==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-AUG-07 2R3J . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.O.FISCHMANN,A.W.HRUZA,V.M.MADISON,J.S.DUCA . 279 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14316.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 12.9 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 20 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 1 0 1 0 0 2 0 1 0 0 0 1 0 0 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 . 0 1 1 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 1 A M > 0 0 46 0, 0.0 3,-1.7 0, 0.0 62,-0.0 0.000 360.0 360.0 360.0 -28.2 -13.3 31.6 -2.6 2 2 A E T 3 + 0 0 146 1,-0.3 22,-0.0 3,-0.0 0, 0.0 0.556 360.0 75.4 -66.7 -4.5 -13.1 31.4 -6.4 3 3 A N T 3 S+ 0 0 74 21,-0.1 21,-1.4 20,-0.1 22,-0.6 0.279 91.9 64.9 -88.2 7.6 -10.8 34.4 -6.0 4 4 A F E < -A 23 0A 25 -3,-1.7 2,-0.6 19,-0.3 19,-0.2 -0.993 63.5-150.3-137.4 145.2 -8.0 32.2 -4.7 5 5 A Q E -A 22 0A 100 17,-2.8 17,-2.5 -2,-0.4 2,-0.2 -0.948 25.6-132.6-112.6 117.4 -5.8 29.4 -6.1 6 6 A K E +A 21 0A 102 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.510 24.3 179.2 -68.9 129.6 -4.6 27.0 -3.4 7 7 A V E - 0 0 56 13,-3.1 2,-0.3 1,-0.4 14,-0.2 0.839 60.4 -34.5 -97.5 -45.9 -0.9 26.3 -3.7 8 8 A E E -A 20 0A 101 12,-1.5 12,-3.1 0, 0.0 -1,-0.4 -0.968 57.1 -96.9-172.2 154.8 -0.4 23.9 -0.9 9 9 A K E -A 19 0A 87 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.630 30.9-173.1 -76.5 135.2 -1.6 22.9 2.6 10 10 A I E - 0 0 66 8,-2.7 2,-0.3 1,-0.4 9,-0.1 0.070 60.7 -42.5-119.0 22.8 0.9 24.4 5.1 11 11 A G E - 0 0 33 7,-0.5 7,-1.7 2,-0.0 2,-0.4 -0.821 58.9 -91.2 142.5 179.8 -0.5 22.7 8.1 12 12 A E E -A 17 0A 110 -2,-0.3 5,-0.2 5,-0.2 7,-0.0 -0.869 41.3-157.6-131.7 93.4 -3.7 21.8 9.9 13 13 A G - 0 0 28 3,-1.4 3,-0.2 -2,-0.4 -2,-0.0 0.015 35.3 -98.0 -61.7 177.4 -4.7 24.5 12.3 14 14 A T S S+ 0 0 65 1,-0.2 -1,-0.1 3,-0.0 3,-0.1 0.395 124.5 40.0 -79.0 1.6 -7.0 23.9 15.3 15 15 A Y S S- 0 0 89 1,-0.5 2,-0.3 20,-0.0 -1,-0.2 0.456 127.0 -56.4-126.0 -10.5 -10.0 25.1 13.2 16 16 A G S S- 0 0 25 -3,-0.2 -3,-1.4 19,-0.2 -1,-0.5 -0.925 78.0 -30.3 154.6-179.2 -9.3 23.6 9.8 17 17 A V E -A 12 0A 21 -2,-0.3 17,-2.0 -5,-0.2 2,-0.5 -0.305 48.9-148.0 -65.7 145.5 -6.8 23.3 7.0 18 18 A V E - B 0 33A 28 -7,-1.7 -8,-2.7 15,-0.2 -7,-0.5 -0.983 17.0-166.4-118.3 126.3 -4.5 26.2 6.3 19 19 A Y E -AB 9 32A 60 13,-3.1 13,-3.3 -2,-0.5 2,-0.3 -0.946 25.3-134.1-119.4 137.3 -3.4 26.8 2.7 20 20 A K E +AB 8 31A 44 -12,-3.1 -13,-3.1 -2,-0.4 -12,-1.5 -0.665 48.2 172.7 -75.1 134.7 -0.8 28.9 1.1 21 21 A A E -AB 6 30A 0 9,-2.8 9,-2.7 -2,-0.3 2,-0.4 -0.966 32.4-130.2-146.0 162.9 -2.8 30.5 -1.7 22 22 A R E -AB 5 29A 96 -17,-2.5 -17,-2.8 -2,-0.3 2,-0.8 -0.958 25.8-121.3-119.9 132.7 -2.6 33.1 -4.5 23 23 A N E > -A 4 0A 26 5,-2.9 4,-2.3 -2,-0.4 -19,-0.3 -0.627 19.7-148.4 -68.7 108.1 -5.2 35.8 -5.1 24 24 A K T 4 S+ 0 0 130 -21,-1.4 -1,-0.2 -2,-0.8 -20,-0.2 0.720 93.9 44.6 -52.5 -17.7 -6.3 35.0 -8.6 25 25 A L T 4 S+ 0 0 134 -22,-0.6 -1,-0.1 3,-0.1 -21,-0.1 0.921 125.2 18.7 -88.8 -82.2 -6.7 38.7 -8.9 26 26 A T T 4 S- 0 0 104 1,-0.1 -2,-0.2 2,-0.0 3,-0.1 0.590 94.1-124.8 -69.6 -14.2 -3.9 40.8 -7.4 27 27 A G < + 0 0 38 -4,-2.3 -3,-0.1 1,-0.3 -1,-0.1 0.432 56.3 156.9 82.2 -1.9 -1.4 37.8 -7.5 28 28 A E - 0 0 101 -5,-0.1 -5,-2.9 -6,-0.1 2,-0.5 -0.229 40.4-132.9 -56.7 143.3 -0.9 38.4 -3.8 29 29 A V E +B 22 0A 58 -7,-0.2 46,-0.6 -3,-0.1 2,-0.3 -0.894 39.0 160.9-104.9 125.2 0.4 35.3 -1.9 30 30 A V E -BC 21 74A 0 -9,-2.7 -9,-2.8 -2,-0.5 2,-0.5 -0.861 43.8-108.2-136.8 173.1 -1.5 34.7 1.4 31 31 A A E -BC 20 73A 12 42,-2.6 42,-3.3 -2,-0.3 2,-0.6 -0.916 34.2-158.9-106.5 126.8 -2.3 32.2 4.0 32 32 A L E -BC 19 72A 7 -13,-3.3 -13,-3.1 -2,-0.5 2,-0.5 -0.941 4.8-165.8-115.9 120.1 -5.9 31.0 3.8 33 33 A K E -BC 18 71A 2 38,-2.9 38,-2.6 -2,-0.6 2,-0.7 -0.893 8.3-153.4-107.0 128.2 -7.6 29.4 6.7 34 34 A K E C 0 70A 76 -17,-2.0 36,-0.2 -2,-0.5 -17,-0.1 -0.883 360.0 360.0-100.9 114.3 -10.9 27.5 6.4 35 35 A I 0 0 64 34,-2.8 34,-0.6 -2,-0.7 -19,-0.2 -0.615 360.0 360.0 -85.3 360.0 -12.9 27.7 9.7 36 ! 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 37 44 A V 0 0 63 0, 0.0 2,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 143.7 -21.8 30.9 11.2 38 45 A P >> - 0 0 87 0, 0.0 4,-2.0 0, 0.0 3,-0.6 -0.416 360.0-130.2 -67.8 136.2 -22.7 32.3 14.6 39 46 A S H 3> S+ 0 0 68 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.880 108.6 59.1 -51.2 -44.0 -23.1 36.1 14.7 40 47 A T H 3> S+ 0 0 104 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.909 105.5 49.5 -52.7 -45.9 -20.9 36.2 17.8 41 48 A A H <> S+ 0 0 36 -3,-0.6 4,-2.9 1,-0.2 5,-0.3 0.961 111.2 48.3 -59.1 -53.4 -18.1 34.6 15.8 42 49 A I H X S+ 0 0 41 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.885 114.1 45.6 -55.4 -44.6 -18.4 37.0 12.9 43 50 A R H X S+ 0 0 158 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.941 114.9 46.9 -66.5 -47.8 -18.4 40.1 15.2 44 51 A E H X S+ 0 0 54 -4,-2.5 4,-1.2 -5,-0.3 3,-0.2 0.911 114.1 46.8 -60.1 -46.8 -15.5 38.9 17.3 45 52 A I H X S+ 0 0 17 -4,-2.9 4,-0.9 -5,-0.2 3,-0.5 0.905 106.9 59.5 -63.7 -38.0 -13.4 38.0 14.2 46 53 A S H >< S+ 0 0 57 -4,-2.1 3,-0.6 -5,-0.3 4,-0.3 0.861 101.0 54.5 -59.5 -33.4 -14.3 41.3 12.7 47 54 A L H >X S+ 0 0 102 -4,-1.5 3,-1.7 -3,-0.2 4,-0.5 0.858 99.3 63.4 -66.7 -35.0 -12.6 43.0 15.7 48 55 A L H >< S+ 0 0 15 -4,-1.2 3,-0.9 -3,-0.5 11,-0.3 0.787 87.9 68.6 -61.2 -29.3 -9.5 41.1 15.0 49 56 A K T << S+ 0 0 90 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.680 101.4 48.9 -64.3 -17.6 -9.1 42.7 11.6 50 57 A E T <4 S+ 0 0 154 -3,-1.7 2,-2.0 -4,-0.3 -1,-0.2 0.601 83.9 93.9 -95.5 -16.9 -8.3 46.0 13.5 51 58 A L << + 0 0 19 -3,-0.9 2,-0.4 -4,-0.5 8,-0.2 -0.546 59.1 165.7 -79.3 76.7 -5.7 44.5 15.9 52 59 A N + 0 0 69 -2,-2.0 5,-0.1 6,-0.1 6,-0.0 -0.826 6.0 143.0-104.3 132.7 -2.7 45.4 13.8 53 60 A H > - 0 0 45 3,-0.5 3,-1.9 -2,-0.4 54,-0.0 -0.958 57.2-110.5-162.1 148.9 0.9 45.3 15.0 54 61 A P T 3 S+ 0 0 92 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.692 117.5 50.2 -64.2 -16.3 4.3 44.3 13.4 55 62 A N T 3 S+ 0 0 10 80,-0.1 81,-2.7 48,-0.1 2,-0.4 0.179 97.4 78.2-107.7 21.4 4.5 41.2 15.6 56 63 A I B < S-e 136 0B 11 -3,-1.9 -3,-0.5 79,-0.3 81,-0.2 -0.995 91.3-111.7-125.9 125.8 1.0 39.9 14.9 57 64 A V - 0 0 9 79,-2.9 2,-0.2 -2,-0.4 82,-0.1 -0.351 44.9-111.9 -57.4 125.6 0.3 38.1 11.6 58 65 A K - 0 0 91 -4,-0.1 16,-2.5 1,-0.1 2,-0.9 -0.454 16.8-141.3 -69.4 130.9 -1.9 40.5 9.7 59 66 A L E -D 73 0A 10 -11,-0.3 14,-0.3 -2,-0.2 3,-0.1 -0.797 22.5-177.9 -91.0 104.2 -5.5 39.4 9.1 60 67 A L E - 0 0 34 12,-2.2 2,-0.3 -2,-0.9 13,-0.2 0.944 56.8 -8.7 -69.3 -55.4 -6.2 40.7 5.5 61 68 A D E -D 72 0A 89 11,-1.6 11,-3.2 2,-0.0 2,-0.5 -0.996 49.6-140.2-149.7 154.1 -9.7 39.8 5.0 62 69 A V E -D 71 0A 35 -2,-0.3 2,-0.6 9,-0.2 9,-0.2 -0.967 22.2-165.1-116.7 113.9 -12.6 37.9 6.4 63 70 A I E -D 70 0A 36 7,-3.4 7,-3.2 -2,-0.5 2,-0.6 -0.900 7.5-177.1-107.9 116.1 -14.7 36.0 3.9 64 71 A H E +D 69 0A 80 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.934 22.2 144.1-111.3 112.0 -18.1 34.7 4.8 65 72 A T E > +D 68 0A 75 3,-2.4 3,-1.5 -2,-0.6 -2,-0.0 -0.979 61.9 5.9-152.3 137.6 -19.9 32.7 2.1 66 73 A E T 3 S- 0 0 175 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.823 128.5 -61.3 63.1 31.4 -22.2 29.7 1.9 67 74 A N T 3 S+ 0 0 136 1,-0.3 2,-0.3 -30,-0.1 -1,-0.3 0.665 115.2 129.1 67.5 14.0 -22.3 29.7 5.7 68 75 A K E < - D 0 65A 48 -3,-1.5 -3,-2.4 -31,-0.1 2,-0.5 -0.781 50.8-148.0-102.8 145.4 -18.5 29.1 5.3 69 76 A L E + D 0 64A 9 -34,-0.6 -34,-2.8 -2,-0.3 2,-0.4 -0.958 16.0 178.8-119.2 120.3 -15.9 31.2 7.0 70 77 A Y E -CD 34 63A 32 -7,-3.2 -7,-3.4 -2,-0.5 2,-0.5 -0.976 11.6-158.5-120.4 132.6 -12.5 31.9 5.4 71 78 A L E -CD 33 62A 1 -38,-2.6 -38,-2.9 -2,-0.4 2,-0.6 -0.940 6.3-154.7-111.1 127.2 -9.7 34.0 7.0 72 79 A V E +CD 32 61A 4 -11,-3.2 -12,-2.2 -2,-0.5 -11,-1.6 -0.906 20.8 178.7-107.0 117.6 -7.1 35.5 4.7 73 80 A F E -CD 31 59A 20 -42,-3.3 -42,-2.6 -2,-0.6 -14,-0.2 -0.768 37.3 -92.5-113.6 162.5 -3.8 36.2 6.4 74 81 A E E -C 30 0A 51 -16,-2.5 2,-0.4 -2,-0.3 -44,-0.2 -0.383 50.6-120.9 -64.7 147.8 -0.4 37.6 5.5 75 82 A F - 0 0 36 -46,-0.6 2,-0.4 -45,-0.1 -1,-0.1 -0.826 26.0-170.8-100.1 135.7 1.9 34.7 4.5 76 83 A L - 0 0 14 -2,-0.4 53,-0.1 1,-0.1 52,-0.1 -0.978 21.5-136.8-124.7 139.7 5.2 33.9 6.3 77 84 A H S S+ 0 0 107 -2,-0.4 2,-0.3 51,-0.1 52,-0.1 0.707 77.4 23.4 -69.7 -27.5 7.6 31.3 5.0 78 85 A Q E -F 128 0B 15 50,-1.3 50,-2.8 203,-0.1 2,-0.3 -0.978 60.8-142.4-142.1 157.2 8.5 29.4 8.2 79 86 A D E > -F 127 0B 41 -2,-0.3 4,-1.8 48,-0.3 48,-0.3 -0.774 32.5-110.5-114.2 161.6 7.3 28.7 11.7 80 87 A L H > S+ 0 0 0 46,-3.0 4,-2.8 43,-1.0 5,-0.2 0.815 113.2 57.9 -64.3 -30.0 9.4 28.4 14.9 81 88 A K H > S+ 0 0 93 42,-0.8 4,-2.5 45,-0.2 -1,-0.2 0.963 109.5 44.6 -63.7 -49.2 9.0 24.6 15.3 82 89 A K H > S+ 0 0 115 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.882 114.8 49.6 -61.7 -38.6 10.5 24.0 11.9 83 90 A F H X S+ 0 0 6 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.893 109.4 50.1 -69.1 -42.3 13.3 26.5 12.6 84 91 A M H < S+ 0 0 21 -4,-2.8 3,-0.3 1,-0.2 -2,-0.2 0.918 110.6 50.8 -62.4 -39.8 14.1 25.0 16.0 85 92 A D H >< S+ 0 0 109 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.871 111.7 48.7 -64.3 -34.6 14.2 21.6 14.3 86 93 A A H 3< S+ 0 0 78 -4,-1.7 3,-0.3 1,-0.2 -1,-0.2 0.706 113.7 44.6 -77.7 -23.6 16.6 23.1 11.7 87 94 A S T 3X S+ 0 0 23 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.050 80.6 114.3-106.9 21.8 18.9 24.7 14.3 88 95 A A T <4 + 0 0 44 -3,-0.8 -1,-0.2 1,-0.2 -2,-0.1 0.772 66.2 60.1 -63.3 -32.9 18.9 21.6 16.4 89 96 A L T 4 S+ 0 0 167 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.898 127.3 8.3 -66.9 -46.3 22.6 20.8 16.0 90 97 A T T 4 S- 0 0 118 -3,-0.2 -2,-0.2 1,-0.1 -1,-0.2 0.491 107.1-125.4-112.1 -10.4 24.1 24.0 17.4 91 98 A G < - 0 0 7 -4,-1.9 -3,-0.1 -7,-0.1 89,-0.1 0.113 41.1 -54.7 81.3 161.2 20.9 25.5 18.8 92 99 A I - 0 0 14 87,-0.6 5,-0.1 1,-0.1 -8,-0.0 -0.579 67.2-105.1 -73.9 126.6 19.5 28.9 18.1 93 100 A P >> - 0 0 77 0, 0.0 4,-2.2 0, 0.0 3,-0.9 -0.255 27.6-121.4 -52.8 137.8 22.1 31.6 18.9 94 101 A L H 3> S+ 0 0 63 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.840 111.1 56.3 -52.3 -40.0 21.2 33.4 22.2 95 102 A P H 3> S+ 0 0 67 0, 0.0 4,-2.1 0, 0.0 178,-0.4 0.881 110.1 46.5 -62.9 -33.1 21.0 36.8 20.6 96 103 A L H <> S+ 0 0 6 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.875 111.6 50.5 -75.7 -38.1 18.4 35.5 18.2 97 104 A I H X S+ 0 0 5 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.963 112.4 47.6 -59.9 -50.1 16.5 33.7 21.0 98 105 A K H X S+ 0 0 13 -4,-3.0 4,-2.9 1,-0.2 -2,-0.2 0.908 111.8 50.3 -57.2 -45.5 16.5 37.0 22.9 99 106 A S H X S+ 0 0 3 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.889 112.9 46.0 -58.3 -48.4 15.4 39.0 19.8 100 107 A Y H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.938 113.1 48.5 -63.6 -47.4 12.5 36.6 19.2 101 108 A L H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.939 112.5 50.5 -58.4 -43.9 11.4 36.6 22.9 102 109 A F H X S+ 0 0 55 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.918 111.9 46.2 -59.2 -49.4 11.6 40.4 22.9 103 110 A Q H X S+ 0 0 9 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.890 112.2 50.4 -62.9 -43.0 9.5 40.7 19.8 104 111 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.891 108.3 52.7 -65.0 -35.2 6.9 38.2 21.0 105 112 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.919 107.9 52.3 -66.8 -38.9 6.6 40.1 24.3 106 113 A Q H X S+ 0 0 63 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.942 110.5 46.7 -60.1 -49.1 6.0 43.2 22.3 107 114 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.923 114.6 48.5 -56.7 -44.7 3.1 41.5 20.3 108 115 A L H X S+ 0 0 0 -4,-2.8 4,-3.4 1,-0.2 5,-0.3 0.941 107.9 52.7 -62.3 -50.1 1.7 40.1 23.6 109 116 A A H X S+ 0 0 20 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.903 111.0 50.3 -52.8 -42.6 1.8 43.5 25.3 110 117 A F H X S+ 0 0 49 -4,-2.1 4,-1.0 -5,-0.2 -2,-0.2 0.965 114.1 41.1 -60.4 -57.5 -0.1 44.9 22.3 111 118 A C H ><>S+ 0 0 0 -4,-2.5 5,-2.4 1,-0.2 3,-1.1 0.939 114.7 52.3 -59.1 -46.0 -2.9 42.3 22.4 112 119 A H H ><5S+ 0 0 16 -4,-3.4 3,-1.9 1,-0.3 -1,-0.2 0.827 101.9 58.5 -60.6 -37.2 -3.1 42.3 26.1 113 120 A S H 3<5S+ 0 0 87 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.767 108.9 48.2 -63.4 -23.9 -3.5 46.1 26.3 114 121 A H T <<5S- 0 0 102 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.119 120.5-112.3 -99.5 18.5 -6.6 45.5 24.0 115 122 A R T < 5S+ 0 0 165 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.807 73.0 138.6 54.9 32.1 -7.9 42.7 26.3 116 123 A V < - 0 0 23 -5,-2.4 2,-0.3 -8,-0.1 -1,-0.2 -0.942 34.3-164.9-109.3 128.7 -7.2 40.1 23.6 117 124 A L - 0 0 37 -2,-0.5 23,-1.1 1,-0.2 26,-0.3 -0.782 18.1-155.2-107.4 155.1 -5.7 36.8 24.6 118 125 A H - 0 0 4 -2,-0.3 24,-0.6 21,-0.2 25,-0.2 0.920 19.3-176.9 -88.6 -56.3 -4.1 34.2 22.4 119 126 A R + 0 0 60 46,-0.1 -1,-0.1 45,-0.1 20,-0.1 0.128 69.1 55.7 83.6 -20.3 -4.7 31.2 24.7 120 127 A D + 0 0 27 18,-0.1 2,-0.1 32,-0.1 5,-0.1 -0.143 65.3 164.6-138.0 45.3 -2.9 28.6 22.5 121 128 A L + 0 0 0 30,-0.2 30,-0.1 3,-0.1 17,-0.0 -0.400 13.2 151.9 -62.9 134.6 0.7 29.9 21.8 122 129 A K > - 0 0 26 -2,-0.1 3,-2.2 1,-0.1 4,-0.3 -0.971 60.1 -99.8-162.0 153.0 2.9 27.1 20.5 123 130 A P G > S+ 0 0 0 0, 0.0 3,-1.6 0, 0.0 -43,-1.0 0.854 117.8 64.1 -48.9 -32.7 6.0 27.0 18.3 124 131 A Q G 3 S+ 0 0 73 1,-0.3 -3,-0.1 -44,-0.2 -42,-0.0 0.733 104.5 45.1 -65.7 -23.2 3.8 26.0 15.3 125 132 A N G < S+ 0 0 13 -3,-2.2 12,-2.2 -5,-0.1 2,-0.6 0.257 89.4 92.9-109.1 17.8 2.0 29.3 15.4 126 133 A L E < - G 0 136B 0 -3,-1.6 -46,-3.0 -4,-0.3 2,-0.4 -0.947 65.9-159.8-108.3 113.6 5.0 31.6 15.8 127 134 A L E -FG 79 135B 29 8,-3.0 8,-2.7 -2,-0.6 2,-0.3 -0.813 8.0-163.9-106.7 138.8 6.0 32.6 12.3 128 135 A I E -FG 78 134B 0 -50,-2.8 -50,-1.3 -2,-0.4 2,-0.2 -0.873 2.5-163.2-121.3 156.0 9.3 34.0 11.1 129 136 A N > - 0 0 38 4,-1.8 3,-1.2 -2,-0.3 -53,-0.1 -0.711 40.1 -95.2-125.5 179.4 10.7 35.8 8.1 130 137 A T T 3 S+ 0 0 64 1,-0.2 149,-0.1 -2,-0.2 -2,-0.0 0.615 114.6 64.8 -70.8 -15.4 14.0 36.5 6.4 131 138 A E T 3 S- 0 0 130 145,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.370 119.5 -99.4 -91.5 3.2 14.4 39.9 8.1 132 139 A G S < S+ 0 0 0 -3,-1.2 2,-0.2 1,-0.3 -2,-0.1 0.519 78.2 140.3 91.3 7.6 14.6 38.5 11.7 133 140 A A - 0 0 12 141,-0.1 -4,-1.8 -30,-0.0 2,-0.4 -0.558 32.4-167.1 -81.1 149.6 10.9 39.3 12.4 134 141 A I E - G 0 128B 0 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.992 9.3-170.1-133.9 140.8 8.8 36.8 14.4 135 142 A K E - G 0 127B 25 -8,-2.7 -8,-3.0 -2,-0.4 2,-0.4 -0.987 23.7-119.0-138.8 146.4 5.0 37.1 14.6 136 143 A L E -eG 56 126B 1 -81,-2.7 -79,-2.9 -2,-0.3 2,-0.3 -0.640 29.8-160.6 -81.2 130.2 2.1 35.6 16.5 137 144 A A + 0 0 11 -12,-2.2 -12,-0.1 -2,-0.4 -79,-0.0 -0.848 66.5 20.6-114.1 146.3 -0.5 33.7 14.4 138 145 A D S > S+ 0 0 33 -2,-0.3 3,-1.4 1,-0.2 4,-0.5 0.651 75.6 171.0 72.9 23.2 -4.1 32.9 15.4 139 146 A F T 3 + 0 0 12 -3,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.392 68.1 8.5 -65.2 137.0 -4.4 35.6 18.1 140 147 A G T 3 S+ 0 0 2 -23,-1.1 -1,-0.2 -2,-0.1 3,-0.1 0.311 96.8 111.5 77.7 -8.7 -8.0 36.0 19.5 141 148 A L < + 0 0 24 -3,-1.4 -2,-0.1 1,-0.2 -23,-0.1 0.901 68.3 58.8 -64.2 -43.5 -9.2 32.9 17.5 142 149 A A 0 0 49 -24,-0.6 -1,-0.2 -4,-0.5 -23,-0.1 0.891 360.0 360.0 -53.9 -42.5 -9.9 30.7 20.6 143 150 A R 0 0 227 -26,-0.3 -1,-0.3 -25,-0.2 -2,-0.2 0.648 360.0 360.0 -72.2 360.0 -12.3 33.3 22.0 144 ! 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 0.0 145 162 A E 0 0 183 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.1 -4.9 15.5 15.5 146 163 A V - 0 0 130 1,-0.1 2,-0.3 3,-0.0 3,-0.0 -0.466 360.0-123.2 -67.2 131.7 -4.3 15.7 19.2 147 164 A V - 0 0 61 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 -0.611 31.9-114.5 -77.5 130.7 -4.2 19.3 20.5 148 165 A T - 0 0 35 -2,-0.3 3,-0.2 1,-0.1 41,-0.1 -0.470 28.1-174.3 -68.8 135.1 -0.8 19.9 22.3 149 166 A L > + 0 0 22 39,-0.5 3,-1.9 -2,-0.2 -1,-0.1 0.352 57.8 103.4-103.3 -2.5 -1.0 20.5 26.0 150 167 A W T 3 S+ 0 0 88 1,-0.3 36,-0.3 38,-0.2 -1,-0.1 0.734 85.8 39.6 -55.9 -31.1 2.7 21.3 26.4 151 168 A Y T 3 S+ 0 0 10 -3,-0.2 2,-0.4 -30,-0.1 -1,-0.3 0.182 85.5 127.7-104.6 12.0 2.3 25.0 26.7 152 169 A R < - 0 0 44 -3,-1.9 -32,-0.1 18,-0.1 -3,-0.1 -0.586 59.3-122.1 -79.8 130.6 -0.9 25.1 28.8 153 170 A A >> - 0 0 0 -2,-0.4 4,-1.8 1,-0.1 3,-0.6 -0.317 19.7-120.2 -66.8 152.5 -0.8 27.2 32.0 154 171 A P H 3> S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 6,-0.2 0.857 110.9 59.5 -63.7 -34.2 -1.5 25.4 35.3 155 172 A E H 34>S+ 0 0 0 1,-0.2 5,-2.9 2,-0.2 8,-0.1 0.855 107.1 47.5 -65.0 -31.6 -4.6 27.6 36.1 156 173 A I H X45S+ 0 0 18 -3,-0.6 3,-1.6 3,-0.2 -1,-0.2 0.922 112.1 49.4 -71.1 -46.4 -6.2 26.3 32.8 157 174 A L H 3<5S+ 0 0 8 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.773 107.5 55.9 -62.8 -27.0 -5.3 22.7 33.7 158 175 A L T 3<5S- 0 0 1 -4,-2.0 60,-2.8 -5,-0.2 61,-0.4 0.326 124.9-100.9 -93.2 12.2 -6.8 23.2 37.2 159 176 A G T < 5 + 0 0 16 -3,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.671 59.3 166.1 83.1 21.7 -10.2 24.2 35.7 160 177 A X < - 0 0 66 -5,-2.9 3,-0.4 -6,-0.2 -1,-0.3 -0.554 17.2-167.1 -69.7 126.7 -10.0 28.0 36.1 161 178 A K S S+ 0 0 148 -2,-0.3 -1,-0.2 1,-0.2 -5,-0.0 0.763 78.5 43.9 -86.4 -33.6 -12.8 29.3 33.9 162 179 A Y S S+ 0 0 209 2,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.317 76.0 158.8-112.5 49.8 -11.9 33.0 33.8 163 180 A Y - 0 0 61 -3,-0.4 2,-0.1 1,-0.1 0, 0.0 -0.231 21.5-157.8 -67.9 161.5 -8.1 32.9 33.2 164 181 A S > - 0 0 44 -45,-0.0 3,-2.2 -47,-0.0 4,-0.3 -0.375 40.5 -49.0-126.4-158.0 -6.4 35.9 31.7 165 182 A T T >> S+ 0 0 30 1,-0.3 3,-1.5 2,-0.2 4,-1.0 0.707 115.5 77.0 -51.2 -28.3 -3.5 37.3 29.8 166 183 A A H 3> S+ 0 0 11 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.762 80.3 69.4 -58.8 -23.5 -1.1 35.5 32.2 167 184 A V H <> S+ 0 0 1 -3,-2.2 4,-1.9 1,-0.2 -1,-0.3 0.849 98.6 50.0 -64.3 -30.8 -1.8 32.2 30.3 168 185 A D H <> S+ 0 0 0 -3,-1.5 4,-2.7 -4,-0.3 -1,-0.2 0.875 106.6 53.8 -76.0 -35.5 0.1 33.6 27.3 169 186 A I H X S+ 0 0 1 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.924 108.3 51.3 -62.1 -44.9 3.1 34.6 29.4 170 187 A W H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.954 110.9 47.2 -54.4 -54.7 3.2 31.0 30.7 171 188 A S H X S+ 0 0 5 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.915 112.0 49.5 -55.2 -46.0 3.2 29.6 27.2 172 189 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.895 108.0 55.2 -64.9 -34.8 5.9 32.0 26.0 173 190 A G H X S+ 0 0 0 -4,-2.6 4,-2.6 76,-0.3 -2,-0.2 0.937 108.0 48.4 -60.5 -46.9 8.0 31.0 29.1 174 191 A C H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 11,-0.3 0.879 113.2 48.0 -59.8 -42.5 7.8 27.3 28.1 175 192 A I H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.880 108.7 53.1 -67.3 -40.2 8.7 28.2 24.5 176 193 A F H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.951 110.7 48.3 -56.2 -51.3 11.7 30.4 25.7 177 194 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.914 110.9 50.3 -56.4 -45.9 12.9 27.4 27.7 178 195 A E H X S+ 0 0 23 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.834 108.0 52.7 -63.3 -38.1 12.5 25.1 24.7 179 196 A M H < S+ 0 0 3 -4,-2.1 -87,-0.6 2,-0.2 -1,-0.2 0.934 114.4 43.7 -63.4 -39.7 14.5 27.4 22.5 180 197 A V H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.1 0.927 124.1 30.6 -72.0 -49.3 17.3 27.5 25.0 181 198 A T H < S- 0 0 43 -4,-3.0 -1,-0.2 2,-0.2 -3,-0.2 0.599 95.5-129.4 -88.4 -18.4 17.5 23.7 25.8 182 199 A R S < S+ 0 0 144 -4,-1.7 2,-0.3 -5,-0.3 -3,-0.1 0.703 80.3 88.3 72.4 22.5 16.4 22.3 22.5 183 200 A R S S- 0 0 198 -6,-0.3 -2,-0.2 -5,-0.2 -1,-0.2 -0.991 89.8 -94.2-148.1 143.2 13.9 20.1 24.2 184 201 A A - 0 0 19 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.271 28.8-142.7 -56.8 138.9 10.2 20.7 25.2 185 202 A L S S+ 0 0 30 -11,-0.3 -1,-0.1 1,-0.2 -34,-0.1 0.946 90.1 9.5 -69.3 -51.1 10.0 21.9 28.9 186 203 A F + 0 0 3 -36,-0.3 2,-2.0 2,-0.1 -1,-0.2 -0.673 69.3 178.5-133.8 77.3 6.7 20.1 29.8 187 204 A P + 0 0 36 0, 0.0 -37,-0.1 0, 0.0 7,-0.1 -0.387 17.0 173.5 -84.9 66.4 5.8 17.6 27.1 188 205 A G - 0 0 4 -2,-2.0 -39,-0.5 1,-0.1 -38,-0.2 -0.303 26.2-160.6 -70.4 151.8 2.7 16.1 28.7 189 206 A D S S+ 0 0 134 1,-0.2 2,-0.3 -40,-0.1 -1,-0.1 0.177 77.1 23.0-122.6 22.6 0.5 13.6 26.8 190 207 A S S > S- 0 0 47 1,-0.1 4,-3.0 -41,-0.0 5,-0.2 -0.921 90.4 -99.1-172.2 160.2 -2.6 14.0 28.9 191 208 A E H > S+ 0 0 100 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.882 124.0 43.1 -59.9 -38.7 -4.0 16.7 31.2 192 209 A I H > S+ 0 0 83 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.906 113.0 52.3 -76.6 -34.8 -2.8 15.0 34.4 193 210 A D H > S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.932 111.6 47.9 -63.2 -43.2 0.6 14.1 32.8 194 211 A Q H X S+ 0 0 0 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.947 113.0 47.3 -61.0 -49.6 1.0 17.8 31.9 195 212 A L H X S+ 0 0 6 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.934 113.7 47.3 -58.6 -46.5 0.0 18.9 35.4 196 213 A F H X S+ 0 0 33 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.852 107.4 55.9 -68.0 -30.2 2.4 16.4 37.0 197 214 A R H X S+ 0 0 92 -4,-2.4 4,-1.0 -5,-0.2 -1,-0.2 0.914 110.1 47.1 -66.6 -39.7 5.3 17.3 34.7 198 215 A I H >X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 3,-0.6 0.941 112.9 48.2 -65.2 -46.8 4.9 20.9 35.8 199 216 A F H 3X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.834 107.3 56.4 -62.6 -36.9 4.7 19.9 39.6 200 217 A R H 3< S+ 0 0 98 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.799 118.6 32.7 -67.2 -26.9 7.8 17.7 39.3 201 218 A T H << S+ 0 0 23 -4,-1.0 28,-3.3 -3,-0.6 -2,-0.2 0.887 132.0 27.9 -95.3 -48.8 9.8 20.6 38.0 202 219 A L H < S- 0 0 7 -4,-3.1 26,-0.3 26,-0.2 -3,-0.2 0.441 114.8-105.9 -94.9 -3.7 8.3 23.7 39.7 203 220 A G < - 0 0 6 -4,-1.6 24,-0.2 24,-0.5 -3,-0.2 0.233 45.8 -65.2 88.5 146.9 7.1 21.8 42.9 204 221 A T - 0 0 20 22,-2.3 24,-0.1 -5,-0.1 21,-0.1 -0.490 63.7-118.0 -65.1 126.3 3.5 21.0 43.7 205 222 A P + 0 0 2 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.322 39.8 174.0 -69.1 151.6 1.8 24.3 44.2 206 223 A D > - 0 0 72 -3,-0.0 4,-2.4 7,-0.0 7,-0.2 -0.810 49.5 -82.2-142.8-176.2 0.3 25.1 47.6 207 224 A E T 4 S+ 0 0 81 -2,-0.2 6,-0.1 1,-0.2 0, 0.0 0.774 121.0 61.2 -65.7 -26.4 -1.4 28.0 49.5 208 225 A V T 4 S+ 0 0 118 2,-0.2 -1,-0.2 1,-0.2 0, 0.0 0.980 118.7 23.8 -64.2 -56.5 2.0 29.5 50.3 209 226 A V T 4 S+ 0 0 68 1,-0.2 44,-0.5 43,-0.0 -2,-0.2 0.718 138.5 28.9 -83.3 -21.4 3.1 30.1 46.6 210 227 A W S >< S- 0 0 11 -4,-2.4 3,-2.4 42,-0.1 4,-0.3 -0.651 78.9-151.5-142.6 81.3 -0.4 30.2 45.1 211 228 A P T 3 S+ 0 0 74 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.277 85.2 18.1 -53.2 131.0 -3.1 31.5 47.5 212 229 A G T >> S+ 0 0 33 4,-0.0 3,-1.9 3,-0.0 4,-0.7 0.238 86.1 118.9 90.5 -13.2 -6.4 29.9 46.5 213 230 A V G X4 + 0 0 0 -3,-2.4 3,-1.1 1,-0.3 6,-0.1 0.850 69.1 60.5 -53.1 -38.2 -4.9 27.1 44.5 214 231 A T G 34 S+ 0 0 65 -4,-0.3 -1,-0.3 1,-0.2 -7,-0.0 0.644 102.1 53.4 -68.3 -11.7 -6.5 24.4 46.8 215 232 A S G <4 S+ 0 0 99 -3,-1.9 -1,-0.2 5,-0.1 -2,-0.2 0.588 80.3 124.9 -96.1 -12.8 -10.0 25.7 46.0 216 233 A M S X< S- 0 0 16 -3,-1.1 3,-1.8 -4,-0.7 -57,-0.1 -0.115 74.5-111.6 -49.8 141.9 -9.5 25.4 42.2 217 234 A P T 3 S+ 0 0 63 0, 0.0 -58,-0.2 0, 0.0 -1,-0.1 0.806 113.2 30.8 -44.5 -44.8 -12.1 23.3 40.4 218 235 A D T 3 S+ 0 0 78 -60,-2.8 2,-0.2 2,-0.0 -59,-0.2 0.263 88.9 120.0-106.2 12.2 -9.8 20.5 39.5 219 236 A Y < - 0 0 41 -3,-1.8 -5,-0.0 -61,-0.4 3,-0.0 -0.573 43.7-164.4 -74.7 141.1 -7.4 20.6 42.4 220 237 A K > - 0 0 104 -2,-0.2 3,-2.4 1,-0.1 -5,-0.1 -0.993 24.6-143.1-131.3 128.8 -7.2 17.4 44.5 221 238 A P T 3 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.718 101.8 69.0 -58.4 -19.4 -5.6 17.2 47.9 222 239 A S T 3 + 0 0 102 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.456 69.1 123.4 -81.4 -0.6 -4.4 13.8 46.8 223 240 A F S < S- 0 0 16 -3,-2.4 -19,-0.0 1,-0.1 -4,-0.0 -0.369 74.2-105.6 -58.6 135.7 -2.0 15.3 44.2 224 241 A P - 0 0 54 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.321 29.8-126.8 -63.1 147.8 1.6 14.0 45.0 225 242 A K + 0 0 186 -3,-0.1 2,-0.3 -21,-0.1 -25,-0.0 -0.865 33.6 179.1-103.2 102.4 3.7 16.7 46.7 226 243 A W - 0 0 73 -2,-0.8 -22,-2.3 -27,-0.1 2,-0.2 -0.739 27.2-116.3 -99.3 152.4 7.0 17.1 44.7 227 244 A A - 0 0 87 -2,-0.3 -24,-0.5 -24,-0.2 2,-0.2 -0.541 34.5-103.2 -86.4 150.7 9.8 19.5 45.6 228 245 A R - 0 0 118 -26,-0.3 -26,-0.2 -2,-0.2 2,-0.2 -0.485 32.2-133.7 -73.1 144.2 10.7 22.4 43.2 229 246 A Q - 0 0 68 -28,-3.3 2,-0.2 -2,-0.2 -1,-0.1 -0.607 23.9-102.1 -95.7 155.8 13.9 22.1 41.1 230 247 A D >> - 0 0 118 -2,-0.2 3,-1.4 1,-0.1 4,-1.3 -0.532 21.4-134.1 -74.3 139.0 16.6 24.8 40.6 231 248 A F H 3> S+ 0 0 24 1,-0.3 4,-2.8 -2,-0.2 -1,-0.1 0.819 105.2 70.2 -62.1 -28.8 16.3 26.6 37.3 232 249 A S H 34 S+ 0 0 65 1,-0.3 -1,-0.3 2,-0.2 6,-0.1 0.826 105.1 40.2 -57.2 -31.5 20.0 26.2 37.0 233 250 A K H <4 S+ 0 0 144 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.769 115.1 54.7 -85.8 -27.2 19.2 22.5 36.5 234 251 A V H < S+ 0 0 24 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.2 0.888 122.5 15.1 -76.5 -43.5 16.2 23.3 34.3 235 252 A V S >< S- 0 0 0 -4,-2.8 3,-3.0 3,-0.1 -1,-0.2 -0.131 86.3-163.0-131.3 45.3 17.7 25.5 31.6 236 253 A P T 3 S+ 0 0 71 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.391 70.9 23.7 -62.8 144.4 21.5 25.3 31.6 237 254 A P T 3 S+ 0 0 122 0, 0.0 -5,-0.1 0, 0.0 -4,-0.0 -0.734 85.8 123.8-108.1 44.7 23.3 27.1 30.3 238 255 A L < - 0 0 6 -3,-3.0 -3,-0.1 1,-0.1 -61,-0.0 -0.331 63.3-115.6 -58.1 137.7 20.9 30.1 30.4 239 256 A D > - 0 0 56 1,-0.1 4,-2.8 -3,-0.1 5,-0.3 -0.159 28.9 -94.7 -71.8 171.8 22.5 33.0 32.2 240 257 A E H > S+ 0 0 119 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.824 124.3 51.0 -59.1 -35.7 21.2 34.6 35.4 241 258 A D H > S+ 0 0 75 2,-0.2 4,-2.5 1,-0.2 27,-0.3 0.951 112.6 46.1 -66.5 -49.1 19.2 37.3 33.6 242 259 A G H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.914 114.7 47.1 -58.1 -48.2 17.5 34.7 31.4 243 260 A R H X S+ 0 0 52 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.915 111.2 51.8 -63.7 -41.3 16.7 32.3 34.3 244 261 A S H X S+ 0 0 41 -4,-2.4 4,-1.9 -5,-0.3 -2,-0.2 0.946 112.7 44.9 -59.6 -47.0 15.4 35.2 36.4 245 262 A L H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.941 113.3 51.2 -61.6 -48.0 13.0 36.3 33.6 246 263 A L H X S+ 0 0 0 -4,-2.9 4,-1.1 1,-0.2 -2,-0.2 0.905 106.8 53.8 -54.4 -46.3 12.0 32.7 33.0 247 264 A S H >< S+ 0 0 32 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.909 109.3 48.1 -59.1 -41.1 11.2 32.2 36.7 248 265 A Q H >< S+ 0 0 67 -4,-1.9 10,-2.2 1,-0.2 3,-0.8 0.800 109.2 53.0 -70.1 -28.3 8.9 35.2 36.7 249 266 A M H 3< S+ 0 0 0 -4,-1.7 -76,-0.3 1,-0.2 -1,-0.2 0.656 111.4 47.9 -78.6 -16.6 7.1 34.0 33.5 250 267 A L T << S+ 0 0 3 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.131 76.3 142.5-110.7 17.6 6.5 30.6 35.1 251 268 A H < - 0 0 66 -3,-0.8 6,-0.2 1,-0.1 -3,-0.1 -0.346 50.7-137.6 -57.5 136.3 5.2 31.9 38.5 252 269 A Y S S+ 0 0 11 -50,-0.1 -97,-0.2 4,-0.1 -1,-0.1 0.948 87.8 71.6 -61.2 -52.0 2.3 29.6 39.6 253 270 A D S >> S- 0 0 18 -44,-0.5 4,-1.6 1,-0.2 3,-1.3 -0.563 76.0-148.6 -69.4 122.7 0.0 32.5 40.8 254 271 A P T 34 S+ 0 0 25 0, 0.0 -1,-0.2 0, 0.0 -88,-0.1 0.702 99.0 57.6 -65.9 -20.4 -1.3 34.2 37.6 255 272 A N T 34 S+ 0 0 150 1,-0.2 -2,-0.1 -89,-0.0 -3,-0.0 0.645 110.2 42.2 -82.3 -18.0 -1.4 37.4 39.6 256 273 A K T <4 S+ 0 0 106 -3,-1.3 -1,-0.2 2,-0.1 3,-0.1 0.632 89.0 110.0 -98.3 -23.8 2.3 37.2 40.4 257 274 A R S < S- 0 0 13 -4,-1.6 -8,-0.2 -6,-0.2 -9,-0.1 -0.281 82.0-102.8 -55.5 132.8 3.3 36.1 36.9 258 275 A I - 0 0 19 -10,-2.2 2,-0.2 -13,-0.2 -1,-0.1 -0.321 34.4-124.3 -60.5 145.9 5.2 38.8 35.1 259 276 A S > - 0 0 63 1,-0.1 4,-2.8 -3,-0.1 5,-0.2 -0.493 19.4-114.8 -86.2 160.7 3.3 40.9 32.6 260 277 A A H > S+ 0 0 3 1,-0.2 4,-1.7 2,-0.2 -151,-0.1 0.917 117.8 50.6 -60.6 -43.7 4.4 41.2 29.0 261 278 A K H > S+ 0 0 167 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.921 112.7 45.4 -61.3 -44.9 5.0 45.0 29.5 262 279 A A H >4 S+ 0 0 50 1,-0.2 3,-1.4 2,-0.2 4,-0.4 0.920 108.5 58.0 -65.2 -41.8 7.0 44.4 32.7 263 280 A A H >< S+ 0 0 0 -4,-2.8 3,-1.8 1,-0.3 6,-0.2 0.861 96.3 61.8 -56.3 -38.4 9.0 41.6 31.0 264 281 A L H 3< S+ 0 0 41 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.765 104.3 50.8 -60.6 -25.4 10.2 44.0 28.2 265 282 A A T << S+ 0 0 85 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.497 82.4 121.0 -91.5 -4.1 11.9 46.0 30.9 266 283 A H S X S- 0 0 17 -3,-1.8 3,-2.3 -4,-0.4 4,-0.1 -0.304 76.3-116.5 -62.9 141.6 13.7 43.1 32.5 267 284 A P G > S+ 0 0 78 0, 0.0 3,-1.9 0, 0.0 4,-0.3 0.684 107.2 79.2 -51.0 -24.7 17.6 43.4 32.5 268 285 A F G > S+ 0 0 1 -27,-0.3 3,-0.6 1,-0.3 -26,-0.1 0.844 92.3 50.8 -53.8 -34.0 17.7 40.3 30.2 269 286 A F G X S+ 0 0 11 -3,-2.3 3,-1.8 -6,-0.2 -1,-0.3 0.341 75.9 106.0 -90.6 10.1 16.9 42.7 27.3 270 287 A Q G < S+ 0 0 169 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.835 91.8 31.9 -56.1 -37.1 19.5 45.2 28.1 271 288 A D G < S+ 0 0 92 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.1 0.016 86.4 152.0-112.9 27.3 21.6 44.1 25.2 272 289 A V < + 0 0 42 -3,-1.8 2,-0.2 -174,-0.1 -176,-0.1 -0.295 14.2 169.7 -61.7 142.4 18.9 43.0 22.8 273 290 A T - 0 0 80 -178,-0.4 -2,-0.0 -2,-0.0 -1,-0.0 -0.768 36.4-114.3-139.1-179.1 19.6 43.2 19.1 274 291 A K - 0 0 125 -2,-0.2 -178,-0.1 -175,-0.0 -141,-0.1 -0.753 36.9-176.8-130.0 83.2 17.9 41.9 15.9 275 292 A P - 0 0 36 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.221 27.7-114.7 -72.1 169.0 20.0 39.3 14.2 276 293 A V - 0 0 109 -144,-0.0 -145,-0.1 -2,-0.0 2,-0.1 -0.919 26.7-141.8-108.4 124.3 19.1 37.6 10.9 277 294 A P - 0 0 11 0, 0.0 2,-0.8 0, 0.0 -145,-0.1 -0.400 22.1-112.2 -77.0 161.9 18.4 33.9 11.1 278 295 A H - 0 0 141 -2,-0.1 2,-0.5 2,-0.0 -148,-0.0 -0.902 40.3-171.6 -97.9 112.3 19.6 31.6 8.3 279 296 A L - 0 0 11 -2,-0.8 2,-0.9 -149,-0.1 -196,-0.0 -0.948 16.1-161.8-110.0 125.9 16.5 30.5 6.6 280 297 A R 0 0 177 -2,-0.5 -2,-0.0 0, 0.0 0, 0.0 -0.829 360.0 360.0-107.1 91.6 16.6 27.8 4.0 281 298 A L 0 0 131 -2,-0.9 -203,-0.1 -203,-0.0 -204,-0.0 -0.334 360.0 360.0 -81.7 360.0 13.3 28.1 2.1