==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-JUL-06 2IZR . COMPND 2 MOLECULE: CASEIN KINASE I ISOFORM GAMMA-3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.BUNKOCZI,E.SALAH,P.RELLOS,S.DAS,O.FEDOROV,P.SAVITSKY, . 298 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14400.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 13 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 2 0 0 1 0 0 0 1 1 0 2 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 2 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 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 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 36 A V 0 0 116 0, 0.0 9,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 146.6 28.4 28.8 30.6 2 37 A L + 0 0 148 7,-0.1 8,-2.2 1,-0.0 2,-0.3 0.655 360.0 37.9 -81.7 -22.6 26.6 28.5 33.9 3 38 A M E -A 9 0A 66 6,-0.3 2,-0.4 22,-0.0 6,-0.2 -0.933 53.1-153.6-136.3 149.7 25.6 32.1 34.6 4 39 A V E >> S-A 8 0A 0 4,-3.2 4,-1.9 -2,-0.3 3,-0.5 -0.999 75.0 -22.7-122.8 128.7 24.4 35.3 33.0 5 40 A G T 34 S- 0 0 26 67,-0.6 64,-0.0 -2,-0.4 66,-0.0 -0.227 109.9 -48.6 64.0-162.5 25.3 38.5 34.7 6 41 A P T 34 S+ 0 0 87 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.746 134.3 16.5 -69.8 -24.5 26.1 38.4 38.5 7 42 A N T <4 S+ 0 0 22 -3,-0.5 21,-2.7 1,-0.0 2,-0.7 0.425 89.1 102.9-141.2 -1.5 23.1 36.4 39.5 8 43 A F E < -AB 4 27A 6 -4,-1.9 -4,-3.2 19,-0.2 2,-0.3 -0.865 50.9-151.9-103.4 113.7 21.2 34.5 36.8 9 44 A R E -AB 3 26A 108 17,-2.7 17,-1.8 -2,-0.7 2,-0.5 -0.638 19.2-129.7 -76.4 133.8 21.8 30.7 36.5 10 45 A V E + B 0 25A 28 -8,-2.2 15,-0.2 -2,-0.3 2,-0.1 -0.766 34.5 176.3 -90.0 124.2 21.2 29.5 32.9 11 46 A G E - 0 0 23 13,-2.9 3,-0.1 -2,-0.5 14,-0.1 -0.120 32.9 -34.9-110.0-153.1 18.9 26.5 32.7 12 47 A K E - 0 0 90 11,-0.1 12,-2.7 1,-0.1 -1,-0.2 -0.193 62.2 -94.9 -73.6 156.6 17.3 24.3 30.1 13 48 A K E - B 0 23A 100 10,-0.2 2,-0.3 1,-0.0 10,-0.3 -0.493 51.2-167.6 -63.0 135.0 16.1 25.2 26.6 14 49 A I + 0 0 15 8,-2.2 8,-0.2 -2,-0.2 6,-0.2 -0.860 35.0 30.6-131.2 164.8 12.3 25.9 26.8 15 50 A G 0 0 64 -2,-0.3 7,-0.1 3,-0.1 282,-0.0 0.084 360.0 360.0 74.2 167.7 9.4 26.4 24.5 16 51 A C 0 0 155 2,-0.1 -2,-0.0 3,-0.1 0, 0.0 -0.764 360.0 360.0 -95.2 360.0 8.8 24.8 21.1 17 ! 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 18 53 A N > 0 0 87 0, 0.0 3,-1.0 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 -47.3 13.4 28.2 19.5 19 54 A F T 3 - 0 0 107 1,-0.3 -3,-0.1 2,-0.1 -6,-0.0 0.876 360.0 -39.3 60.4 43.6 16.5 26.0 18.9 20 55 A G T 3 S+ 0 0 13 2,-0.2 -1,-0.3 -6,-0.2 18,-0.1 0.444 112.7 114.7 84.9 1.8 18.3 27.2 22.0 21 56 A E S < S+ 0 0 38 -3,-1.0 17,-2.7 1,-0.2 2,-0.4 0.757 76.5 45.0 -71.6 -23.8 17.2 30.8 21.6 22 57 A L E + C 0 37A 50 -8,-0.2 -8,-2.2 15,-0.2 2,-0.3 -0.986 66.8 173.3-130.7 125.6 15.2 30.6 24.8 23 58 A R E -BC 13 36A 73 13,-2.6 13,-2.8 -2,-0.4 -10,-0.2 -0.938 33.3-115.2-125.9 151.8 16.2 29.2 28.2 24 59 A L E - C 0 35A 17 -12,-2.7 -13,-2.9 -2,-0.3 2,-0.3 -0.589 40.9-176.6 -71.5 142.9 14.8 29.0 31.6 25 60 A G E -BC 10 34A 1 9,-2.5 9,-2.3 -2,-0.2 2,-0.4 -0.907 18.0-141.5-134.7 172.5 16.9 30.9 34.2 26 61 A K E -BC 9 33A 43 -17,-1.8 -17,-2.7 -2,-0.3 2,-1.0 -0.990 14.1-137.3-139.2 126.5 16.9 31.5 37.9 27 62 A N E >>> -BC 8 32A 16 5,-3.3 4,-1.6 -2,-0.4 5,-1.3 -0.736 21.0-167.4 -74.3 102.1 17.8 34.7 39.8 28 63 A L T 345S+ 0 0 88 -21,-2.7 -1,-0.2 -2,-1.0 -20,-0.1 0.764 82.9 58.5 -64.8 -27.7 19.8 33.0 42.5 29 64 A Y T 345S+ 0 0 176 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.794 121.4 23.3 -72.2 -30.1 19.8 36.2 44.6 30 65 A T T <45S- 0 0 69 -3,-0.6 -2,-0.2 -23,-0.2 -1,-0.2 0.409 99.5-121.5-117.8 -1.0 16.0 36.3 44.8 31 66 A N T <5 + 0 0 118 -4,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.924 67.3 134.7 56.1 46.4 14.9 32.7 44.2 32 67 A E E < -C 27 0A 95 -5,-1.3 -5,-3.3 0, 0.0 -1,-0.2 -0.992 54.3-125.4-127.4 138.2 12.8 33.6 41.1 33 68 A Y E +C 26 0A 81 -2,-0.4 50,-0.5 -7,-0.2 2,-0.3 -0.477 32.7 177.6 -77.1 149.3 12.6 32.0 37.7 34 69 A V E -CD 25 82A 4 -9,-2.3 -9,-2.5 48,-0.2 2,-0.4 -0.875 30.4-108.5-141.8 168.2 13.2 34.2 34.6 35 70 A A E -CD 24 81A 9 46,-3.1 46,-2.7 -2,-0.3 2,-0.5 -0.879 26.1-156.8-100.2 138.3 13.3 33.8 30.8 36 71 A I E -CD 23 80A 0 -13,-2.8 -13,-2.6 -2,-0.4 2,-0.5 -0.973 3.2-163.0-119.3 116.0 16.7 34.1 29.1 37 72 A K E -CD 22 79A 59 42,-2.9 42,-2.4 -2,-0.5 2,-0.4 -0.845 12.7-164.3 -97.1 129.2 16.8 35.1 25.4 38 73 A L E - D 0 78A 17 -17,-2.7 40,-0.2 -2,-0.5 -2,-0.0 -0.921 14.2-178.0-119.4 142.4 20.1 34.4 23.7 39 74 A E E - D 0 77A 26 38,-2.5 38,-3.0 -2,-0.4 -2,-0.0 -0.983 34.9-111.7-136.4 127.4 21.5 35.6 20.4 40 75 A P E > - D 0 76A 64 0, 0.0 3,-1.8 0, 0.0 36,-0.3 -0.261 17.6-133.3 -56.3 139.0 24.8 34.5 19.0 41 76 A M T 3 S+ 0 0 90 34,-3.0 35,-0.1 1,-0.3 33,-0.0 0.805 107.8 60.3 -60.7 -27.6 27.4 37.2 19.0 42 77 A K T 3 S+ 0 0 199 33,-0.4 -1,-0.3 3,-0.0 34,-0.1 0.379 75.8 141.9 -79.6 4.1 28.2 36.1 15.4 43 78 A S < - 0 0 41 -3,-1.8 -4,-0.0 1,-0.2 0, 0.0 -0.168 47.3-150.2 -53.2 135.0 24.6 36.8 14.2 44 79 A R S S+ 0 0 133 1,-0.3 -1,-0.2 2,-0.0 -3,-0.0 0.570 95.7 33.7 -81.1 -9.7 24.5 38.3 10.7 45 80 A A S S- 0 0 69 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.576 84.0-163.1-143.6 72.2 21.4 40.2 11.7 46 81 A P + 0 0 82 0, 0.0 -5,-0.0 0, 0.0 -7,-0.0 -0.350 24.7 154.3 -65.2 139.1 21.5 41.2 15.3 47 82 A Q > + 0 0 91 3,-0.1 4,-2.2 -2,-0.1 5,-0.1 0.500 50.5 82.0-134.4 -19.9 18.2 42.2 16.9 48 83 A L H > S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.889 92.3 48.6 -68.7 -42.3 18.5 41.6 20.7 49 84 A H H > S+ 0 0 104 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.921 112.8 48.4 -65.7 -41.3 20.3 44.8 21.7 50 85 A L H > S+ 0 0 75 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.908 110.0 53.6 -62.6 -38.0 17.9 47.0 19.7 51 86 A E H X S+ 0 0 3 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.938 106.9 51.2 -59.3 -46.8 15.1 45.1 21.3 52 87 A Y H X S+ 0 0 71 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.916 107.9 52.9 -56.0 -43.0 16.5 45.8 24.8 53 88 A R H X S+ 0 0 60 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.895 106.6 51.9 -63.7 -37.3 16.7 49.5 23.8 54 89 A F H X S+ 0 0 35 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.917 107.9 52.7 -64.9 -41.1 13.0 49.5 22.8 55 90 A Y H X S+ 0 0 12 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.896 107.4 51.9 -59.4 -38.3 12.2 48.0 26.2 56 91 A K H < S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.899 110.3 48.5 -65.0 -38.9 14.1 50.8 27.9 57 92 A Q H < S+ 0 0 65 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.872 110.5 51.5 -66.8 -37.5 12.1 53.4 25.9 58 93 A L H < S- 0 0 0 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.862 92.7-172.7 -65.1 -37.4 8.8 51.6 26.9 59 94 A G < - 0 0 35 -4,-2.0 2,-0.4 -5,-0.2 -1,-0.1 -0.148 44.3 -22.3 67.7-167.2 9.7 51.7 30.6 60 95 A S S S+ 0 0 122 -4,-0.1 2,-0.3 6,-0.0 6,-0.1 -0.593 80.1 154.1 -80.9 125.8 7.6 49.9 33.2 61 96 A G > - 0 0 21 -2,-0.4 3,-1.9 3,-0.3 2,-0.1 -0.992 49.3 -82.6-152.8 160.2 4.1 49.3 32.1 62 97 A D T 3 S+ 0 0 138 -2,-0.3 55,-0.1 1,-0.3 0, 0.0 -0.392 115.3 8.2 -62.1 127.6 1.0 47.1 32.5 63 98 A G T 3 S+ 0 0 6 1,-0.2 85,-2.3 -2,-0.1 -1,-0.3 0.630 100.5 115.8 74.2 16.7 1.3 44.0 30.4 64 99 A I S < S- 0 0 12 -3,-1.9 -3,-0.3 83,-0.2 -1,-0.2 -0.971 70.6-117.6-112.8 125.9 4.9 44.7 29.5 65 100 A P - 0 0 5 0, 0.0 2,-0.2 0, 0.0 -4,-0.0 -0.332 28.9-111.7 -62.0 144.0 7.4 42.1 30.8 66 101 A Q - 0 0 110 -6,-0.1 16,-2.8 17,-0.1 2,-0.4 -0.511 27.3-147.1 -66.8 141.2 10.0 43.4 33.2 67 102 A V E +E 81 0A 36 14,-0.2 14,-0.3 -2,-0.2 3,-0.1 -0.954 19.4 176.6-115.3 132.7 13.5 43.3 31.8 68 103 A Y E + 0 0 80 12,-3.2 2,-0.3 -2,-0.4 13,-0.2 0.705 56.3 0.1-108.6 -26.1 16.3 42.6 34.3 69 104 A Y E -E 80 0A 62 11,-1.3 11,-2.7 2,-0.0 2,-0.4 -0.972 40.6-165.3-166.7 144.2 19.6 42.4 32.4 70 105 A F E +E 79 0A 39 -2,-0.3 9,-0.2 9,-0.2 7,-0.0 -0.981 44.0 103.3-134.5 130.0 21.3 42.6 29.0 71 106 A G E -E 78 0A 5 7,-2.3 7,-2.6 -2,-0.4 2,-0.1 -0.988 63.8 -51.0 176.8 179.1 24.8 41.4 28.6 72 107 A P E +E 77 0A 81 0, 0.0 -67,-0.6 0, 0.0 2,-0.3 -0.361 33.1 179.3 -75.7 151.1 27.2 38.7 27.4 73 108 A C E > -E 76 0A 8 3,-2.8 3,-1.9 1,-0.3 -69,-0.1 -0.833 65.2 -58.3-149.0 100.9 26.9 35.0 28.2 74 109 A G T 3 S- 0 0 44 -2,-0.3 -1,-0.3 1,-0.3 -70,-0.0 -0.362 121.3 -16.3 54.7-129.8 29.7 33.0 26.6 75 110 A K T 3 S+ 0 0 121 -3,-0.1 -34,-3.0 2,-0.0 -33,-0.4 0.109 127.4 83.2 -91.0 23.0 29.5 33.5 22.8 76 111 A Y E < S-DE 40 73A 100 -3,-1.9 -3,-2.8 -36,-0.3 2,-0.4 -0.889 72.7-132.1-121.6 151.8 26.0 35.0 23.1 77 112 A N E -DE 39 72A 44 -38,-3.0 -38,-2.5 -2,-0.3 2,-0.4 -0.868 36.1-160.3 -91.4 142.2 24.3 38.2 23.9 78 113 A A E -DE 38 71A 0 -7,-2.6 -7,-2.3 -2,-0.4 2,-0.4 -0.959 19.4-163.9-129.3 141.4 21.6 37.6 26.5 79 114 A M E -DE 37 70A 0 -42,-2.4 -42,-2.9 -2,-0.4 2,-0.5 -0.997 13.4-154.4-124.2 127.2 18.5 39.4 27.7 80 115 A V E +DE 36 69A 0 -11,-2.7 -12,-3.2 -2,-0.4 -11,-1.3 -0.882 26.1 162.4-104.3 123.0 17.0 38.3 31.0 81 116 A L E -DE 35 67A 16 -46,-2.7 -46,-3.1 -2,-0.5 -14,-0.2 -0.873 44.0 -66.5-137.8 168.3 13.3 39.1 31.3 82 117 A E E -D 34 0A 28 -16,-2.8 2,-0.5 -2,-0.3 -48,-0.2 -0.321 49.5-121.7 -54.2 132.9 10.2 38.2 33.3 83 118 A L - 0 0 11 -50,-0.5 54,-0.3 -58,-0.1 2,-0.2 -0.689 38.4-173.8 -78.8 122.9 9.0 34.6 32.8 84 119 A L - 0 0 16 -2,-0.5 52,-0.3 1,-0.2 3,-0.1 -0.450 21.3-102.1-107.7-179.6 5.4 34.7 31.5 85 120 A G - 0 0 17 50,-3.1 -1,-0.2 1,-0.2 52,-0.1 -0.065 61.2 -44.3 -88.6-165.0 2.8 32.1 30.8 86 121 A P - 0 0 12 0, 0.0 49,-2.3 0, 0.0 -1,-0.2 -0.161 59.9-109.3 -64.2 157.9 1.7 30.6 27.5 87 122 A S B > -F 134 0B 8 47,-0.2 4,-2.7 1,-0.1 47,-0.3 -0.402 28.2-107.6 -79.2 164.8 1.0 32.6 24.4 88 123 A L H > S+ 0 0 0 45,-2.7 4,-2.4 42,-1.1 43,-0.2 0.834 122.6 54.8 -61.1 -33.7 -2.4 33.2 22.9 89 124 A E H > S+ 0 0 21 41,-0.9 4,-2.3 44,-0.3 -1,-0.2 0.927 108.5 47.7 -65.4 -42.9 -1.5 30.7 20.1 90 125 A D H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.923 115.7 45.3 -58.2 -45.9 -0.7 28.0 22.7 91 126 A L H X S+ 0 0 0 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.855 108.8 56.0 -68.7 -36.1 -4.0 28.8 24.4 92 127 A F H <>S+ 0 0 0 -4,-2.4 5,-2.9 -5,-0.2 6,-0.4 0.935 107.5 49.3 -60.9 -46.6 -5.9 28.8 21.1 93 128 A D H ><5S+ 0 0 80 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.907 108.8 53.1 -57.8 -45.2 -4.6 25.3 20.4 94 129 A L H 3<5S+ 0 0 54 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.812 108.1 51.7 -59.4 -30.7 -5.7 24.2 23.9 95 130 A C T ><5S- 0 0 12 -4,-1.6 3,-0.7 -3,-0.3 -1,-0.3 0.055 124.6-101.7 -96.8 22.5 -9.2 25.6 23.1 96 131 A D T < 5 - 0 0 140 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.786 69.1 -66.8 63.5 29.4 -9.5 23.7 19.8 97 132 A R T 3 - 0 0 46 -2,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.256 29.6-110.5 -62.3 157.3 -15.6 32.7 22.3 101 136 A L H > S+ 0 0 23 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.901 119.4 56.3 -57.8 -42.7 -16.7 36.2 21.7 102 137 A K H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.945 109.9 44.4 -57.0 -46.8 -16.4 36.9 25.5 103 138 A T H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.932 113.5 50.4 -63.7 -44.7 -12.7 35.8 25.5 104 139 A V H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 -1,-0.2 0.898 111.4 48.6 -61.6 -41.5 -11.9 37.7 22.3 105 140 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 5,-0.3 0.895 109.4 51.2 -68.0 -38.8 -13.4 40.9 23.7 106 141 A M H X S+ 0 0 0 -4,-2.4 4,-1.5 -5,-0.2 -2,-0.2 0.935 115.7 43.8 -61.3 -41.8 -11.5 40.5 27.0 107 142 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.947 114.7 49.2 -62.3 -49.4 -8.3 40.1 24.9 108 143 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 5,-0.2 0.885 107.2 52.7 -62.7 -43.4 -9.2 42.9 22.5 109 144 A I H X S+ 0 0 21 -4,-2.8 4,-1.4 1,-0.2 -1,-0.2 0.934 114.7 44.1 -59.2 -44.9 -10.1 45.5 25.2 110 145 A Q H X S+ 0 0 16 -4,-1.5 4,-2.3 -5,-0.3 -2,-0.2 0.900 112.5 50.6 -63.7 -44.4 -6.7 44.9 26.8 111 146 A L H X S+ 0 0 1 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.810 104.0 56.9 -73.8 -28.2 -4.7 44.8 23.6 112 147 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.949 113.0 43.5 -59.9 -45.2 -6.2 48.2 22.3 113 148 A S H X S+ 0 0 39 -4,-1.4 4,-2.5 -5,-0.2 -2,-0.2 0.890 111.3 53.5 -65.3 -40.4 -4.8 49.6 25.6 114 149 A R H X S+ 0 0 20 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.940 112.2 44.7 -62.3 -44.0 -1.5 47.8 25.3 115 150 A M H X S+ 0 0 1 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.893 109.5 55.5 -69.0 -38.7 -1.0 49.2 21.8 116 151 A E H X S+ 0 0 56 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.912 108.1 49.9 -55.6 -44.9 -2.1 52.6 23.0 117 152 A Y H X S+ 0 0 54 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.955 111.0 47.9 -58.4 -50.8 0.7 52.4 25.6 118 153 A V H ><>S+ 0 0 0 -4,-2.2 5,-1.6 1,-0.2 3,-1.4 0.952 113.5 48.0 -55.9 -48.3 3.3 51.4 23.1 119 154 A H H ><5S+ 0 0 3 -4,-2.9 3,-1.7 1,-0.3 -1,-0.2 0.834 104.2 60.9 -63.0 -32.5 2.2 54.2 20.8 120 155 A S H 3<5S+ 0 0 70 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.702 100.0 56.2 -67.7 -20.7 2.3 56.7 23.7 121 156 A K T <<5S- 0 0 81 -3,-1.4 -1,-0.3 -4,-0.9 -2,-0.2 0.092 125.0-104.3 -95.6 16.2 6.0 55.9 24.0 122 157 A N T < 5S+ 0 0 58 -3,-1.7 35,-1.9 1,-0.2 36,-0.8 0.653 83.3 120.9 71.9 21.5 6.6 56.9 20.4 123 158 A L E < -H 156 0C 0 -5,-1.6 2,-0.3 33,-0.3 -1,-0.2 -0.885 50.3-154.0-116.3 145.8 6.9 53.3 19.1 124 159 A I E -H 155 0C 0 31,-2.8 31,-2.1 -2,-0.4 69,-0.1 -0.873 13.1-148.8-108.0 151.1 5.0 51.3 16.6 125 160 A Y - 0 0 0 -2,-0.3 28,-0.2 29,-0.2 -1,-0.1 0.924 14.6-176.7 -92.3 -55.2 5.1 47.5 17.1 126 161 A R + 0 0 56 66,-0.1 -1,-0.0 1,-0.1 55,-0.0 0.537 60.8 81.8 71.0 13.5 4.9 46.0 13.7 127 162 A D + 0 0 10 49,-0.1 2,-0.3 2,-0.0 5,-0.1 -0.073 51.6 164.0-141.3 42.8 4.8 42.3 14.8 128 163 A V + 0 0 9 49,-0.1 52,-0.2 3,-0.1 49,-0.1 -0.428 19.2 128.5 -64.7 127.4 1.2 41.5 15.8 129 164 A K > - 0 0 50 -2,-0.3 3,-2.0 50,-0.1 4,-0.2 -0.910 67.8-107.3-170.0 153.7 0.6 37.7 16.0 130 165 A P G > S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 -42,-1.1 0.783 114.0 66.3 -61.0 -28.2 -0.9 35.4 18.6 131 166 A E G 3 S+ 0 0 80 1,-0.2 -3,-0.1 -43,-0.2 -41,-0.0 0.682 97.0 56.9 -62.1 -19.1 2.6 34.0 19.5 132 167 A N G < S+ 0 0 8 -3,-2.0 17,-2.3 -5,-0.1 2,-0.5 0.314 90.8 76.8-102.7 8.8 3.6 37.5 20.8 133 168 A F E < + G 0 148B 0 -3,-1.3 -45,-2.7 15,-0.2 2,-0.4 -0.986 62.8 179.5-120.3 119.4 0.8 37.9 23.4 134 169 A L E -FG 87 147B 25 13,-1.5 13,-3.3 -2,-0.5 -47,-0.2 -0.944 24.7-131.0-124.1 140.2 1.4 35.9 26.6 135 170 A I E - G 0 146B 4 -49,-2.3 -50,-3.1 -2,-0.4 8,-0.2 -0.381 36.5-107.6 -74.7 165.7 -0.6 35.6 29.8 136 171 A G - 0 0 2 6,-1.1 -1,-0.1 9,-0.5 7,-0.1 -0.103 30.6 -98.2 -77.3-175.3 1.3 35.9 33.1 137 172 A R > > - 0 0 67 -54,-0.3 3,-1.6 -52,-0.1 5,-1.1 -0.881 27.1-121.9-101.8 144.9 2.2 33.3 35.7 138 173 A P G > 5S+ 0 0 103 0, 0.0 3,-2.6 0, 0.0 5,-0.2 0.874 106.8 68.9 -50.1 -42.0 0.1 32.8 38.8 139 174 A G G 3 5S+ 0 0 69 1,-0.3 -3,-0.0 2,-0.1 0, 0.0 0.718 102.2 44.0 -55.6 -27.1 3.1 33.5 41.1 140 175 A N G < 5S- 0 0 69 -3,-1.6 -1,-0.3 0, 0.0 -4,-0.0 0.256 109.2-119.7-101.5 11.2 3.1 37.2 40.0 141 176 A K T < 5S+ 0 0 68 -3,-2.6 -2,-0.1 -4,-0.2 3,-0.1 0.731 92.6 99.3 59.7 21.7 -0.7 37.7 40.3 142 177 A T > < + 0 0 36 -5,-1.1 3,-1.8 1,-0.1 -6,-1.1 0.139 33.8 115.3-122.5 19.1 -0.7 38.6 36.6 143 178 A Q T 3 S+ 0 0 79 -6,-0.3 -1,-0.1 1,-0.3 -7,-0.1 0.760 80.4 53.2 -59.2 -22.9 -1.9 35.3 35.1 144 179 A Q T 3 S+ 0 0 51 -9,-0.1 2,-0.4 -7,-0.1 -1,-0.3 0.578 91.2 93.7 -83.5 -15.5 -5.1 37.1 34.0 145 180 A V S < S- 0 0 24 -3,-1.8 2,-0.7 1,-0.0 -9,-0.5 -0.720 71.1-136.7 -91.4 130.6 -3.2 39.9 32.2 146 181 A I E -G 135 0B 0 -2,-0.4 2,-0.2 -11,-0.2 -11,-0.2 -0.743 28.8-164.4 -82.7 117.5 -2.4 39.7 28.4 147 182 A H E -G 134 0B 7 -13,-3.3 -13,-1.5 -2,-0.7 2,-0.4 -0.672 12.6-134.0 -98.9 160.0 1.2 40.8 28.0 148 183 A I E +G 133 0B 0 -85,-2.3 2,-0.3 -2,-0.2 -15,-0.2 -0.938 28.4 173.3-115.1 133.7 3.0 41.9 24.8 149 184 A I + 0 0 38 -17,-2.3 -17,-0.0 -2,-0.4 -85,-0.0 -0.822 39.3 58.3-128.5 171.9 6.5 40.6 23.9 150 185 A D + 0 0 35 -2,-0.3 3,-0.4 1,-0.1 -1,-0.2 0.999 40.0 173.2 71.4 79.8 9.0 40.7 21.0 151 186 A F > + 0 0 0 1,-0.2 3,-1.6 2,-0.1 -1,-0.1 0.166 44.7 112.0-100.0 17.1 9.9 44.2 20.2 152 187 A A T 3 S+ 0 0 10 1,-0.3 -1,-0.2 -25,-0.1 -2,-0.0 0.761 81.9 45.3 -62.9 -27.4 12.7 43.4 17.7 153 188 A L T 3 S+ 0 0 39 -3,-0.4 -1,-0.3 -28,-0.2 -2,-0.1 0.352 88.7 120.6 -99.1 7.9 10.6 44.8 14.8 154 189 A A < - 0 0 7 -3,-1.6 2,-0.3 -27,-0.1 -29,-0.2 -0.111 42.6-161.9 -69.7 167.1 9.5 48.0 16.5 155 190 A K E -H 124 0C 56 -31,-2.1 -31,-2.8 -101,-0.0 2,-0.6 -0.993 25.7-115.8-151.6 144.3 10.2 51.5 15.2 156 191 A E E -H 123 0C 60 -2,-0.3 -33,-0.3 -33,-0.2 -34,-0.1 -0.698 28.1-174.9 -77.5 117.4 10.2 55.0 16.6 157 192 A Y S S+ 0 0 9 -35,-1.9 9,-2.6 -2,-0.6 2,-0.5 0.504 70.5 62.9 -97.8 -5.9 7.4 56.8 14.6 158 193 A I B S-I 165 0D 29 -36,-0.8 7,-0.2 7,-0.3 -1,-0.1 -0.990 91.6-127.2-113.7 117.5 8.1 60.2 16.2 159 194 A D > - 0 0 51 5,-3.0 4,-2.8 -2,-0.5 5,-0.4 -0.543 18.7-137.1 -68.6 124.4 11.6 61.4 15.2 160 195 A P T 4 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.745 94.7 40.6 -62.6 -30.5 13.2 62.3 18.6 161 196 A E T 4 S+ 0 0 147 1,-0.1 -2,-0.0 3,-0.1 -3,-0.0 0.934 126.5 30.9 -81.1 -48.1 14.9 65.6 17.6 162 197 A T T 4 S- 0 0 82 2,-0.1 3,-0.1 1,-0.0 -1,-0.1 0.740 90.6-140.3 -82.7 -24.7 12.2 67.1 15.4 163 198 A K < + 0 0 74 -4,-2.8 2,-0.4 1,-0.3 -1,-0.0 0.685 57.4 137.1 65.9 20.4 9.3 65.6 17.2 164 199 A K - 0 0 150 -5,-0.4 -5,-3.0 1,-0.1 -1,-0.3 -0.764 63.7-104.9 -96.7 143.5 7.7 65.1 13.8 165 200 A H B -I 158 0D 29 -2,-0.4 -7,-0.3 -7,-0.2 3,-0.1 -0.319 51.4 -92.0 -54.1 142.8 5.9 61.9 12.8 166 201 A I - 0 0 16 -9,-2.6 -1,-0.1 1,-0.1 -9,-0.1 -0.237 52.3 -99.5 -57.2 146.9 8.0 59.8 10.4 167 202 A P - 0 0 95 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.348 34.3-103.7 -71.6 157.1 7.4 60.7 6.7 168 203 A Y + 0 0 83 -3,-0.1 2,-0.3 -2,-0.0 23,-0.0 -0.543 53.6 151.0 -72.1 138.9 5.2 58.6 4.4 169 204 A R - 0 0 113 -2,-0.2 21,-2.8 21,-0.1 2,-0.2 -0.970 27.5-146.7-158.1 174.2 7.0 56.4 2.0 170 205 A E + 0 0 76 -2,-0.3 19,-0.2 19,-0.2 18,-0.1 -0.470 63.9 72.7-126.7-167.0 6.7 53.2 0.0 171 206 A H + 0 0 159 16,-0.4 2,-0.4 1,-0.2 18,-0.2 0.810 59.3 162.0 61.1 31.7 9.0 50.4 -1.2 172 207 A K - 0 0 64 16,-2.7 -1,-0.2 -3,-0.1 2,-0.1 -0.685 43.2-115.4 -82.5 131.0 9.4 49.0 2.3 173 208 A S - 0 0 105 -2,-0.4 2,-0.4 -3,-0.1 -1,-0.1 -0.444 27.6-124.7 -68.5 143.1 10.6 45.4 2.1 174 209 A L + 0 0 47 1,-0.2 -1,-0.1 -2,-0.1 52,-0.1 -0.773 53.2 135.0 -95.3 137.0 8.2 42.8 3.5 175 210 A T + 0 0 95 -2,-0.4 -1,-0.2 2,-0.1 3,-0.1 0.435 42.1 98.2-147.1 -27.7 9.4 40.5 6.2 176 211 A G S S- 0 0 26 1,-0.2 2,-0.5 2,-0.1 -49,-0.1 0.629 89.0 -60.8 -55.1-149.2 6.7 40.4 8.9 177 212 A T > - 0 0 39 -49,-0.1 4,-1.0 1,-0.1 3,-0.3 -0.939 42.5-156.1-101.3 127.3 3.9 37.8 9.4 178 213 A A T 4 S+ 0 0 6 -2,-0.5 -1,-0.1 1,-0.2 8,-0.1 0.841 81.6 68.0 -73.4 -34.9 1.7 37.7 6.4 179 214 A R T 4 S+ 0 0 67 1,-0.2 -1,-0.2 36,-0.1 35,-0.1 0.828 114.9 21.1 -59.3 -38.3 -1.4 36.3 8.1 180 215 A Y T 4 S+ 0 0 3 -3,-0.3 22,-0.3 -52,-0.2 -1,-0.2 0.586 90.3 122.2-107.4 -14.8 -2.2 39.4 10.2 181 216 A M < - 0 0 16 -4,-1.0 15,-0.1 1,-0.1 -3,-0.0 -0.065 66.2-102.0 -61.5 152.5 -0.5 42.2 8.5 182 217 A S > - 0 0 0 13,-0.2 4,-1.8 1,-0.1 5,-0.1 -0.253 26.3-113.8 -65.2 156.5 -2.5 45.2 7.3 183 218 A I H > S+ 0 0 24 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.932 118.7 53.7 -56.8 -43.6 -3.4 45.7 3.6 184 219 A N H 4>S+ 0 0 21 1,-0.2 5,-2.0 2,-0.2 -1,-0.2 0.860 103.0 56.6 -66.0 -29.6 -1.2 48.8 3.5 185 220 A T H >45S+ 0 0 9 1,-0.2 3,-2.2 2,-0.2 -1,-0.2 0.946 104.0 53.7 -60.8 -47.3 1.8 46.8 4.8 186 221 A H H 3<5S+ 0 0 22 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.814 102.4 58.7 -54.4 -34.3 1.3 44.4 1.8 187 222 A L T 3<5S- 0 0 86 -4,-1.3 -16,-0.4 -5,-0.1 -1,-0.3 0.386 120.2-109.3 -79.8 2.0 1.5 47.3 -0.5 188 223 A G T < 5 + 0 0 8 -3,-2.2 -16,-2.7 1,-0.3 -3,-0.2 0.652 66.6 151.5 81.6 14.7 5.0 48.2 0.8 189 224 A K < - 0 0 52 -5,-2.0 -1,-0.3 -19,-0.2 -19,-0.2 -0.514 57.4 -95.0 -77.4 148.1 3.9 51.3 2.6 190 225 A E - 0 0 8 -21,-2.8 2,-0.2 -2,-0.2 -1,-0.1 -0.392 48.6-121.2 -52.6 131.0 5.7 52.6 5.7 191 226 A Q + 0 0 40 -3,-0.1 2,-0.2 -2,-0.1 -1,-0.1 -0.521 38.3 170.3 -78.6 149.2 3.8 51.2 8.7 192 227 A S >> - 0 0 0 -2,-0.2 4,-1.0 70,-0.0 3,-1.0 -0.687 53.1 -65.0-141.5-166.6 2.2 53.5 11.3 193 228 A R H >> S+ 0 0 27 67,-0.4 4,-1.5 1,-0.3 3,-0.6 0.883 126.0 59.9 -57.0 -38.7 -0.1 53.4 14.2 194 229 A R H 3> S+ 0 0 19 66,-0.3 4,-2.4 65,-0.2 -1,-0.3 0.855 98.8 57.6 -55.8 -38.8 -3.1 52.3 12.1 195 230 A D H <> S+ 0 0 3 -3,-1.0 4,-2.4 1,-0.2 -1,-0.2 0.841 102.0 53.3 -68.3 -33.5 -1.3 49.2 10.9 196 231 A D H - 0 0 4 -2,-0.3 3,-1.9 -3,-0.1 4,-0.3 -0.903 30.4-119.6-117.1 149.1 -8.7 33.6 8.1 213 248 A P T 3 S+ 0 0 64 0, 0.0 3,-0.2 0, 0.0 -1,-0.0 0.611 111.4 48.8 -71.6 -7.0 -9.6 33.0 4.4 214 249 A W T > S+ 0 0 0 -35,-0.1 3,-1.0 1,-0.1 18,-0.1 0.266 81.9 101.5-105.7 8.1 -6.1 33.8 3.1 215 250 A Q T < S+ 0 0 49 -3,-1.9 -1,-0.1 1,-0.2 -36,-0.1 0.803 77.1 51.0 -69.7 -32.0 -4.3 31.6 5.5 216 251 A G T 3 S+ 0 0 71 -4,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.484 78.2 125.6 -85.8 -2.9 -3.7 28.6 3.2 217 252 A L < + 0 0 48 -3,-1.0 2,-0.3 8,-0.1 12,-0.1 -0.309 33.4 179.0 -68.1 136.1 -2.1 30.6 0.3 218 253 A K + 0 0 88 -2,-0.1 2,-0.3 10,-0.0 -2,-0.0 -0.881 5.3 179.1-128.0 160.2 1.3 29.5 -1.0 219 254 A A - 0 0 32 -2,-0.3 6,-0.1 1,-0.0 7,-0.0 -0.969 42.2-107.3-154.0 167.5 3.7 30.6 -3.8 220 255 A D S S+ 0 0 161 -2,-0.3 2,-0.3 1,-0.0 3,-0.1 0.720 106.2 34.3 -72.2 -21.6 7.1 29.8 -5.3 221 256 A T S > S- 0 0 68 1,-0.1 4,-2.1 -3,-0.0 5,-0.1 -0.958 81.5-122.8-130.3 152.4 8.6 33.0 -3.8 222 257 A L H > S+ 0 0 125 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.898 113.4 54.9 -55.9 -42.7 7.9 34.8 -0.6 223 258 A K H > S+ 0 0 144 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.917 108.4 47.4 -60.5 -43.9 7.1 38.0 -2.5 224 259 A E H > S+ 0 0 101 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.873 111.5 51.6 -65.7 -37.2 4.5 36.2 -4.6 225 260 A R H X S+ 0 0 75 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.936 109.6 48.0 -65.9 -47.3 3.0 34.7 -1.5 226 261 A Y H X S+ 0 0 24 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.914 112.2 52.5 -56.3 -41.7 2.7 38.1 0.3 227 262 A Q H X S+ 0 0 100 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.923 108.9 46.8 -62.7 -48.2 1.1 39.4 -2.9 228 263 A K H X S+ 0 0 93 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.901 113.0 50.4 -62.4 -41.6 -1.5 36.7 -3.2 229 264 A I H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.936 111.9 46.9 -62.6 -45.1 -2.4 37.1 0.5 230 265 A G H X S+ 0 0 4 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.903 110.4 53.4 -62.7 -39.6 -2.8 40.9 0.1 231 266 A D H X S+ 0 0 58 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.913 110.1 47.4 -60.9 -44.1 -4.9 40.3 -3.0 232 267 A T H X S+ 0 0 40 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.905 109.8 53.1 -65.1 -41.7 -7.2 38.0 -1.0 233 268 A K H >< S+ 0 0 0 -4,-2.6 3,-0.8 1,-0.2 -2,-0.2 0.940 112.3 45.1 -57.8 -45.2 -7.4 40.5 1.9 234 269 A R H 3< S+ 0 0 140 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.848 113.8 50.1 -66.8 -32.6 -8.4 43.3 -0.6 235 270 A A H 3< S+ 0 0 79 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.483 93.2 84.5 -86.0 -4.8 -10.9 40.9 -2.3 236 271 A T S << S- 0 0 22 -3,-0.8 -1,-0.1 -4,-0.8 5,-0.0 -0.867 80.4-133.0-103.1 107.8 -12.6 39.8 0.9 237 272 A P >> - 0 0 75 0, 0.0 4,-2.7 0, 0.0 3,-0.9 -0.314 11.4-128.5 -58.9 143.2 -15.3 42.3 1.9 238 273 A I H 3> S+ 0 0 22 1,-0.2 4,-2.9 2,-0.2 14,-0.1 0.887 110.5 58.5 -55.8 -39.5 -15.3 43.3 5.6 239 274 A E H 34 S+ 0 0 84 1,-0.2 -1,-0.2 2,-0.2 6,-0.1 0.773 111.4 42.3 -64.4 -26.3 -19.0 42.4 5.8 240 275 A V H X4 S+ 0 0 81 -3,-0.9 3,-1.6 2,-0.2 -2,-0.2 0.903 114.7 47.3 -83.1 -51.5 -18.1 38.9 4.7 241 276 A L H 3< S+ 0 0 2 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.898 121.6 39.1 -52.9 -43.1 -15.0 38.4 6.8 242 277 A C T >< S+ 0 0 3 -4,-2.9 3,-2.7 -5,-0.2 7,-0.3 -0.005 80.1 156.5-103.7 24.8 -16.8 39.8 9.9 243 278 A E T < S+ 0 0 128 -3,-1.6 -3,-0.1 1,-0.3 -4,-0.0 -0.316 75.1 13.9 -52.1 129.9 -20.2 38.1 9.2 244 279 A N T 3 S+ 0 0 133 -5,-0.1 -1,-0.3 1,-0.0 -4,-0.1 0.411 113.4 83.3 79.3 2.7 -22.0 37.9 12.6 245 280 A F X> + 0 0 47 -3,-2.7 4,-1.9 -6,-0.1 3,-0.6 -0.629 49.3 168.7-132.2 71.6 -19.6 40.3 14.2 246 281 A P H 3> S+ 0 0 83 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.841 77.7 52.9 -54.6 -39.0 -20.9 43.8 13.4 247 282 A E H 3> S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.833 107.0 52.6 -70.1 -32.7 -18.6 45.6 15.9 248 283 A M H <> S+ 0 0 3 -3,-0.6 4,-2.8 2,-0.2 -1,-0.2 0.883 108.5 51.1 -66.2 -39.3 -15.6 43.8 14.4 249 284 A A H X S+ 0 0 8 -4,-1.9 4,-2.8 -7,-0.3 5,-0.2 0.932 111.6 47.3 -59.8 -45.9 -16.6 45.1 11.0 250 285 A T H X S+ 0 0 48 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.940 113.1 49.2 -62.6 -44.3 -16.9 48.6 12.4 251 286 A Y H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.939 114.1 44.8 -56.6 -51.5 -13.5 48.3 14.1 252 287 A L H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.900 112.2 50.5 -68.0 -40.9 -11.8 47.0 10.9 253 288 A R H X S+ 0 0 93 -4,-2.8 4,-1.4 -5,-0.2 -1,-0.2 0.936 111.7 50.1 -60.5 -44.6 -13.4 49.6 8.6 254 289 A Y H X S+ 0 0 57 -4,-2.4 4,-0.6 -5,-0.2 3,-0.5 0.941 113.9 42.2 -58.1 -51.2 -12.4 52.3 10.9 255 290 A V H >< S+ 0 0 1 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.885 111.4 55.7 -70.5 -33.2 -8.7 51.2 11.2 256 291 A R H 3< S+ 0 0 49 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.772 109.5 48.7 -63.6 -28.3 -8.5 50.5 7.5 257 292 A R H 3< S+ 0 0 131 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.454 83.0 117.4 -95.5 -2.9 -9.6 54.1 6.8 258 293 A L << - 0 0 4 -3,-0.9 2,-0.1 -4,-0.6 -3,-0.0 -0.356 67.6-117.9 -62.2 143.7 -7.2 55.8 9.1 259 294 A D > - 0 0 86 1,-0.1 3,-0.8 4,-0.1 -65,-0.2 -0.431 27.1-106.6 -77.7 157.5 -4.7 58.1 7.5 260 295 A F T 3 S+ 0 0 5 1,-0.2 -67,-0.4 -2,-0.1 -66,-0.3 0.853 118.5 35.5 -53.9 -40.2 -1.0 57.4 7.8 261 296 A F T 3 S+ 0 0 93 -69,-0.1 -1,-0.2 -68,-0.1 -96,-0.1 0.575 92.7 120.8 -90.3 -10.9 -0.3 60.2 10.2 262 297 A E < - 0 0 82 -3,-0.8 -68,-0.2 1,-0.1 -69,-0.1 -0.256 62.3-128.7 -71.7 137.4 -3.6 60.0 12.2 263 298 A K - 0 0 137 -70,-0.1 -1,-0.1 1,-0.0 -4,-0.1 -0.709 33.2-124.3 -75.5 119.4 -3.9 59.4 15.9 264 299 A P - 0 0 3 0, 0.0 2,-1.5 0, 0.0 3,-0.2 -0.334 14.6-119.4 -60.3 150.0 -6.4 56.5 16.4 265 300 A D > + 0 0 78 1,-0.2 4,-2.0 2,-0.1 5,-0.2 -0.685 38.6 174.4 -87.6 84.2 -9.3 57.1 18.6 266 301 A Y H > S+ 0 0 7 -2,-1.5 4,-2.7 1,-0.2 5,-0.2 0.850 75.5 58.0 -60.9 -35.9 -8.5 54.4 21.1 267 302 A D H > S+ 0 0 110 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.916 106.7 48.4 -59.4 -47.2 -11.3 55.4 23.3 268 303 A Y H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.910 111.6 48.7 -59.6 -45.7 -13.8 54.9 20.5 269 304 A L H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.922 112.2 48.4 -66.1 -43.0 -12.4 51.5 19.6 270 305 A R H X S+ 0 0 41 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.920 110.2 52.7 -59.6 -42.9 -12.5 50.3 23.3 271 306 A K H X S+ 0 0 116 -4,-2.3 4,-2.7 1,-0.2 5,-0.4 0.871 101.2 59.5 -65.8 -36.0 -16.1 51.6 23.6 272 307 A L H X S+ 0 0 26 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.939 115.3 36.7 -49.7 -47.7 -17.3 49.6 20.5 273 308 A F H X S+ 0 0 0 -4,-1.4 4,-2.6 -3,-0.2 -2,-0.2 0.857 116.3 49.5 -81.5 -34.9 -16.2 46.5 22.4 274 309 A T H X S+ 0 0 48 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.880 111.2 50.7 -72.6 -34.8 -17.1 47.4 25.9 275 310 A D H X S+ 0 0 56 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.929 113.7 45.7 -63.9 -44.9 -20.6 48.4 24.8 276 311 A L H X S+ 0 0 7 -4,-1.4 4,-2.3 -5,-0.4 -2,-0.2 0.930 110.7 53.3 -58.8 -49.3 -20.9 45.1 23.0 277 312 A F H <>S+ 0 0 5 -4,-2.6 5,-2.0 1,-0.2 4,-0.3 0.917 112.7 43.7 -52.2 -50.3 -19.6 43.2 26.0 278 313 A D H ><5S+ 0 0 111 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.892 110.5 55.2 -64.8 -41.1 -22.2 44.8 28.3 279 314 A R H 3<5S+ 0 0 152 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.864 106.4 51.8 -62.9 -35.0 -25.0 44.3 25.7 280 315 A K T 3<5S- 0 0 120 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.538 115.7-118.0 -76.6 -9.0 -24.2 40.5 25.6 281 316 A G T < 5 + 0 0 57 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.650 58.7 157.1 79.9 16.9 -24.4 40.4 29.4 282 317 A Y < - 0 0 69 -5,-2.0 2,-0.5 -6,-0.2 -1,-0.2 -0.428 35.7-140.1 -74.2 150.1 -20.8 39.3 29.8 283 318 A M - 0 0 127 -2,-0.1 2,-1.8 4,-0.1 4,-0.3 -0.946 15.1-129.5-109.9 131.6 -19.0 39.9 33.0 284 319 A F + 0 0 81 -2,-0.5 -2,-0.0 1,-0.2 -182,-0.0 -0.613 61.9 133.5 -82.4 84.2 -15.3 41.1 32.8 285 320 A D S S- 0 0 60 -2,-1.8 -1,-0.2 2,-0.0 3,-0.1 0.214 73.2-114.3-122.0 7.7 -14.2 38.4 35.2 286 321 A Y + 0 0 84 1,-0.2 2,-1.9 -3,-0.1 -2,-0.1 0.653 66.0 145.6 59.3 22.0 -11.1 37.0 33.4 287 322 A E - 0 0 110 -4,-0.3 -1,-0.2 3,-0.0 -184,-0.1 -0.530 29.2-179.2 -87.8 74.0 -12.8 33.7 32.9 288 323 A Y > - 0 0 7 -2,-1.9 3,-2.0 1,-0.1 -189,-0.0 -0.263 43.6 -99.6 -66.8 164.2 -11.2 33.1 29.6 289 324 A D T 3 S+ 0 0 44 1,-0.3 -1,-0.1 -189,-0.1 -2,-0.0 0.770 120.7 58.8 -56.3 -30.5 -12.0 29.9 27.6 290 325 A W T > S+ 0 0 5 2,-0.1 3,-1.9 3,-0.0 -1,-0.3 0.525 74.2 117.5 -81.4 -7.0 -8.7 28.3 28.7 291 326 A I T < S+ 0 0 89 -3,-2.0 3,-0.1 1,-0.3 -4,-0.0 -0.442 78.7 25.5 -64.9 132.0 -9.5 28.5 32.5 292 327 A G T 3 S+ 0 0 84 1,-0.4 -1,-0.3 -2,-0.1 2,-0.2 0.382 99.3 112.2 95.0 -1.4 -9.6 25.0 33.9 293 328 A K S < S- 0 0 87 -3,-1.9 2,-0.8 1,-0.0 -1,-0.4 -0.675 78.9 -99.4-102.0 157.8 -7.3 23.5 31.2 294 329 A Q - 0 0 92 -2,-0.2 -3,-0.0 -3,-0.1 -1,-0.0 -0.666 42.7-153.3 -79.5 109.2 -3.8 22.1 31.7 295 330 A L - 0 0 71 -2,-0.8 2,-0.2 1,-0.1 -204,-0.0 -0.592 19.3-108.7 -87.1 142.9 -1.4 24.9 30.6 296 331 A P - 0 0 77 0, 0.0 -1,-0.1 0, 0.0 -206,-0.0 -0.492 43.6-178.8 -69.7 135.9 2.1 24.2 29.3 297 332 A T - 0 0 85 -2,-0.2 -212,-0.1 1,-0.1 0, 0.0 -0.998 36.3-154.6-142.5 132.7 4.8 25.2 31.7 298 333 A P 0 0 52 0, 0.0 -1,-0.1 0, 0.0 -286,-0.1 0.752 360.0 360.0 -70.9 -24.2 8.6 25.2 31.8 299 334 A V 0 0 78 -266,-0.0 -266,-0.1 0, 0.0 0, 0.0 -0.716 360.0 360.0 82.7 360.0 8.5 25.1 35.6