.3 -45,-0.2 -43,-0.2 -0.981 38.1 95.9-127.8 144.3 -24.6 18.8 -5.7 150 152 A G E -i 106 0B 16 -45,-0.9 -43,-1.0 -2,-0.4 -42,-0.6 -0.986 65.2 -48.7 170.9-167.0 -22.2 16.1 -4.5 151 153 A I E -i 108 0B 9 24,-0.5 26,-2.3 -2,-0.3 27,-1.5 -0.689 43.6-144.4 -93.2 141.7 -18.9 14.3 -4.8 152 154 A S E -ik 109 178B 0 -44,-2.1 -42,-2.6 -2,-0.3 2,-0.7 -0.907 10.0-134.0-104.6 136.0 -17.6 13.0 -8.1 153 155 A V E -ik 110 179B 0 25,-3.4 27,-2.7 -2,-0.4 2,-0.9 -0.811 17.8-159.4 -79.5 116.7 -15.6 9.8 -8.6 154 156 A S E +ik 111 180B 0 -44,-1.7 -42,-1.3 -2,-0.7 2,-0.4 -0.840 22.0 178.1 -96.6 99.3 -12.6 10.7 -10.8 155 157 A S E -i 112 0B 3 25,-2.5 -42,-0.2 -2,-0.9 -90,-0.1 -0.853 37.1-151.7-111.3 136.6 -11.6 7.3 -12.2 156 158 A D S S+ 0 0 1 -44,-2.3 2,-0.6 -2,-0.4 158,-0.1 0.520 81.5 82.0 -74.5 -5.6 -8.9 6.4 -14.7 157 159 A M + 0 0 19 -45,-0.2 -2,-0.1 1,-0.2 154,-0.1 -0.903 40.2 159.0-111.1 122.4 -11.0 3.4 -15.7 158 160 A Y S S+ 0 0 39 -2,-0.6 -1,-0.2 1,-0.2 -2,-0.0 0.807 75.7 43.6-101.5 -45.3 -13.7 3.7 -18.2 159 161 A Y S S- 0 0 41 155,-0.0 -1,-0.2 0, 0.0 159,-0.0 -0.832 82.3-153.4-105.1 94.5 -14.1 0.1 -19.4 160 162 A P - 0 0 67 0, 0.0 2,-0.2 0, 0.0 203,-0.1 -0.271 3.1-148.3 -64.9 151.1 -13.9 -2.2 -16.4 161 163 A N - 0 0 26 201,-0.3 5,-0.2 3,-0.3 203,-0.0 -0.564 23.3-112.4-103.7-179.3 -12.6 -5.8 -16.8 162 164 A K S S+ 0 0 161 -2,-0.2 201,-0.1 1,-0.1 499,-0.0 0.151 97.2 73.2-104.9 18.5 -13.9 -8.8 -14.7 163 165 A I S S+ 0 0 16 1,-0.3 -1,-0.1 200,-0.2 201,-0.1 0.897 99.0 35.4 -94.0 -55.0 -10.7 -9.6 -12.7 164 166 A I S S- 0 0 36 199,-0.5 -1,-0.3 198,-0.2 -3,-0.3 -0.896 94.0-116.1-101.4 122.4 -10.5 -6.8 -10.1 165 167 A P - 0 0 115 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.284 29.0-117.9 -59.1 135.1 -13.8 -5.6 -8.9 166 168 A S - 0 0 46 -5,-0.2 3,-0.3 1,-0.1 4,-0.3 -0.463 11.7-141.6 -65.6 144.5 -14.6 -1.9 -9.8 167 169 A R S > S+ 0 0 85 1,-0.2 4,-2.3 -2,-0.1 5,-0.2 0.385 76.6 100.5 -87.9 3.2 -15.0 0.4 -6.7 168 170 A L H > S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.894 82.0 48.1 -61.1 -40.4 -17.9 2.4 -8.3 169 171 A E H > S+ 0 0 116 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.877 109.6 54.4 -65.4 -37.2 -20.6 0.6 -6.4 170 172 A D H > S+ 0 0 38 -4,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.927 111.7 44.6 -57.5 -46.0 -18.6 1.1 -3.2 171 173 A Y H <>S+ 0 0 0 -4,-2.3 5,-2.7 2,-0.2 -2,-0.2 0.868 108.7 55.6 -72.1 -36.1 -18.5 4.8 -3.9 172 174 A S H ><5S+ 0 0 22 -4,-2.6 3,-1.7 1,-0.2 -1,-0.2 0.942 109.7 47.3 -55.7 -48.8 -22.2 4.9 -4.8 173 175 A K H 3<5S+ 0 0 89 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.783 106.9 57.6 -62.9 -30.7 -22.9 3.4 -1.4 174 176 A A T 3<5S- 0 0 0 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.363 125.5-107.2 -78.1 -0.6 -20.6 6.0 0.1 175 177 A N T < 5 + 0 0 40 -3,-1.7 -24,-0.5 1,-0.3 -3,-0.2 0.663 60.9 160.0 79.8 22.9 -22.9 8.6 -1.5 176 178 A A < - 0 0 0 -5,-2.7 -1,-0.3 1,-0.1 -24,-0.2 -0.566 29.3-152.4 -66.6 139.4 -20.7 9.8 -4.4 177 179 A A + 0 0 7 -26,-2.3 -84,-2.5 -2,-0.2 -83,-0.4 0.925 60.8 0.1 -82.3 -49.6 -23.1 11.4 -6.9 178 180 A V E -Gk 92 152B 0 -27,-1.5 -25,-3.4 -86,-0.2 2,-0.4 -0.756 57.9-130.0-139.9 172.5 -21.4 11.0 -10.2 179 181 A V E +Gk 91 153B 19 -88,-2.1 -88,-2.6 -27,-0.2 2,-0.2 -1.000 32.8 140.4-132.3 134.0 -18.3 9.7 -12.0 180 182 A E E - k 0 154B 10 -27,-2.7 -25,-2.5 -2,-0.4 -90,-0.1 -0.719 46.5-114.2-145.3-152.0 -16.0 11.2 -14.6 181 183 A M S S+ 0 0 18 -27,-0.3 -115,-0.5 -2,-0.2 -27,-0.1 0.442 92.1 36.9-133.4 0.8 -12.2 11.1 -15.2 182 184 A E S > S+ 0 0 12 -117,-0.1 4,-1.9 2,-0.1 3,-0.2 0.593 82.4 86.4-135.6 -20.4 -10.5 14.5 -14.6 183 185 A L H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.894 88.7 52.2 -65.3 -44.7 -12.0 16.5 -11.7 184 186 A A H > S+ 0 0 0 -74,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.884 110.3 51.7 -57.7 -37.6 -10.0 15.1 -8.8 185 187 A T H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.918 110.1 47.8 -67.0 -45.4 -6.8 15.9 -10.8 186 188 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.936 112.6 49.9 -57.0 -49.5 -7.9 19.5 -11.4 187 189 A M H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.937 112.9 44.4 -58.2 -53.3 -8.8 20.0 -7.7 188 190 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.926 114.6 48.2 -59.6 -49.4 -5.5 18.6 -6.4 189 191 A I H X S+ 0 0 1 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.902 112.3 50.5 -56.9 -44.9 -3.3 20.5 -8.9 190 192 A G H <>S+ 0 0 0 -4,-2.6 5,-3.1 -5,-0.2 4,-0.4 0.890 109.9 49.3 -60.8 -41.5 -5.2 23.7 -8.1 191 193 A T H ><5S+ 0 0 27 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.944 113.0 46.7 -64.9 -45.6 -4.8 23.3 -4.3 192 194 A L H 3<5S+ 0 0 17 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.796 119.8 40.2 -65.4 -29.6 -1.0 22.7 -4.7 193 195 A R T 3<5S- 0 0 57 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.258 112.1-113.8-105.2 7.6 -0.7 25.7 -7.0 194 196 A K T < 5 + 0 0 159 -3,-1.0 2,-0.4 -4,-0.4 -3,-0.2 0.896 69.3 138.3 59.4 44.7 -3.1 28.1 -5.3 195 197 A V < - 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0 0 109 -2,-0.6 3,-2.5 1,-0.1 104,-0.3 -0.653 38.3 -72.6-106.5 160.0 -0.4 -30.4 -19.2 588 102 C R T 3 S+ 0 0 107 1,-0.3 104,-0.2 -2,-0.2 -1,-0.1 -0.163 121.0 26.0 -41.7 130.6 2.1 -32.1 -16.9 589 103 C G T 3 S+ 0 0 3 102,-2.7 -1,-0.3 1,-0.3 103,-0.1 0.123 90.2 127.7 94.1 -20.7 5.3 -32.7 -18.7 590 104 C D < - 0 0 40 -3,-2.5 101,-2.5 100,-0.1 2,-0.5 -0.286 54.8-129.2 -68.4 156.0 4.9 -29.8 -21.2 591 105 C I E -E 690 0F 1 43,-0.4 45,-2.6 99,-0.2 2,-0.4 -0.914 20.0-167.3-114.0 130.3 7.7 -27.2 -21.5 592 106 C C E -Ef 689 636F 0 97,-2.9 97,-2.8 -2,-0.5 2,-0.6 -0.966 10.3-158.1-119.0 134.5 7.2 -23.5 -21.3 593 107 C I E -Ef 688 637F 0 43,-3.2 45,-1.1 -2,-0.4 2,-0.3 -0.960 22.3-156.0-109.9 116.1 9.7 -20.8 -22.2 594 108 C C E -Ef 687 638F 2 93,-1.6 93,-0.8 -2,-0.6 45,-0.2 -0.756 24.5-174.8-104.4 139.9 8.8 -17.5 -20.4 595 109 C N E S+ 0 0 15 43,-1.0 21,-3.8 -2,-0.3 2,-0.3 0.576 74.1 12.4-102.0 -16.5 9.6 -13.9 -21.3 596 110 C A E -Gf 615 639F 0 42,-0.6 44,-2.0 19,-0.3 2,-0.3 -0.958 64.6-149.3-157.8 166.2 8.3 -12.2 -18.2 597 111 C A E -Gf 614 640F 0 17,-2.3 17,-0.6 -2,-0.3 2,-0.5 -0.984 22.9-111.2-149.4 151.2 7.0 -12.9 -14.7 598 112 C V E - f 0 641F 0 42,-2.5 44,-1.8 -2,-0.3 2,-1.7 -0.758 33.3-132.5 -82.4 127.8 4.6 -11.7 -12.0 599 113 C R E + f 0 642F 0 -232,-2.6 2,-0.7 -2,-0.5 44,-0.1 -0.449 47.5 149.8 -84.5 64.4 6.6 -10.3 -9.1 600 114 C E E + f 0 643F 3 -2,-1.7 44,-2.1 42,-1.5 45,-0.2 -0.299 48.4 87.9 -91.9 50.2 4.9 -12.0 -6.2 601 115 C D S S- 0 0 1 -2,-0.7 244,-0.1 42,-0.2 69,-0.0 -0.491 72.8-133.5-118.6-164.9 8.0 -12.1 -4.0 602 116 C R S >> S+ 0 0 40 -2,-0.2 4,-1.3 286,-0.1 3,-0.7 0.622 92.0 66.0-116.7 -42.6 9.4 -9.5 -1.5 603 117 C V H >> S+ 0 0 4 1,-0.3 4,-0.8 2,-0.2 3,-0.6 0.858 98.0 53.3 -56.6 -44.1 13.1 -9.3 -2.5 604 118 C S H >> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-1.0 0.917 109.4 52.0 -54.2 -41.3 12.6 -7.7 -5.9 605 119 C H H <4 S+ 0 0 38 -3,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.753 104.0 55.5 -69.2 -25.7 10.5 -5.1 -4.2 606 120 C L H << S+ 0 0 17 -4,-1.3 287,-0.3 -3,-0.6 -1,-0.3 0.619 115.0 41.4 -78.6 -10.3 13.3 -4.4 -1.7 607 121 C L H << S+ 0 0 1 -3,-1.0 289,-0.5 -4,-0.8 2,-0.3 0.789 129.6 0.9-100.1 -40.7 15.5 -3.7 -4.7 608 122 C I S < S- 0 0 0 -4,-2.5 -1,-0.4 -5,-0.2 68,-0.0 -0.992 87.7 -80.9-153.5 147.2 13.2 -1.7 -7.1 609 123 C H > - 0 0 28 -2,-0.3 3,-1.6 1,-0.1 -3,-0.1 -0.054 42.1-113.5 -50.3 148.6 9.6 -0.4 -7.0 610 124 C G T 3 S+ 0 0 23 1,-0.3 -11,-0.2 -5,-0.1 -1,-0.1 0.703 109.9 69.5 -56.4 -26.2 6.8 -2.8 -7.8 611 125 C D T 3 S+ 0 0 16 -257,-0.1 -256,-2.6 2,-0.1 -1,-0.3 0.731 78.1 99.0 -67.4 -23.5 5.8 -1.0 -11.0 612 126 C F S < S- 0 0 2 -3,-1.6 2,-0.2 -258,-0.2 -258,-0.1 -0.409 79.2-117.9 -67.8 135.5 9.1 -2.1 -12.6 613 127 C P - 0 0 2 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.536 4.4-137.9 -84.2 143.4 8.6 -5.2 -14.9 614 128 C A E +G 597 0F 0 -17,-0.6 -17,-2.3 -247,-0.2 2,-0.4 -0.900 45.8 160.0 -88.3 105.2 10.2 -8.6 -14.4 615 129 C V E -G 596 0F 5 -2,-0.9 -19,-0.3 -19,-0.2 64,-0.1 -0.990 34.4-129.9-135.1 138.9 11.2 -9.3 -18.0 616 130 C G - 0 0 3 -21,-3.8 2,-0.4 -2,-0.4 70,-0.2 -0.401 38.8 -88.5 -81.3 164.0 13.7 -11.6 -19.6 617 131 C D > - 0 0 37 68,-2.1 4,-2.0 1,-0.1 3,-0.3 -0.598 33.9-140.1 -68.6 129.5 16.3 -10.7 -22.1 618 132 C F H > S+ 0 0 2 -2,-0.4 4,-2.4 1,-0.2 -1,-0.1 0.830 98.9 55.5 -71.1 -28.3 14.7 -11.2 -25.5 619 133 C D H > S+ 0 0 101 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.864 108.2 49.1 -65.4 -36.6 17.8 -12.7 -27.2 620 134 C V H > S+ 0 0 0 -3,-0.3 4,-2.7 65,-0.2 -2,-0.2 0.934 111.5 49.4 -67.1 -44.6 17.9 -15.4 -24.5 621 135 C Y H X S+ 0 0 22 -4,-2.0 4,-2.5 64,-0.3 -2,-0.2 0.937 112.3 48.2 -56.6 -49.7 14.2 -16.1 -25.0 622 136 C D H X S+ 0 0 21 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.891 111.6 49.5 -57.8 -47.5 14.8 -16.3 -28.9 623 137 C T H X S+ 0 0 29 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.913 110.5 49.6 -59.0 -48.9 17.8 -18.7 -28.4 624 138 C L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.943 113.9 46.9 -57.3 -47.5 15.8 -21.0 -26.1 625 139 C N H X S+ 0 0 11 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.902 111.7 49.1 -61.8 -45.0 13.0 -21.0 -28.7 626 140 C K H X S+ 0 0 88 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.859 110.2 52.7 -63.3 -36.7 15.3 -21.7 -31.7 627 141 C C H X S+ 0 0 4 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.919 109.2 48.2 -62.7 -44.3 17.0 -24.5 -29.8 628 142 C A H <>S+ 0 0 1 -4,-2.1 5,-2.9 2,-0.2 -2,-0.2 0.920 111.5 51.6 -61.7 -44.1 13.6 -26.2 -29.0 629 143 C Q H ><5S+ 0 0 124 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.933 109.9 47.7 -55.7 -52.6 12.6 -25.8 -32.7 630 144 C E H 3<5S+ 0 0 135 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.775 112.9 48.4 -66.1 -27.3 15.8 -27.4 -34.0 631 145 C L T 3<5S- 0 0 88 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.374 112.9-122.9 -88.2 3.9 15.5 -30.3 -31.5 632 146 C N T < 5 + 0 0 148 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.906 59.8 149.0 51.2 48.3 11.8 -30.6 -32.6 633 147 C V < - 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k 01421M 0 112,-2.4 114,-1.9 -2,-0.7 2,-0.2 -0.505 48.6-106.0-123.7-171.8 -11.7 22.4 18.3 1309 91 F S E + k 01422M 18 112,-0.3 2,-0.3 -2,-0.2 114,-0.2 -0.653 36.1 179.0-108.0 174.1 -8.1 23.6 18.6 1310 92 F C E - k 01423M 4 112,-1.7 114,-3.1 -2,-0.2 115,-0.6 -0.972 27.2-111.5-163.4 164.4 -5.3 23.1 16.1 1311 93 F G E -Lk13991425M 7 88,-2.9 88,-2.1 -2,-0.3 2,-0.4 -0.663 38.2-110.3 -96.8 162.1 -1.7 23.8 15.3 1312 94 F S E -L 1398 0M 1 113,-2.3 116,-0.4 -2,-0.2 86,-0.2 -0.784 24.9-177.2 -95.8 135.7 -0.6 26.1 12.5 1313 95 F L S S+ 0 0 0 84,-2.5 85,-0.2 -2,-0.4 -1,-0.1 0.331 86.4 54.7-104.4 3.4 1.1 24.8 9.4 1314 96 F Q >> + 0 0 48 83,-0.6 4,-3.4 4,-0.2 3,-1.8 -0.597 63.6 170.0-131.9 68.3 1.6 28.3 8.0 1315 97 F P T 34 S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.695 76.4 59.9 -61.0 -19.2 3.4 30.1 10.9 1316 98 F D T 34 S+ 0 0 152 -3,-0.1 3,-0.1 1,-0.1 -2,-0.0 0.770 123.1 19.0 -72.8 -30.2 4.0 33.1 8.6 1317 99 F L T <4 S+ 0 0 116 -3,-1.8 2,-0.6 1,-0.2 -1,-0.1 0.781 122.3 51.9-109.4 -41.6 0.3 33.7 8.1 1318 100 F I < - 0 0 6 -4,-3.4 -4,-0.2 79,-0.1 -1,-0.2 -0.901 67.9-177.5-114.7 113.6 -1.6 31.9 10.9 1319 101 F K > - 0 0 122 -2,-0.6 3,-2.5 1,-0.2 104,-0.3 -0.543 39.6 -64.9-109.6 167.9 -0.6 32.5 14.6 1320 102 F R T 3 S+ 0 0 106 1,-0.3 104,-0.2 -2,-0.2 -1,-0.2 -0.198 122.4 22.3 -47.7 129.4 -1.5 31.3 18.1 1321 103 F G T 3 S+ 0 0 2 102,-3.2 -1,-0.3 1,-0.3 103,-0.1 0.239 91.6 129.8 92.2 -14.2 -5.1 32.4 18.8 1322 104 F D < - 0 0 45 -3,-2.5 101,-2.7 100,-0.1 2,-0.5 -0.331 53.5-128.4 -71.6 156.9 -6.2 32.7 15.2 1323 105 F I E -M 1422 0M 0 43,-0.4 45,-3.0 99,-0.2 2,-0.4 -0.927 19.3-167.7-115.3 127.1 -9.4 31.0 14.0 1324 106 F C E -Mn14211368M 0 97,-2.8 97,-2.7 -2,-0.5 2,-0.6 -0.957 9.8-159.6-114.8 132.5 -9.6 28.7 11.0 1325 107 F I E -Mn14201369M 0 43,-3.3 45,-1.0 -2,-0.4 2,-0.3 -0.966 24.6-154.9-106.9 116.2 -12.9 27.5 9.4 1326 108 F C E -Mn14191370M 2 93,-1.9 93,-0.7 -2,-0.6 45,-0.2 -0.773 26.2-175.0-106.9 138.1 -12.0 24.4 7.4 1327 109 F N E S+ 0 0 14 43,-0.7 21,-3.4 -2,-0.3 2,-0.3 0.576 73.8 13.2-100.3 -15.3 -13.8 22.9 4.3 1328 110 F A E -On13471371M 0 42,-0.5 44,-2.3 19,-0.3 2,-0.3 -0.958 64.0-148.6-156.7 166.3 -11.7 19.7 3.9 1329 111 F A E -On13461372M 0 17,-2.5 17,-0.6 -2,-0.3 2,-0.4 -0.986 22.5-113.0-147.4 151.3 -9.2 17.5 5.7 1330 112 F V E - 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