==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-MAR-06 2CGV . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE CHK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.FOLOPPE,L.M.FISHER,R.HOWES,A.POTTER,A.G.S.ROBERTSON, . 264 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13144.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 17.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 22 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 26.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 1 1 0 1 0 0 1 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 3 1 1 1 1 1 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 . 2 0 1 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 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 6 A V 0 0 124 0, 0.0 4,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 51.1 11.4 -10.9 33.6 2 7 A E - 0 0 43 2,-2.9 2,-1.8 0, 0.0 3,-0.1 -0.415 360.0 -50.0-170.2 74.1 14.4 -8.5 33.2 3 8 A D S S+ 0 0 131 -2,-0.1 21,-0.6 20,-0.0 2,-0.2 -0.213 139.9 58.4 70.9 -45.3 14.2 -5.4 35.4 4 9 A W E S-A 23 0A 33 -2,-1.8 -2,-2.9 19,-0.2 2,-0.3 -0.708 91.4-117.6-104.8 157.9 10.6 -5.3 33.8 5 10 A D E -A 22 0A 78 17,-2.7 17,-2.0 -2,-0.2 2,-1.0 -0.807 18.9-126.5 -94.8 141.4 7.8 -7.9 33.9 6 11 A L E +A 21 0A 64 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.778 35.7 172.9 -87.9 99.3 6.5 -9.7 30.7 7 12 A V E - 0 0 67 13,-1.5 2,-0.3 -2,-1.0 -1,-0.2 0.814 53.6 -5.8 -84.5 -42.2 2.7 -9.0 31.0 8 13 A Q E -A 20 0A 99 12,-1.0 12,-2.8 0, 0.0 -1,-0.2 -0.990 68.2-104.2-156.4 158.3 1.2 -10.2 27.8 9 14 A T E +A 19 0A 68 -2,-0.3 10,-0.2 10,-0.2 8,-0.0 -0.479 32.8 178.5 -86.2 149.9 2.1 -11.6 24.4 10 15 A L + 0 0 68 8,-2.8 9,-0.2 -2,-0.1 -1,-0.1 0.710 65.0 2.4-129.9 -27.9 1.8 -9.1 21.4 11 16 A G - 0 0 36 7,-1.3 2,-2.2 2,-0.0 7,-0.2 -0.367 59.5-159.5-171.2 74.3 2.9 -10.5 18.0 12 17 A E + 0 0 140 5,-0.2 5,-0.2 1,-0.1 7,-0.0 -0.417 31.0 163.7 -67.8 74.8 3.9 -14.1 18.0 13 18 A G - 0 0 46 -2,-2.2 -1,-0.1 1,-0.0 -2,-0.0 0.484 50.5 -86.1 -66.4-149.0 6.0 -14.2 14.7 14 19 A A S S+ 0 0 99 1,-0.0 -2,-0.0 3,-0.0 3,-0.0 0.888 120.9 50.6 -96.6 -58.3 8.6 -16.8 13.3 15 20 A Y S S- 0 0 105 20,-0.1 21,-0.9 24,-0.0 2,-0.2 0.858 130.1 -75.0 -38.9 -51.6 11.8 -15.6 14.9 16 21 A G E - B 0 35A 21 19,-0.2 2,-0.3 -5,-0.2 19,-0.2 -0.576 67.1 -61.5-176.7-113.1 10.1 -15.5 18.4 17 22 A E E - B 0 34A 63 17,-1.2 17,-2.6 -5,-0.2 2,-0.5 -0.985 23.5-127.4-159.4 153.7 7.5 -13.0 19.9 18 23 A V E - B 0 33A 35 -2,-0.3 -8,-2.8 15,-0.2 -7,-1.3 -0.960 33.2-171.3-106.7 130.3 7.0 -9.3 20.9 19 24 A Q E -AB 9 32A 26 13,-2.4 13,-2.3 -2,-0.5 2,-0.5 -0.903 26.7-117.2-118.5 152.1 5.7 -9.1 24.5 20 25 A L E -AB 8 31A 9 -12,-2.8 -13,-1.5 -2,-0.3 -12,-1.0 -0.830 35.4-162.3 -90.1 126.3 4.5 -6.0 26.2 21 26 A A E -AB 6 30A 0 9,-3.9 9,-2.8 -2,-0.5 2,-0.4 -0.930 7.3-164.8-114.8 135.6 6.8 -5.2 29.2 22 27 A V E -AB 5 29A 15 -17,-2.0 -17,-2.7 -2,-0.4 2,-0.6 -0.921 20.5-130.2-116.0 139.4 6.0 -3.0 32.2 23 28 A N E > -A 4 0A 13 5,-1.9 4,-2.2 -2,-0.4 -19,-0.2 -0.828 15.2-150.6 -86.8 126.4 8.5 -1.6 34.7 24 29 A R T 4 S+ 0 0 121 -21,-0.6 -1,-0.1 -2,-0.6 -20,-0.1 0.772 92.0 46.6 -73.8 -23.6 7.2 -2.4 38.2 25 30 A V T 4 S+ 0 0 126 1,-0.1 -1,-0.2 3,-0.1 -21,-0.0 0.950 129.4 19.2 -73.6 -60.0 8.8 0.6 39.8 26 31 A T T 4 S- 0 0 89 2,-0.1 -2,-0.2 0, 0.0 3,-0.1 0.500 94.2-130.9 -97.4 -17.0 7.9 3.4 37.2 27 32 A E < + 0 0 119 -4,-2.2 2,-0.2 1,-0.3 -3,-0.1 0.404 51.1 157.5 88.3 -0.5 4.9 1.6 35.5 28 33 A E - 0 0 100 -6,-0.1 -5,-1.9 1,-0.1 -1,-0.3 -0.362 31.9-141.9 -71.0 127.0 6.4 2.4 32.2 29 34 A A E +B 22 0A 38 -7,-0.2 50,-0.3 -2,-0.2 2,-0.3 -0.621 26.2 160.6 -86.8 142.3 5.4 0.2 29.2 30 35 A V E -B 21 0A 2 -9,-2.8 -9,-3.9 -2,-0.2 2,-0.4 -0.973 36.7-113.0-145.8 163.3 7.6 -1.0 26.3 31 36 A A E -BC 20 77A 7 46,-3.0 46,-3.7 -2,-0.3 2,-0.5 -0.822 26.3-164.6 -93.8 135.8 7.7 -3.7 23.6 32 37 A V E -BC 19 76A 2 -13,-2.3 -13,-2.4 -2,-0.4 2,-0.5 -0.974 6.9-153.4-119.4 124.3 10.4 -6.3 23.9 33 38 A K E -BC 18 75A 6 42,-3.0 42,-1.5 -2,-0.5 2,-0.5 -0.870 11.7-155.2-100.4 136.7 11.1 -8.4 20.9 34 39 A I E +BC 17 74A 19 -17,-2.6 -17,-1.2 -2,-0.5 2,-0.5 -0.958 15.3 175.8-119.3 109.2 12.5 -11.8 21.9 35 40 A V E -BC 16 73A 9 38,-1.8 38,-2.3 -2,-0.5 2,-0.8 -0.983 21.0-150.6-120.6 127.8 14.6 -13.7 19.4 36 41 A D E > - C 0 72A 54 -21,-0.9 3,-0.7 -2,-0.5 36,-0.2 -0.864 8.6-153.3 -97.8 102.3 16.3 -17.0 20.3 37 42 A M T 3 S+ 0 0 29 34,-0.9 -1,-0.1 -2,-0.8 35,-0.1 0.656 93.7 57.1 -57.7 -20.8 19.4 -17.0 18.1 38 43 A K T 3 0 0 67 3,-0.1 -1,-0.3 4,-0.1 34,-0.0 0.925 360.0 360.0 -71.9 -53.1 19.3 -20.8 18.3 39 44 A R < 0 0 107 -3,-0.7 -2,-0.2 -24,-0.1 -23,-0.1 0.977 360.0 360.0 -70.2 360.0 15.7 -21.3 16.9 40 ! 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 41 48 A C 0 0 83 0, 0.0 4,-0.2 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 136.6 19.7 -16.4 12.7 42 49 A P > + 0 0 75 0, 0.0 4,-0.8 0, 0.0 -5,-0.1 0.461 360.0 60.5 -89.3 -5.0 22.5 -14.2 14.3 43 50 A E H > S+ 0 0 153 2,-0.2 4,-0.8 3,-0.1 5,-0.1 0.916 103.1 40.5 -97.7 -52.7 23.1 -12.4 11.1 44 51 A N H > S+ 0 0 43 1,-0.2 4,-2.9 2,-0.2 -1,-0.1 0.769 115.5 56.0 -71.3 -24.9 19.9 -10.6 10.1 45 52 A I H > S+ 0 0 10 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.858 102.2 52.9 -77.0 -34.2 19.5 -9.8 13.8 46 53 A K H X S+ 0 0 98 -4,-0.8 4,-1.0 2,-0.2 -1,-0.2 0.801 114.1 46.2 -64.8 -22.0 22.9 -8.0 14.0 47 54 A K H X S+ 0 0 83 -4,-0.8 4,-3.4 2,-0.2 5,-0.3 0.917 107.8 55.2 -87.4 -43.9 21.6 -6.0 11.0 48 55 A E H X S+ 0 0 8 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.892 113.6 40.6 -49.5 -45.0 18.2 -5.3 12.5 49 56 A I H X S+ 0 0 16 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.875 114.3 53.9 -78.0 -28.9 19.8 -3.8 15.7 50 57 A C H X S+ 0 0 70 -4,-1.0 4,-0.7 -5,-0.3 -2,-0.2 0.954 112.1 42.3 -67.5 -48.1 22.3 -2.0 13.6 51 58 A I H >X S+ 0 0 6 -4,-3.4 3,-1.7 1,-0.2 4,-0.8 0.949 111.3 58.5 -62.6 -46.4 19.7 -0.4 11.4 52 59 A N H >< S+ 0 0 4 -4,-2.5 3,-1.3 1,-0.3 11,-0.2 0.859 99.6 56.6 -50.2 -44.0 17.5 0.3 14.5 53 60 A K H 3< S+ 0 0 123 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.792 102.1 55.4 -66.3 -25.3 20.2 2.3 16.1 54 61 A M H << S+ 0 0 91 -3,-1.7 2,-0.4 -4,-0.7 -1,-0.3 0.737 91.7 101.9 -72.7 -15.6 20.4 4.7 13.1 55 62 A L << + 0 0 15 -3,-1.3 8,-0.4 -4,-0.8 2,-0.3 -0.523 33.5 152.4 -83.3 124.1 16.6 5.4 13.4 56 63 A N + 0 0 119 -2,-0.4 2,-0.3 6,-0.1 5,-0.1 -0.743 25.0 116.4-148.2 105.7 15.1 8.5 14.9 57 64 A H > - 0 0 25 3,-0.3 3,-1.9 -2,-0.3 53,-0.0 -0.971 65.2-118.2-166.7 139.5 11.7 9.8 13.8 58 65 A E T 3 S+ 0 0 125 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.748 115.9 47.7 -52.4 -26.3 8.1 10.5 14.9 59 66 A N T 3 S+ 0 0 13 79,-0.1 80,-3.8 2,-0.1 2,-0.4 0.241 99.3 74.7-107.5 22.2 6.9 7.8 12.4 60 67 A V B < S-e 139 0B 3 -3,-1.9 -3,-0.3 78,-0.3 80,-0.2 -0.981 93.2-101.6-129.1 137.5 9.3 5.0 13.1 61 68 A V - 0 0 8 78,-2.5 -2,-0.1 -2,-0.4 2,-0.1 -0.389 47.1-109.5 -57.4 130.6 9.0 2.8 16.2 62 69 A K - 0 0 68 -4,-0.1 16,-2.1 -2,-0.1 2,-0.5 -0.336 20.3-143.7 -68.5 141.4 11.6 3.9 18.8 63 70 A F E +D 77 0A 30 -8,-0.4 14,-0.2 -11,-0.2 3,-0.1 -0.964 21.5 173.9-101.1 121.6 14.5 1.7 19.5 64 71 A Y E - 0 0 115 12,-3.6 2,-0.3 -2,-0.5 13,-0.2 0.814 51.3 -77.2 -92.4 -39.3 15.5 1.9 23.3 65 72 A G E -D 76 0A 9 11,-1.3 11,-3.0 2,-0.0 2,-0.3 -0.944 34.7-101.6 161.9-178.5 18.3 -0.8 23.4 66 73 A H E -D 75 0A 58 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.993 15.1-178.9-141.3 130.4 19.6 -4.4 23.5 67 74 A R E -D 74 0A 143 7,-0.8 7,-2.1 -2,-0.3 -2,-0.0 -0.923 18.4-148.4-115.1 161.1 21.0 -7.1 25.8 68 75 A R + 0 0 134 -2,-0.3 -1,-0.1 5,-0.2 0, 0.0 0.738 18.3 177.9-104.3 -22.6 22.1 -10.6 24.9 69 76 A E S > S- 0 0 108 2,-0.1 3,-0.7 5,-0.1 2,-0.5 0.653 71.9 -45.9 25.1 52.7 21.3 -12.8 28.0 70 77 A G T 3 S- 0 0 61 1,-0.3 -1,-0.0 -34,-0.0 -34,-0.0 -0.900 120.3 -25.3 107.9-125.1 22.5 -16.2 26.5 71 78 A N T 3 S+ 0 0 87 -2,-0.5 -34,-0.9 2,-0.0 2,-0.7 0.699 117.4 107.0 -77.1 -26.1 21.3 -16.9 23.0 72 79 A I E < -C 36 0A 42 -3,-0.7 2,-0.4 -36,-0.2 -36,-0.2 -0.289 53.2-166.9 -69.1 98.0 18.4 -14.5 23.8 73 80 A Q E -C 35 0A 2 -38,-2.3 -38,-1.8 -2,-0.7 2,-0.4 -0.691 5.1-161.7 -78.7 133.8 18.5 -11.1 22.2 74 81 A Y E -CD 34 67A 33 -7,-2.1 -7,-0.8 -2,-0.4 2,-0.5 -0.845 2.0-165.8-113.6 95.4 16.0 -8.6 23.7 75 82 A L E -CD 33 66A 0 -42,-1.5 -42,-3.0 -2,-0.4 2,-0.6 -0.692 13.2-146.3 -81.9 127.5 15.3 -5.6 21.5 76 83 A F E +CD 32 65A 20 -11,-3.0 -12,-3.6 -2,-0.5 -11,-1.3 -0.847 28.3 173.4-102.1 121.3 13.6 -2.9 23.5 77 84 A L E -CD 31 63A 19 -46,-3.7 -46,-3.0 -2,-0.6 -14,-0.2 -0.918 40.9 -82.3-140.4 147.4 11.1 -0.9 21.3 78 85 A E - 0 0 24 -16,-2.1 2,-0.4 -2,-0.3 -48,-0.1 -0.198 47.0-132.9 -51.0 121.0 8.4 1.7 21.5 79 86 A Y - 0 0 60 -50,-0.3 2,-0.7 -58,-0.1 -1,-0.1 -0.701 13.7-150.6 -74.8 133.5 5.2 -0.1 22.6 80 87 A C > - 0 0 11 -2,-0.4 3,-1.3 1,-0.1 51,-0.2 -0.924 11.9-172.2-113.1 104.5 2.3 1.0 20.4 81 88 A S T 3 S+ 0 0 63 -2,-0.7 51,-0.2 1,-0.3 -1,-0.1 0.667 82.3 67.1 -69.6 -16.8 -1.0 0.8 22.4 82 89 A G T 3 S- 0 0 23 49,-2.4 -1,-0.3 1,-0.2 50,-0.2 0.695 94.1-151.4 -75.5 -19.5 -3.0 1.5 19.2 83 90 A G E < -F 131 0B 30 -3,-1.3 48,-3.1 48,-0.7 2,-0.2 -0.463 41.7 -19.4 78.8-154.8 -2.0 -1.9 17.7 84 91 A E E > -F 130 0B 60 46,-0.2 3,-1.3 -2,-0.1 4,-0.3 -0.614 46.0-131.2 -88.1 150.0 -1.7 -2.5 13.9 85 92 A L G > S+ 0 0 0 44,-2.9 3,-1.5 41,-0.9 4,-0.4 0.742 104.5 78.1 -61.0 -17.3 -3.2 -0.4 11.1 86 93 A F G > S+ 0 0 90 40,-0.8 3,-0.8 43,-0.4 -1,-0.2 0.857 89.2 50.1 -68.8 -29.2 -4.2 -3.8 9.9 87 94 A D G < S+ 0 0 117 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.587 100.5 65.1 -85.3 -10.5 -7.1 -3.9 12.4 88 95 A R G < S+ 0 0 81 -3,-1.5 2,-0.8 -4,-0.3 -1,-0.2 0.461 82.9 86.6 -84.9 -4.0 -8.4 -0.4 11.4 89 96 A I S < S- 0 0 20 -3,-0.8 6,-0.2 -4,-0.4 105,-0.1 -0.862 75.1-144.4-101.7 113.5 -9.3 -1.6 8.0 90 97 A E B >> -H 94 0C 122 4,-3.0 4,-2.8 -2,-0.8 3,-2.3 -0.665 35.2-102.3 -71.7 128.3 -12.8 -3.1 8.0 91 98 A P T 34 S+ 0 0 106 0, 0.0 107,-0.2 0, 0.0 106,-0.1 -0.273 101.5 3.1 -57.2 133.9 -12.7 -6.0 5.5 92 99 A D T 34 S+ 0 0 102 105,-2.8 105,-0.2 1,-0.1 106,-0.1 0.438 135.6 52.6 72.3 -7.3 -14.3 -5.1 2.2 93 100 A I T <4 S- 0 0 108 -3,-2.3 2,-0.6 104,-0.1 104,-0.3 0.657 78.0-163.9-124.4 -42.6 -14.9 -1.6 3.3 94 101 A G B < -H 90 0C 2 -4,-2.8 -4,-3.0 102,-0.2 101,-0.2 -0.861 38.6 -61.2 101.9-116.7 -11.7 0.0 4.6 95 102 A M - 0 0 21 99,-0.7 -6,-0.1 -2,-0.6 5,-0.1 -0.966 65.4 -60.6-162.9 162.6 -12.0 3.2 6.6 96 103 A P >> - 0 0 79 0, 0.0 4,-1.7 0, 0.0 3,-1.4 -0.356 52.4-119.8 -49.6 132.3 -13.2 6.8 6.3 97 104 A E H 3> S+ 0 0 47 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.837 111.3 56.9 -46.8 -39.2 -11.3 8.5 3.5 98 105 A P H 3> S+ 0 0 37 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.815 104.7 51.4 -66.6 -30.5 -9.9 11.2 6.0 99 106 A D H <> S+ 0 0 49 -3,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.927 109.9 48.8 -72.8 -37.5 -8.4 8.6 8.2 100 107 A A H X S+ 0 0 0 -4,-1.7 4,-3.4 2,-0.2 5,-0.3 0.939 108.8 53.7 -62.4 -52.8 -6.6 6.9 5.4 101 108 A Q H X S+ 0 0 12 -4,-2.9 4,-2.5 -5,-0.2 -1,-0.2 0.908 109.9 47.0 -48.6 -43.8 -5.3 10.2 4.2 102 109 A R H X S+ 0 0 58 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.926 115.2 46.6 -63.6 -41.8 -3.8 11.0 7.6 103 110 A F H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.943 111.2 50.4 -71.1 -49.6 -2.3 7.6 7.8 104 111 A F H X S+ 0 0 0 -4,-3.4 4,-3.1 2,-0.2 -2,-0.2 0.889 109.2 53.8 -47.3 -43.7 -0.9 7.8 4.3 105 112 A H H X S+ 0 0 55 -4,-2.5 4,-2.8 -5,-0.3 -2,-0.2 0.951 112.1 43.8 -58.5 -42.4 0.6 11.2 5.2 106 113 A Q H X S+ 0 0 27 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.869 111.4 53.8 -77.4 -26.5 2.4 9.7 8.2 107 114 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.990 110.1 48.0 -67.0 -52.1 3.4 6.7 6.2 108 115 A M H X S+ 0 0 0 -4,-3.1 4,-3.3 1,-0.2 -2,-0.2 0.839 109.2 52.1 -49.5 -46.6 5.0 9.0 3.6 109 116 A A H X S+ 0 0 32 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.974 112.9 46.3 -55.7 -51.8 6.8 11.1 6.3 110 117 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.891 114.5 45.2 -64.2 -43.4 8.3 7.9 7.8 111 118 A V H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.917 110.6 54.8 -58.4 -47.2 9.4 6.4 4.3 112 119 A V H X S+ 0 0 52 -4,-3.3 4,-2.4 -5,-0.2 -2,-0.2 0.922 110.2 49.1 -53.1 -46.3 10.8 9.8 3.3 113 120 A Y H X S+ 0 0 47 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.950 111.4 44.9 -62.0 -54.8 12.9 9.7 6.4 114 121 A L H ><>S+ 0 0 0 -4,-2.2 5,-2.1 1,-0.2 3,-1.5 0.952 115.7 48.7 -48.4 -52.2 14.2 6.2 6.0 115 122 A H H ><5S+ 0 0 8 -4,-3.0 3,-1.5 1,-0.3 -1,-0.2 0.827 104.6 59.5 -62.8 -40.5 15.0 6.8 2.4 116 123 A G H 3<5S+ 0 0 55 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.813 108.6 44.7 -51.5 -34.7 16.7 10.0 3.3 117 124 A I T <<5S- 0 0 61 -3,-1.5 -1,-0.2 -4,-1.3 -2,-0.2 0.286 122.1-103.2-104.5 18.7 19.1 8.0 5.4 118 125 A G T < 5S+ 0 0 1 -3,-1.5 30,-3.3 1,-0.2 31,-1.0 0.618 79.4 125.3 83.0 20.9 19.7 5.3 2.9 119 126 A I E < -I 147 0D 0 -5,-2.1 2,-0.4 28,-0.3 28,-0.2 -0.914 41.0-162.1-120.3 130.9 17.5 2.6 4.3 120 127 A T E -I 146 0D 1 26,-2.9 26,-2.2 -2,-0.4 60,-0.1 -0.933 9.8-155.4-110.2 133.2 14.7 0.6 2.7 121 128 A H - 0 0 2 -2,-0.4 23,-0.2 24,-0.2 -1,-0.2 0.943 17.4-165.8 -69.0 -54.1 12.2 -1.2 4.9 122 129 A R S S+ 0 0 21 57,-0.1 41,-0.2 23,-0.1 39,-0.1 0.379 70.5 61.8 89.5 -5.5 11.3 -3.7 2.1 123 130 A D + 0 0 17 39,-0.2 2,-0.6 18,-0.1 39,-0.1 -0.132 60.1 160.9-146.5 50.5 8.2 -5.0 3.8 124 131 A I + 0 0 1 42,-0.1 39,-0.1 3,-0.1 66,-0.1 -0.665 19.4 132.7 -76.5 117.8 5.7 -2.3 4.3 125 132 A K S > S- 0 0 35 -2,-0.6 3,-2.5 64,-0.0 4,-0.2 -0.914 70.4 -90.1-154.6 170.9 2.2 -3.6 4.9 126 133 A P G > S+ 0 0 1 0, 0.0 3,-1.6 0, 0.0 -41,-0.9 0.826 122.4 61.1 -59.6 -33.3 -0.6 -2.9 7.4 127 134 A E G 3 S+ 0 0 59 1,-0.3 -3,-0.1 -42,-0.2 -40,-0.0 0.624 105.8 48.3 -63.3 -23.7 0.7 -5.5 9.8 128 135 A N G < S+ 0 0 16 -3,-2.5 12,-2.5 1,-0.1 2,-0.6 0.266 93.1 84.9-106.4 16.4 4.0 -3.5 10.0 129 136 A L E < - G 0 139B 0 -3,-1.6 -44,-2.9 10,-0.2 -43,-0.4 -0.951 65.2-167.3-113.6 110.9 2.4 -0.1 10.6 130 137 A L E -FG 84 138B 36 8,-2.5 8,-2.7 -2,-0.6 2,-0.4 -0.730 11.9-137.8-103.5 151.8 1.7 0.4 14.3 131 138 A L E -FG 83 137B 0 -48,-3.1 -49,-2.4 -2,-0.3 -48,-0.7 -0.877 13.8-149.1-108.0 126.8 -0.5 3.0 16.0 132 139 A D > - 0 0 12 4,-2.4 3,-1.6 -2,-0.4 -52,-0.1 -0.089 45.4 -74.8 -78.3-167.4 0.5 4.9 19.2 133 140 A E T 3 S+ 0 0 124 1,-0.3 -1,-0.0 2,-0.1 -53,-0.0 0.877 135.8 42.5 -57.3 -39.1 -1.8 6.3 21.9 134 141 A R T 3 S- 0 0 192 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.298 123.6-103.5 -94.6 16.5 -2.9 9.3 19.7 135 142 A D < + 0 0 50 -3,-1.6 2,-0.5 1,-0.3 -2,-0.1 0.791 66.4 158.8 73.3 30.3 -3.3 7.0 16.6 136 143 A N - 0 0 36 1,-0.0 -4,-2.4 -30,-0.0 -1,-0.3 -0.768 41.2-120.7 -92.5 134.7 -0.1 8.2 15.1 137 144 A L E - G 0 131B 0 -2,-0.5 2,-0.4 -6,-0.2 -6,-0.2 -0.465 29.7-175.7 -73.6 136.4 1.4 5.8 12.6 138 145 A K E - G 0 130B 10 -8,-2.7 -8,-2.5 -2,-0.2 -78,-0.3 -0.975 26.2-125.1-133.6 127.7 4.9 4.3 13.2 139 146 A I E -eG 60 129B 0 -80,-3.8 -78,-2.5 -2,-0.4 2,-0.3 -0.504 37.6-162.8 -69.8 136.0 6.7 2.1 10.7 140 147 A S + 0 0 19 -12,-2.5 -1,-0.0 -2,-0.2 -78,-0.0 -0.833 40.2 29.6-129.7 148.0 7.8 -1.1 12.5 141 148 A D - 0 0 30 -2,-0.3 3,-0.4 1,-0.1 -1,-0.2 0.983 39.5-168.6 68.9 97.3 10.1 -4.1 12.2 142 149 A F > + 0 0 2 1,-0.2 3,-1.5 2,-0.1 -91,-0.1 0.141 52.0 119.8-101.6 19.7 13.4 -3.5 10.3 143 150 A G T 3 S+ 0 0 15 1,-0.3 -1,-0.2 -92,-0.0 -95,-0.2 0.706 87.3 29.8 -56.3 -31.2 14.1 -7.2 10.2 144 151 A L T 3 S+ 0 0 62 -3,-0.4 -1,-0.3 -23,-0.2 -2,-0.1 0.317 95.3 126.3-109.1 6.4 14.2 -7.2 6.4 145 152 A A < - 0 0 2 -3,-1.5 2,-0.3 -22,-0.1 -24,-0.2 -0.315 37.2-176.6 -65.1 147.5 15.4 -3.6 6.2 146 153 A T E -I 120 0D 18 -26,-2.2 -26,-2.9 -95,-0.0 2,-0.4 -0.946 28.8-107.7-137.3 165.2 18.5 -3.0 4.1 147 154 A V E +I 119 0D 40 -2,-0.3 -28,-0.3 -28,-0.2 3,-0.1 -0.789 33.8 167.1 -86.8 131.8 21.0 -0.1 3.2 148 155 A F + 0 0 0 -30,-3.3 7,-2.0 -2,-0.4 2,-0.3 0.295 67.3 42.3-129.0 2.4 20.7 1.2 -0.5 149 156 A R E +J 154 0E 68 -31,-1.0 -1,-0.4 5,-0.3 2,-0.3 -0.951 61.9 163.4-154.0 128.4 22.6 4.3 -0.3 150 157 A Y E > S+J 153 0E 138 3,-1.4 3,-1.5 -2,-0.3 -32,-0.1 -0.948 74.3 0.1-153.3 126.6 25.9 4.7 1.5 151 158 A N T 3 S- 0 0 145 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.869 131.3 -62.6 50.6 39.4 28.5 7.5 1.1 152 159 A N T 3 S+ 0 0 136 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.688 110.5 117.8 57.6 25.9 26.0 8.8 -1.5 153 160 A R E < -J 150 0E 188 -3,-1.5 -3,-1.4 2,-0.0 2,-0.3 -0.988 56.6-138.8-117.7 136.2 26.2 5.9 -3.9 154 161 A E E -J 149 0E 72 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.3 -0.645 11.6-156.2 -87.5 137.5 23.0 3.9 -4.5 155 162 A R - 0 0 138 -7,-2.0 24,-0.4 -2,-0.3 2,-0.1 -0.956 17.2-125.3-110.5 142.1 23.2 0.1 -4.7 156 163 A L - 0 0 68 -2,-0.4 2,-0.2 22,-0.1 22,-0.2 -0.472 26.9-123.6 -70.8 148.9 20.6 -1.9 -6.6 157 164 A L B +K 177 0F 13 20,-2.5 20,-2.1 1,-0.1 3,-0.1 -0.685 31.0 172.6 -85.4 154.2 18.9 -4.6 -4.6 158 165 A N + 0 0 109 -2,-0.2 2,-0.2 18,-0.2 -1,-0.1 0.506 50.8 90.5-127.2 -41.9 18.9 -8.3 -5.8 159 166 A K S S- 0 0 98 1,-0.1 2,-0.4 0, 0.0 -2,-0.0 -0.435 73.7-131.7 -63.1 127.9 17.5 -10.4 -3.0 160 167 A M + 0 0 126 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.673 44.1 146.3 -72.2 127.3 13.7 -10.8 -3.3 161 168 A C + 0 0 21 -2,-0.4 2,-0.3 -39,-0.1 -39,-0.1 -0.959 16.9 64.3-161.1-178.6 11.9 -10.1 -0.1 162 169 A G S S- 0 0 32 -2,-0.3 2,-0.5 -39,-0.1 -39,-0.2 -0.742 86.9 -45.9 98.5-155.3 8.7 -8.8 1.4 163 170 A T >> - 0 0 32 -2,-0.3 3,-2.0 -41,-0.2 4,-0.8 -0.961 48.9-127.6-129.7 111.2 5.2 -10.0 1.2 164 171 A L G >4 S+ 0 0 87 -2,-0.5 3,-0.8 1,-0.3 -1,-0.1 0.643 104.7 49.3 -32.4 -55.0 3.7 -11.0 -2.3 165 172 A P G 34 S+ 0 0 30 0, 0.0 -1,-0.3 0, 0.0 36,-0.1 0.852 119.2 41.9 -65.0 -23.4 0.5 -8.9 -2.4 166 173 A Y G <4 S+ 0 0 11 -3,-2.0 -2,-0.2 36,-0.1 23,-0.2 0.569 92.9 106.6 -91.3 -13.3 2.6 -5.8 -1.4 167 174 A V S << S- 0 0 10 -4,-0.8 -5,-0.1 -3,-0.8 16,-0.1 -0.390 70.5-119.6 -69.8 142.5 5.6 -6.5 -3.7 168 175 A A >> - 0 0 0 1,-0.1 3,-1.5 -2,-0.1 4,-0.7 -0.531 24.1-117.3 -76.3 153.1 6.3 -4.4 -6.9 169 176 A P H >> S+ 0 0 1 0, 0.0 3,-1.5 0, 0.0 4,-1.0 0.854 108.6 65.7 -54.9 -36.9 6.4 -6.2 -10.2 170 177 A E H >> S+ 0 0 4 1,-0.3 4,-2.3 2,-0.2 3,-0.5 0.812 92.9 60.4 -69.6 -22.3 10.0 -5.4 -10.9 171 178 A L H <4 S+ 0 0 7 -3,-1.5 -1,-0.3 1,-0.2 6,-0.0 0.857 108.2 45.4 -73.7 -19.5 11.1 -7.5 -8.0 172 179 A L H << S+ 0 0 52 -3,-1.5 -1,-0.2 -4,-0.7 -2,-0.2 0.657 123.7 33.6 -84.1 -15.6 9.5 -10.6 -9.6 173 180 A K H << S+ 0 0 104 -4,-1.0 2,-0.3 -3,-0.5 -2,-0.2 0.686 105.6 64.3-119.1 -25.2 10.9 -9.9 -13.0 174 181 A R < - 0 0 113 -4,-2.3 3,-0.1 -5,-0.2 -1,-0.0 -0.757 62.3-140.0-118.3 156.1 14.3 -8.2 -12.8 175 182 A R S S+ 0 0 207 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.793 95.3 15.5 -84.2 -30.3 17.7 -9.4 -11.4 176 183 A E S S+ 0 0 76 -6,-0.1 -1,-0.3 -3,-0.0 2,-0.3 -0.987 72.9 169.5-144.2 144.2 18.4 -6.0 -9.9 177 184 A F B -K 157 0F 4 -20,-2.1 -20,-2.5 -2,-0.3 2,-0.3 -0.952 39.2 -89.8-152.1 162.9 16.1 -3.1 -9.2 178 185 A H > - 0 0 85 -2,-0.3 4,-0.8 -22,-0.2 -22,-0.1 -0.640 28.7-141.2 -82.3 141.4 16.1 0.3 -7.3 179 186 A A H > S+ 0 0 0 -24,-0.4 4,-1.7 -2,-0.3 3,-0.4 0.896 91.6 62.2 -65.9 -42.8 14.9 0.1 -3.6 180 187 A E H >> S+ 0 0 58 1,-0.3 4,-1.9 2,-0.2 3,-1.3 0.960 101.3 47.3 -57.1 -57.1 13.0 3.3 -3.5 181 188 A P H 3> S+ 0 0 28 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.800 106.7 60.1 -54.3 -30.3 10.3 2.5 -6.2 182 189 A V H 3X S+ 0 0 9 -4,-0.8 4,-1.8 -3,-0.4 -2,-0.2 0.900 108.3 44.3 -65.6 -39.3 9.7 -0.9 -4.5 183 190 A D H S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 5,-0.5 0.943 109.5 49.4 -57.5 -46.9 -5.7 0.6 -1.7 193 200 A A H X5S+ 0 0 5 -4,-2.5 4,-1.9 1,-0.3 3,-0.3 0.889 111.6 50.0 -59.9 -40.1 -6.2 -1.6 1.3 194 201 A M H <5S+ 0 0 1 -4,-2.4 -99,-0.7 1,-0.2 -1,-0.3 0.792 115.1 41.8 -67.6 -29.1 -7.2 1.4 3.4 195 202 A L H <5S+ 0 0 16 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.639 131.0 19.7-101.8 -9.0 -9.7 2.7 0.9 196 203 A A H <5S- 0 0 0 -4,-1.6 -102,-0.2 -3,-0.3 -3,-0.2 0.481 89.7-126.9-135.8 -23.6 -11.4 -0.6 -0.2 197 204 A G S < - 0 0 14 -2,-1.8 3,-1.8 1,-0.1 7,-0.2 -0.864 67.3-125.4-103.0 139.9 2.5 -11.1 -12.2 206 213 A D T 3 S+ 0 0 96 -2,-0.4 6,-0.1 1,-0.3 -1,-0.1 0.841 114.3 65.2 -36.2 -42.0 1.4 -11.2 -15.9 207 214 A S T 3 S+ 0 0 113 4,-0.1 2,-0.4 5,-0.0 -1,-0.3 0.184 87.5 86.8 -67.9 16.0 0.0 -14.7 -14.8 208 215 A C <> - 0 0 13 -3,-1.8 4,-1.8 1,-0.1 3,-0.1 -0.989 68.0-149.5-132.3 127.7 -2.5 -13.0 -12.4 209 216 A Q H > S+ 0 0 123 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.860 93.1 49.5 -67.1 -47.2 -5.9 -11.9 -13.6 210 217 A E H > S+ 0 0 93 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.874 112.3 50.7 -64.8 -33.5 -6.7 -9.0 -11.4 211 218 A Y H > S+ 0 0 1 -6,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.894 108.5 51.0 -71.3 -38.5 -3.3 -7.6 -12.1 212 219 A S H X S+ 0 0 23 -4,-1.8 4,-1.9 -7,-0.2 -2,-0.2 0.939 109.1 53.5 -60.7 -38.8 -3.8 -8.0 -15.8 213 220 A D H <>S+ 0 0 21 -4,-2.5 5,-2.6 1,-0.2 -2,-0.2 0.845 106.0 51.0 -65.6 -40.8 -7.1 -6.2 -15.3 214 221 A W H ><5S+ 0 0 11 -4,-1.8 3,-2.1 3,-0.2 -1,-0.2 0.921 107.7 51.6 -61.9 -48.4 -5.5 -3.2 -13.6 215 222 A K H 3<5S+ 0 0 73 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.866 108.9 53.2 -60.4 -34.1 -2.9 -2.7 -16.4 216 223 A E T 3<5S- 0 0 123 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.323 115.5-124.4 -74.8 2.8 -5.9 -2.7 -18.8 217 224 A K T < 5 + 0 0 144 -3,-2.1 2,-2.2 1,-0.2 -3,-0.2 0.711 52.3 160.0 59.4 26.6 -7.4 0.0 -16.6 218 225 A K > < + 0 0 59 -5,-2.6 3,-0.9 1,-0.2 -1,-0.2 -0.524 5.7 157.1 -74.9 73.8 -10.6 -1.9 -16.0 219 226 A T T 3 + 0 0 43 -2,-2.2 -1,-0.2 1,-0.2 -5,-0.1 0.203 54.1 83.1 -92.9 11.3 -11.3 0.2 -12.9 220 227 A Y T 3 S+ 0 0 151 4,-0.1 -1,-0.2 5,-0.0 -2,-0.1 0.534 82.9 91.4 -79.7 -17.6 -15.1 -0.6 -13.1 221 228 A L S <> S- 0 0 55 -3,-0.9 4,-2.1 -8,-0.1 5,-0.2 -0.211 92.3 -72.0 -88.3-173.6 -14.0 -3.8 -11.2 222 229 A N T 4 S+ 0 0 74 1,-0.2 4,-0.2 2,-0.2 -3,-0.1 0.251 113.8 32.4 -96.2 -11.6 -13.7 -4.6 -7.7 223 230 A P T >4 S+ 0 0 13 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.868 124.9 45.7 -68.0 -50.3 -11.0 -3.1 -5.6 224 231 A W G >> S+ 0 0 8 1,-0.3 3,-2.6 2,-0.2 4,-0.7 0.749 99.0 64.9 -73.4 -37.0 -11.0 0.2 -7.7 225 232 A K G 3< S+ 0 0 130 -4,-2.1 -1,-0.3 1,-0.3 -3,-0.1 0.813 99.5 56.7 -50.9 -36.4 -14.8 0.9 -8.0 226 233 A K G <4 S+ 0 0 68 -3,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.394 98.5 71.6 -72.7 -4.1 -14.9 1.5 -4.2 227 234 A I T <4 S- 0 0 7 -3,-2.6 -2,-0.2 -4,-0.1 -1,-0.1 0.949 84.4-122.0 -97.9 -64.4 -12.3 4.2 -4.3 228 235 A D X - 0 0 76 -4,-0.7 4,-2.6 1,-0.2 5,-0.2 -0.045 28.1 -91.7 114.8 138.7 -13.1 7.5 -5.8 229 236 A S H > S+ 0 0 83 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.688 114.6 47.0 -72.5 -35.6 -11.7 9.4 -8.4 230 237 A A H > S+ 0 0 3 2,-0.2 4,-1.1 1,-0.2 27,-0.4 0.955 117.5 39.5 -67.9 -58.5 -9.1 11.5 -6.6 231 238 A P H > S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 3,-0.5 0.904 114.7 56.2 -58.0 -33.9 -7.4 8.9 -4.5 232 239 A L H X S+ 0 0 23 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.832 101.6 57.7 -57.0 -39.9 -7.7 6.5 -7.5 233 240 A A H < S+ 0 0 27 -4,-1.6 4,-0.4 -3,-0.3 -1,-0.2 0.786 107.6 47.1 -60.1 -34.8 -5.8 9.1 -9.7 234 241 A L H >X S+ 0 0 0 -4,-1.1 4,-1.8 -3,-0.5 3,-0.5 0.876 108.4 54.1 -78.0 -37.5 -2.9 8.9 -7.2 235 242 A L H 3X S+ 0 0 0 -4,-1.8 4,-3.3 1,-0.3 -2,-0.2 0.877 102.5 58.7 -65.8 -34.8 -3.1 5.1 -7.2 236 243 A H H 3< S+ 0 0 65 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.728 108.8 47.0 -64.6 -20.4 -2.8 5.3 -11.1 237 244 A K H <4 S+ 0 0 78 -3,-0.5 10,-1.7 -4,-0.4 3,-0.4 0.882 116.1 40.8 -92.2 -25.6 0.4 7.0 -10.5 238 245 A I H < S+ 0 0 0 -4,-1.8 2,-1.9 1,-0.2 -2,-0.2 0.866 107.6 57.9 -88.1 -43.7 1.9 4.8 -7.9 239 246 A L S < S+ 0 0 4 -4,-3.3 2,-0.4 -5,-0.2 -1,-0.2 -0.329 72.1 137.6 -93.9 65.5 0.9 1.4 -9.2 240 247 A V - 0 0 41 -2,-1.9 6,-0.1 -3,-0.4 -55,-0.1 -0.864 51.0-139.6-102.8 136.8 2.7 1.9 -12.6 241 248 A E S S+ 0 0 66 -2,-0.4 -71,-0.2 4,-0.1 -1,-0.1 0.822 84.6 74.1 -75.4 -32.5 4.6 -1.3 -13.7 242 249 A N S >> S- 0 0 76 1,-0.2 3,-1.8 -73,-0.1 4,-1.2 -0.714 76.1-148.6 -85.5 117.3 7.7 0.3 -15.1 243 250 A P T 34 S+ 0 0 11 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.730 93.7 57.6 -56.6 -25.2 9.6 1.4 -11.9 244 251 A S T 34 S+ 0 0 99 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.652 107.5 43.5 -76.3 -25.2 11.0 4.4 -13.9 245 252 A A T <4 S+ 0 0 68 -3,-1.8 -1,-0.2 2,-0.1 2,-0.1 0.571 91.5 112.4 -95.7 -10.3 7.8 5.8 -14.9 246 253 A R S < S- 0 0 8 -4,-1.2 -8,-0.2 -6,-0.1 -9,-0.1 -0.419 77.6-103.4 -62.2 131.8 6.4 5.3 -11.4 247 254 A I - 0 0 22 -10,-1.7 2,-0.2 -2,-0.1 -1,-0.1 -0.092 35.5-137.7 -52.7 153.1 5.7 8.5 -9.4 248 255 A T >> - 0 0 70 1,-0.1 4,-1.9 -3,-0.1 3,-0.5 -0.638 23.1-102.6-111.7 174.8 8.2 9.4 -6.7 249 256 A I H >> S+ 0 0 11 1,-0.3 4,-2.0 2,-0.2 3,-1.5 0.966 117.6 56.4 -66.2 -56.1 7.6 10.6 -3.3 250 257 A P H 34 S+ 0 0 91 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.810 113.7 47.2 -46.9 -28.0 8.4 14.3 -3.8 251 258 A D H X> S+ 0 0 67 -3,-0.5 3,-0.8 1,-0.2 4,-0.5 0.752 102.0 60.3 -83.6 -28.7 5.7 14.0 -6.5 252 259 A I H X< S+ 0 0 0 -4,-1.9 3,-1.5 -3,-1.5 6,-0.2 0.918 99.8 61.3 -57.7 -35.9 3.2 12.2 -4.3 253 260 A K T 3< S+ 0 0 94 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.685 105.2 44.8 -71.8 -11.4 3.4 15.3 -2.1 254 261 A K T <4 S+ 0 0 157 -3,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.525 85.4 123.5-103.7 -5.9 2.1 17.5 -4.9 255 262 A D 4 S+ 0 0 0 -27,-0.4 3,-1.1 1,-0.2 -1,-0.2 0.852 109.6 59.5 -74.1 -36.4 -5.8 14.1 -3.4 258 265 A Y T 34 S+ 0 0 25 1,-0.3 -1,-0.2 -6,-0.2 -2,-0.2 0.801 114.4 38.2 -57.5 -32.1 -2.7 14.0 -1.2 259 266 A N T 3< S+ 0 0 98 -4,-1.3 -1,-0.3 -3,-0.1 -2,-0.2 0.311 90.0 119.2-104.2 1.8 -3.2 17.8 -0.7 260 267 A K < - 0 0 89 -3,-1.1 2,-0.3 -4,-0.1 -3,-0.1 -0.543 68.1-121.6 -72.2 127.6 -7.1 17.6 -0.5 261 268 A P + 0 0 120 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.588 55.7 136.5 -72.3 130.8 -8.5 18.9 2.8 262 269 A L + 0 0 52 -2,-0.3 2,-0.5 1,-0.1 -163,-0.1 0.544 44.1 79.4-139.5 -34.1 -10.6 16.2 4.5 263 270 A K - 0 0 105 -165,-0.1 -1,-0.1 -164,-0.0 0, 0.0 -0.837 53.4-147.6-123.5 119.5 -9.8 16.1 8.2 264 271 A K 0 0 192 -2,-0.5 -1,-0.0 1,-0.1 -2,-0.0 -0.058 360.0 360.0 -58.9 156.8 -10.6 17.9 11.5 265 272 A G 0 0 131 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.000 360.0 360.0 -85.1 360.0 -8.1 18.3 14.4