==== 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 2R3I . 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 . 290 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14472.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 63.1 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 . 39 13.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 15 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 26.9 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 2 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 . 1 1 1 0 2 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 . 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 39 0, 0.0 3,-2.1 0, 0.0 62,-0.0 0.000 360.0 360.0 360.0 -19.0 -13.0 31.1 -3.4 2 2 A E T 3 + 0 0 147 1,-0.3 22,-0.0 3,-0.1 0, 0.0 0.621 360.0 68.0 -66.2 -10.3 -12.9 31.3 -7.2 3 3 A N T 3 S+ 0 0 64 21,-0.1 21,-2.2 20,-0.1 22,-0.7 0.476 95.7 65.6 -86.4 -2.7 -10.6 34.2 -6.7 4 4 A F E < -A 23 0A 27 -3,-2.1 2,-0.6 19,-0.3 19,-0.2 -0.967 63.2-153.4-129.0 139.8 -7.8 32.0 -5.3 5 5 A Q E -A 22 0A 99 17,-2.9 17,-2.5 -2,-0.4 2,-0.2 -0.933 24.2-131.9-108.7 119.1 -5.7 29.3 -6.8 6 6 A K E -A 21 0A 92 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.495 23.2-178.1 -71.2 133.6 -4.4 26.7 -4.2 7 7 A V E - 0 0 60 13,-3.4 2,-0.3 1,-0.4 14,-0.2 0.830 59.3 -32.8 -96.6 -51.5 -0.7 26.1 -4.6 8 8 A E E -A 20 0A 112 12,-1.4 12,-3.0 0, 0.0 -1,-0.4 -0.971 60.1 -95.2-168.1 156.4 -0.1 23.4 -2.0 9 9 A K E +A 19 0A 108 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.638 34.3 179.4 -77.8 130.6 -1.2 22.2 1.4 10 10 A I E - 0 0 69 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.239 58.8 -24.2-116.3 8.0 1.1 23.7 4.1 11 11 A G E -A 18 0A 27 7,-0.9 7,-2.5 2,-0.0 2,-0.6 -0.890 52.2-107.6 161.8 164.4 -0.4 22.2 7.1 12 12 A E E -A 17 0A 99 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.997 46.2-162.4-115.9 109.6 -3.4 20.8 8.9 13 13 A G - 0 0 16 3,-2.6 139,-0.5 -2,-0.6 140,-0.3 -0.360 35.4 -92.9 -88.5 178.8 -4.5 23.4 11.3 14 14 A T S S+ 0 0 13 1,-0.2 138,-1.1 137,-0.1 139,-0.1 0.912 124.8 29.8 -53.7 -42.4 -6.7 23.2 14.4 15 15 A Y S S- 0 0 41 1,-0.2 2,-0.3 136,-0.2 -1,-0.2 0.525 127.8 -45.4-101.2 -12.2 -9.7 24.0 12.3 16 16 A G S S- 0 0 5 19,-0.2 -3,-2.6 -3,-0.2 -1,-0.2 -0.964 82.1 -34.6 165.3-176.6 -9.1 22.7 8.8 17 17 A V E -A 12 0A 15 -2,-0.3 17,-2.1 -5,-0.2 2,-0.5 -0.323 48.7-146.6 -69.9 148.7 -6.5 22.5 6.0 18 18 A V E -AB 11 33A 12 -7,-2.5 -8,-2.7 15,-0.2 -7,-0.9 -0.983 19.8-172.0-116.8 128.0 -4.2 25.4 5.5 19 19 A Y E -AB 9 32A 53 13,-2.5 13,-3.0 -2,-0.5 2,-0.4 -0.923 28.3-130.5-119.6 150.8 -3.1 26.1 2.0 20 20 A K E +AB 8 31A 43 -12,-3.0 -13,-3.4 -2,-0.4 -12,-1.4 -0.829 46.7 173.1 -86.8 135.2 -0.6 28.4 0.3 21 21 A A E -AB 6 30A 0 9,-2.6 9,-2.8 -2,-0.4 2,-0.4 -0.943 30.0-130.9-143.3 164.9 -2.7 30.1 -2.4 22 22 A R E -AB 5 29A 90 -17,-2.5 -17,-2.9 -2,-0.3 2,-0.8 -0.974 23.6-122.5-123.5 132.6 -2.5 32.8 -5.0 23 23 A N E > -A 4 0A 21 5,-3.1 4,-2.4 -2,-0.4 -19,-0.3 -0.627 19.7-148.1 -69.7 106.4 -5.0 35.6 -5.6 24 24 A K T 4 S+ 0 0 127 -21,-2.2 -1,-0.2 -2,-0.8 -20,-0.1 0.750 93.2 43.9 -49.8 -24.3 -6.0 35.0 -9.3 25 25 A L T 4 S+ 0 0 124 -22,-0.7 -1,-0.1 3,-0.1 -21,-0.0 0.849 126.1 19.2 -84.0 -93.6 -6.4 38.8 -9.4 26 26 A T T 4 S- 0 0 108 1,-0.2 -2,-0.2 2,-0.0 3,-0.1 0.689 95.6-126.3 -51.4 -23.8 -3.7 40.7 -7.7 27 27 A G < + 0 0 36 -4,-2.4 -1,-0.2 1,-0.3 -3,-0.1 0.446 53.8 159.6 86.2 0.1 -1.3 37.7 -7.9 28 28 A E - 0 0 94 -5,-0.2 -5,-3.1 -6,-0.1 2,-0.5 -0.251 38.9-134.3 -56.6 137.8 -0.8 38.0 -4.1 29 29 A V E +B 22 0A 54 -7,-0.2 46,-0.6 -3,-0.1 2,-0.3 -0.868 38.8 163.5 -98.0 127.3 0.5 34.8 -2.3 30 30 A V E -BC 21 74A 0 -9,-2.8 -9,-2.6 -2,-0.5 2,-0.5 -0.842 42.1-110.7-135.1 169.6 -1.5 34.2 0.9 31 31 A A E -BC 20 73A 8 42,-2.7 42,-2.9 -2,-0.3 2,-0.5 -0.931 31.8-159.1-103.8 132.2 -2.3 31.5 3.4 32 32 A L E -BC 19 72A 4 -13,-3.0 -13,-2.5 -2,-0.5 2,-0.5 -0.975 4.7-164.8-117.0 123.5 -5.9 30.3 3.1 33 33 A K E -BC 18 71A 29 38,-2.9 38,-2.5 -2,-0.5 2,-0.4 -0.935 9.0-150.0-115.3 119.2 -7.5 28.5 6.2 34 34 A K E C 0 70A 72 -17,-2.1 36,-0.2 -2,-0.5 -21,-0.1 -0.690 360.0 360.0 -82.0 136.7 -10.7 26.6 5.9 35 35 A I 0 0 50 34,-2.8 34,-0.6 -2,-0.4 -19,-0.2 -0.899 360.0 360.0-109.6 360.0 -12.6 26.6 9.2 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 61 0, 0.0 5,-0.1 0, 0.0 30,-0.1 0.000 360.0 360.0 360.0 128.7 -21.3 29.9 10.8 38 45 A P >> - 0 0 84 0, 0.0 4,-1.8 0, 0.0 3,-0.8 -0.229 360.0-123.9 -57.1 140.1 -22.8 31.3 14.0 39 46 A S H 3> S+ 0 0 78 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.811 109.2 60.5 -55.4 -36.3 -23.1 35.1 13.9 40 47 A T H 3> S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.898 104.7 48.4 -62.1 -38.0 -21.1 35.5 17.1 41 48 A A H <> S+ 0 0 5 -3,-0.8 4,-2.6 1,-0.2 5,-0.3 0.933 110.7 51.3 -69.4 -41.5 -18.1 33.8 15.5 42 49 A I H X S+ 0 0 49 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.916 110.6 48.5 -59.8 -45.3 -18.4 36.0 12.4 43 50 A R H X S+ 0 0 154 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.944 112.1 48.6 -62.9 -42.6 -18.5 39.2 14.5 44 51 A E H X S+ 0 0 47 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.935 114.4 44.9 -62.1 -47.1 -15.4 38.1 16.6 45 52 A I H >X S+ 0 0 1 -4,-2.6 3,-0.9 1,-0.2 4,-0.6 0.902 108.2 58.0 -64.3 -40.6 -13.4 37.2 13.5 46 53 A S H >< S+ 0 0 44 -4,-2.5 3,-1.2 -5,-0.3 -1,-0.2 0.887 101.7 55.6 -58.5 -35.5 -14.4 40.4 11.8 47 54 A L H >< S+ 0 0 117 -4,-1.8 3,-1.5 1,-0.2 -1,-0.3 0.778 95.0 68.1 -67.6 -25.2 -13.0 42.4 14.7 48 55 A L H X< S+ 0 0 13 -3,-0.9 3,-1.3 -4,-0.9 11,-0.3 0.728 80.6 78.2 -69.5 -17.0 -9.6 40.7 14.2 49 56 A K T << S+ 0 0 85 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.744 96.8 45.2 -64.1 -19.4 -9.2 42.5 10.9 50 57 A E T < S+ 0 0 167 -3,-1.5 2,-1.9 -4,-0.2 -1,-0.3 0.468 83.6 96.8-101.7 -1.3 -8.2 45.6 12.8 51 58 A L < + 0 0 17 -3,-1.3 2,-0.4 -4,-0.3 8,-0.2 -0.568 59.6 165.2 -89.9 72.8 -5.8 43.9 15.3 52 59 A N + 0 0 71 -2,-1.9 5,-0.1 6,-0.1 6,-0.0 -0.815 7.6 142.3-103.2 130.5 -2.8 44.8 13.2 53 60 A H > - 0 0 44 -2,-0.4 3,-2.0 3,-0.4 54,-0.0 -0.974 56.6-111.2-160.3 149.2 0.8 44.7 14.3 54 61 A P T 3 S+ 0 0 92 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.718 117.3 48.9 -60.6 -20.8 4.2 43.7 12.7 55 62 A N T 3 S+ 0 0 10 80,-0.1 81,-2.6 48,-0.1 2,-0.4 0.191 98.4 79.6-104.5 16.4 4.5 40.6 14.9 56 63 A I B < S-e 136 0B 9 -3,-2.0 -3,-0.4 79,-0.3 81,-0.2 -0.986 90.0-114.2-121.9 125.7 1.0 39.4 14.2 57 64 A V - 0 0 9 79,-2.5 2,-0.2 -2,-0.4 81,-0.1 -0.433 43.8-111.9 -59.6 127.2 0.2 37.5 11.0 58 65 A K - 0 0 93 -2,-0.1 16,-2.4 -4,-0.1 2,-0.8 -0.450 16.2-141.9 -71.2 129.3 -2.1 39.9 9.1 59 66 A L E -D 73 0A 12 -11,-0.3 14,-0.2 -2,-0.2 3,-0.1 -0.783 23.2-179.7 -83.5 109.2 -5.7 38.7 8.7 60 67 A L E - 0 0 32 12,-2.5 2,-0.3 -2,-0.8 13,-0.2 0.907 53.3 -25.9 -80.5 -45.8 -6.5 40.0 5.2 61 68 A D E -D 72 0A 93 11,-1.5 11,-2.8 2,-0.0 2,-0.4 -0.984 46.5-126.4-163.5 167.4 -10.0 38.9 4.7 62 69 A V E -D 71 0A 40 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.991 18.9-164.6-125.5 130.4 -12.8 36.6 5.6 63 70 A I E +D 70 0A 32 7,-2.9 7,-3.0 -2,-0.4 2,-0.5 -0.970 10.1 174.8-118.1 127.5 -14.8 34.6 2.9 64 71 A H E +D 69 0A 73 -2,-0.5 2,-0.4 5,-0.2 5,-0.2 -0.946 14.9 150.9-136.7 104.6 -18.1 33.0 3.9 65 72 A T E > +D 68 0A 61 3,-2.1 3,-2.2 -2,-0.5 -2,-0.0 -0.999 66.8 1.9-139.3 138.6 -20.0 31.4 1.0 66 73 A E T 3 S- 0 0 180 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.842 128.2 -63.3 54.7 34.6 -22.4 28.5 1.0 67 74 A N T 3 S+ 0 0 135 1,-0.2 2,-0.4 -30,-0.1 -1,-0.3 0.712 110.5 124.0 61.2 22.5 -21.9 28.3 4.7 68 75 A K E < - D 0 65A 57 -3,-2.2 -3,-2.1 -31,-0.0 2,-0.5 -0.944 49.9-149.5-110.6 135.1 -18.2 27.5 4.3 69 76 A L E + D 0 64A 2 -34,-0.6 -34,-2.8 -2,-0.4 2,-0.4 -0.913 16.1 178.9-113.7 131.8 -15.8 29.8 6.0 70 77 A Y E -CD 34 63A 29 -7,-3.0 -7,-2.9 -2,-0.5 2,-0.4 -0.980 13.9-153.5-128.9 136.4 -12.2 30.7 4.8 71 78 A L E -CD 33 62A 0 -38,-2.5 -38,-2.9 -2,-0.4 2,-0.5 -0.927 9.4-151.8-107.8 138.4 -9.7 33.1 6.4 72 79 A V E +CD 32 61A 4 -11,-2.8 -12,-2.5 -2,-0.4 -11,-1.5 -0.932 21.8 177.7-113.4 122.1 -7.1 34.7 4.2 73 80 A F E -CD 31 59A 10 -42,-2.9 -42,-2.7 -2,-0.5 -14,-0.2 -0.885 38.8 -90.6-122.9 156.3 -3.8 35.6 5.9 74 81 A E E -C 30 0A 53 -16,-2.4 2,-0.4 -2,-0.3 -44,-0.2 -0.356 53.5-119.8 -51.1 140.4 -0.5 37.1 5.1 75 82 A F - 0 0 33 -46,-0.6 2,-0.3 -54,-0.1 -1,-0.1 -0.754 28.3-173.5 -95.9 136.7 1.8 34.2 4.0 76 83 A L - 0 0 13 -2,-0.4 53,-0.1 1,-0.1 52,-0.0 -0.956 22.8-134.9-124.3 148.1 5.1 33.3 5.8 77 84 A H S S+ 0 0 105 -2,-0.3 2,-0.3 51,-0.3 52,-0.1 0.642 75.3 17.9 -78.8 -20.7 7.5 30.7 4.5 78 85 A Q E -F 128 0B 20 50,-1.1 50,-2.8 213,-0.1 2,-0.2 -0.996 61.6-132.9-151.0 155.3 8.4 28.7 7.7 79 86 A D E > -F 127 0B 41 -2,-0.3 4,-1.9 48,-0.3 48,-0.2 -0.630 31.2-111.9-105.3 169.8 7.3 27.9 11.2 80 87 A L H > S+ 0 0 0 46,-2.5 4,-3.0 43,-1.3 5,-0.2 0.810 113.4 61.4 -70.8 -28.4 9.4 27.8 14.4 81 88 A K H > S+ 0 0 87 42,-0.8 4,-2.7 45,-0.3 -1,-0.2 0.952 107.2 43.4 -62.8 -48.8 9.0 24.1 14.7 82 89 A K H > S+ 0 0 134 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.907 114.5 51.2 -63.9 -39.4 10.8 23.4 11.4 83 90 A F H X S+ 0 0 12 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.920 111.0 47.3 -67.9 -37.3 13.4 26.0 12.2 84 91 A M H < S+ 0 0 19 -4,-3.0 -2,-0.2 2,-0.2 -1,-0.2 0.928 111.0 51.5 -68.8 -39.4 14.1 24.4 15.7 85 92 A D H >< S+ 0 0 105 -4,-2.7 3,-1.0 1,-0.2 -1,-0.2 0.912 113.2 45.7 -63.0 -40.0 14.3 21.0 14.1 86 93 A A H 3< S+ 0 0 81 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.749 114.1 48.1 -72.0 -28.0 16.8 22.3 11.6 87 94 A S T 3X S+ 0 0 21 -4,-1.6 4,-2.8 -3,-0.2 3,-0.3 0.208 82.1 105.2 -96.4 8.9 18.8 24.2 14.2 88 95 A A T <4 + 0 0 40 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.748 67.4 61.3 -67.2 -27.8 19.0 21.2 16.6 89 96 A L T 4 S+ 0 0 168 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.917 129.9 8.6 -66.3 -41.4 22.6 20.2 16.0 90 97 A T T 4 S- 0 0 113 -3,-0.3 -2,-0.2 1,-0.0 -1,-0.2 0.564 106.8-127.0-114.5 -15.4 24.0 23.5 17.3 91 98 A G < - 0 0 8 -4,-2.8 -3,-0.1 -7,-0.2 99,-0.1 0.173 38.3 -61.3 81.7 155.5 20.8 25.1 18.6 92 99 A I - 0 0 13 97,-0.5 5,-0.1 1,-0.1 -8,-0.0 -0.574 66.4-106.4 -70.4 127.9 19.4 28.5 17.8 93 100 A P >> - 0 0 79 0, 0.0 4,-2.4 0, 0.0 3,-1.1 -0.317 26.3-117.3 -58.3 142.2 22.1 31.1 18.8 94 101 A L H 3> S+ 0 0 62 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.871 112.9 57.9 -51.0 -41.4 21.1 33.0 22.0 95 102 A P H 3> S+ 0 0 69 0, 0.0 4,-2.1 0, 0.0 188,-0.4 0.873 110.3 44.5 -59.7 -34.4 20.9 36.4 20.2 96 103 A L H <> S+ 0 0 8 -3,-1.1 4,-2.9 2,-0.2 5,-0.2 0.893 111.9 51.1 -76.4 -41.6 18.3 35.0 17.8 97 104 A I H X S+ 0 0 5 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.943 113.1 48.3 -55.8 -46.8 16.3 33.3 20.6 98 105 A K H X S+ 0 0 11 -4,-3.1 4,-2.6 -5,-0.2 -2,-0.2 0.908 110.6 48.7 -61.3 -46.7 16.4 36.6 22.3 99 106 A S H X S+ 0 0 3 -4,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.925 113.7 48.0 -58.4 -47.0 15.3 38.6 19.2 100 107 A Y H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.935 112.3 47.7 -62.1 -45.1 12.4 36.1 18.6 101 108 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.928 112.2 50.7 -61.9 -43.7 11.3 36.2 22.3 102 109 A F H X S+ 0 0 61 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.928 112.8 45.3 -57.4 -47.0 11.4 40.0 22.2 103 110 A Q H X S+ 0 0 13 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.899 112.1 51.1 -65.7 -44.1 9.3 40.2 19.0 104 111 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.908 108.0 52.9 -61.9 -40.3 6.8 37.6 20.2 105 112 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.867 106.7 53.2 -61.8 -37.3 6.4 39.6 23.5 106 113 A Q H X S+ 0 0 61 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.919 109.3 48.9 -64.2 -41.4 5.7 42.8 21.4 107 114 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.944 113.7 46.2 -62.9 -43.7 3.0 40.8 19.5 108 115 A L H X S+ 0 0 0 -4,-2.6 4,-3.4 1,-0.2 5,-0.3 0.932 110.7 52.9 -62.7 -46.3 1.5 39.6 22.8 109 116 A A H X S+ 0 0 25 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.922 110.2 48.1 -58.3 -43.0 1.6 43.1 24.3 110 117 A F H X S+ 0 0 48 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.959 116.6 41.2 -63.2 -52.8 -0.2 44.6 21.4 111 118 A C H ><>S+ 0 0 0 -4,-2.4 5,-2.2 1,-0.2 3,-1.4 0.924 113.2 53.2 -61.8 -45.9 -3.0 42.0 21.4 112 119 A H H ><5S+ 0 0 19 -4,-3.4 3,-1.9 1,-0.3 -1,-0.2 0.822 98.0 64.9 -60.8 -28.7 -3.3 41.9 25.1 113 120 A S H 3<5S+ 0 0 86 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.804 107.1 43.9 -65.7 -20.0 -3.8 45.7 25.2 114 121 A H T <<5S- 0 0 109 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.272 119.4-113.8-104.4 11.5 -7.0 45.0 23.3 115 122 A R T < 5S+ 0 0 174 -3,-1.9 2,-0.4 1,-0.2 -3,-0.2 0.754 70.4 140.9 58.3 31.9 -7.9 42.1 25.6 116 123 A V < - 0 0 22 -5,-2.2 2,-0.3 -6,-0.1 -1,-0.2 -0.864 34.0-160.4-104.0 133.4 -7.5 39.6 22.7 117 124 A L - 0 0 38 -2,-0.4 23,-1.4 1,-0.2 26,-0.3 -0.759 22.7-155.8-107.5 158.8 -5.9 36.2 23.6 118 125 A H - 0 0 4 -2,-0.3 24,-0.6 21,-0.2 -1,-0.2 0.874 20.9-178.9 -91.0 -59.8 -4.2 33.6 21.5 119 126 A R + 0 0 33 56,-0.1 44,-0.1 23,-0.1 20,-0.1 0.232 69.4 55.6 82.1 -15.3 -4.8 30.7 23.9 120 127 A D + 0 0 16 18,-0.1 2,-0.1 42,-0.1 38,-0.1 -0.121 65.7 162.6-143.2 48.0 -3.1 28.1 21.8 121 128 A L + 0 0 1 40,-0.1 40,-0.1 3,-0.1 17,-0.1 -0.405 12.7 147.0 -64.7 140.5 0.5 29.3 21.1 122 129 A K > - 0 0 23 -2,-0.1 3,-2.3 1,-0.1 4,-0.3 -0.973 62.5 -91.7-165.0 165.5 2.8 26.6 19.9 123 130 A P G > S+ 0 0 1 0, 0.0 3,-1.4 0, 0.0 -43,-1.3 0.828 119.5 64.4 -55.9 -31.4 5.8 26.3 17.5 124 131 A Q G 3 S+ 0 0 84 1,-0.3 -3,-0.1 -44,-0.2 -42,-0.0 0.606 106.0 42.9 -67.5 -18.9 3.5 25.5 14.6 125 132 A N G < S+ 0 0 8 -3,-2.3 12,-3.0 -5,-0.1 2,-0.6 0.221 91.7 91.5-114.0 16.1 1.8 28.9 14.8 126 133 A L E < - G 0 136B 0 -3,-1.4 -46,-2.5 -4,-0.3 2,-0.4 -0.956 66.3-164.1-108.0 116.0 4.9 31.0 15.3 127 134 A L E -FG 79 135B 29 8,-3.0 8,-2.6 -2,-0.6 2,-0.3 -0.825 8.7-162.7-114.6 143.8 6.1 32.0 11.8 128 135 A I E -FG 78 134B 0 -50,-2.8 -50,-1.1 -2,-0.4 -51,-0.3 -0.853 2.5-162.2-126.0 155.1 9.3 33.3 10.5 129 136 A N > - 0 0 34 4,-1.6 3,-1.2 -2,-0.3 -53,-0.1 -0.719 41.2 -95.1-123.0-179.5 10.7 35.1 7.4 130 137 A T T 3 S+ 0 0 67 1,-0.2 159,-0.1 -2,-0.2 -2,-0.0 0.610 114.2 68.0 -73.1 -9.2 14.1 35.8 5.8 131 138 A E T 3 S- 0 0 123 155,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.346 117.2-101.5 -92.2 -1.7 14.3 39.2 7.5 132 139 A G S < S+ 0 0 0 -3,-1.2 2,-0.2 1,-0.3 -2,-0.1 0.529 79.4 134.6 91.3 4.3 14.7 37.9 11.1 133 140 A A - 0 0 11 151,-0.1 -4,-1.6 -30,-0.0 2,-0.3 -0.564 36.0-165.2 -84.0 154.8 11.0 38.6 11.9 134 141 A I E - G 0 128B 0 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.983 8.6-171.2-134.5 144.4 8.8 36.2 13.8 135 142 A K E - G 0 127B 27 -8,-2.6 -8,-3.0 -2,-0.3 2,-0.5 -0.968 23.7-118.9-138.9 149.2 5.0 36.5 14.0 136 143 A L E -eG 56 126B 0 -81,-2.6 -79,-2.5 -2,-0.3 3,-0.4 -0.802 28.1-157.2 -89.7 126.8 2.1 34.9 15.8 137 144 A A + 0 0 3 -12,-3.0 -79,-0.1 -2,-0.5 -12,-0.0 -0.761 67.8 21.2-100.6 149.5 -0.5 33.2 13.6 138 145 A D S > S+ 0 0 18 -2,-0.3 3,-1.6 1,-0.2 4,-0.5 0.625 72.8 171.5 71.4 21.6 -4.1 32.5 14.6 139 146 A F T 3 + 0 0 13 -3,-0.4 -21,-0.2 1,-0.2 -1,-0.2 -0.337 68.2 11.1 -58.2 134.9 -4.4 35.1 17.4 140 147 A G T 3> S+ 0 0 0 -23,-1.4 4,-1.2 1,-0.1 3,-0.3 0.271 93.5 109.0 83.2 -10.5 -8.0 35.4 18.6 141 148 A L H <> + 0 0 3 -3,-1.6 4,-3.0 1,-0.2 5,-0.4 0.853 68.4 64.4 -69.9 -32.8 -9.3 32.3 16.8 142 149 A A H > S+ 0 0 13 -24,-0.6 4,-2.4 -4,-0.5 -1,-0.2 0.892 103.7 46.8 -56.6 -42.4 -9.7 30.4 20.0 143 150 A R H 4 S+ 0 0 204 -26,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.878 116.2 46.3 -68.5 -34.2 -12.4 32.8 21.3 144 151 A A H < S+ 0 0 15 -4,-1.2 -2,-0.2 1,-0.1 -1,-0.2 0.893 134.4 10.2 -73.2 -39.5 -14.2 32.7 18.0 145 152 A F H < S- 0 0 51 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.454 100.1-121.0-121.7 -8.8 -14.2 28.9 17.4 146 153 A G < - 0 0 32 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.1 -0.102 28.5 -88.9 82.3 168.7 -13.0 27.3 20.7 147 154 A V - 0 0 31 -4,-0.1 -1,-0.1 -2,-0.0 4,-0.1 -0.976 48.0-152.3-116.5 109.2 -10.0 25.0 21.2 148 155 A P - 0 0 49 0, 0.0 3,-0.1 0, 0.0 9,-0.1 -0.295 21.6-122.2 -78.8 167.4 -11.1 21.4 20.5 149 156 A V S S+ 0 0 110 1,-0.2 8,-2.4 7,-0.1 2,-0.3 0.896 100.2 24.1 -72.6 -40.7 -9.6 18.3 22.0 150 157 A R B S-H 156 0C 135 6,-0.2 6,-0.2 1,-0.1 -1,-0.2 -0.927 85.3-121.0-124.4 149.5 -8.9 16.9 18.5 151 158 A T > - 0 0 12 4,-2.8 3,-2.3 -2,-0.3 -136,-0.2 -0.148 43.9 -86.5 -78.3 179.7 -8.4 18.7 15.2 152 159 A Y T 3 S+ 0 0 94 -138,-1.1 -138,-0.1 -139,-0.5 -137,-0.1 0.751 133.3 50.7 -61.5 -21.5 -10.5 18.3 12.1 153 160 A T T 3 S- 0 0 43 -140,-0.3 -1,-0.3 -139,-0.1 3,-0.1 0.266 121.6-107.7 -96.6 9.7 -8.1 15.4 11.2 154 161 A H S < S+ 0 0 142 -3,-2.3 -2,-0.1 1,-0.3 3,-0.1 0.416 70.3 150.0 76.0 0.5 -8.5 13.8 14.6 155 162 A E - 0 0 107 1,-0.1 -4,-2.8 -5,-0.1 2,-0.3 -0.361 55.7-105.6 -61.8 141.0 -5.0 14.8 15.6 156 163 A V B -H 150 0C 86 -6,-0.2 2,-0.5 -3,-0.1 -6,-0.2 -0.524 28.0-127.6 -70.4 127.6 -4.5 15.5 19.3 157 164 A V - 0 0 5 -8,-2.4 -1,-0.1 -2,-0.3 -10,-0.0 -0.691 39.8-108.3 -75.0 122.5 -4.3 19.2 20.0 158 165 A T - 0 0 32 -2,-0.5 3,-0.2 1,-0.1 -1,-0.1 -0.232 27.7-166.5 -60.3 144.7 -1.1 19.5 22.0 159 166 A L > + 0 0 23 39,-0.5 3,-1.8 1,-0.1 -1,-0.1 0.398 62.5 102.7 -99.3 -5.9 -1.2 20.2 25.7 160 167 A W T 3 S+ 0 0 90 1,-0.3 36,-0.3 38,-0.2 -1,-0.1 0.720 86.8 36.3 -59.8 -26.3 2.4 21.0 26.0 161 168 A Y T 3 S+ 0 0 12 -3,-0.2 2,-0.3 -40,-0.1 -1,-0.3 0.265 86.5 127.9-108.3 9.8 2.1 24.8 26.2 162 169 A R < - 0 0 36 -3,-1.8 -42,-0.1 1,-0.1 16,-0.1 -0.531 60.1-119.9 -80.2 131.9 -1.1 24.9 28.2 163 170 A A >> - 0 0 0 -2,-0.3 4,-1.9 14,-0.1 3,-0.8 -0.239 20.1-120.1 -68.1 149.5 -1.2 27.1 31.3 164 171 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 6,-0.2 0.840 109.9 61.0 -63.9 -32.7 -1.9 25.4 34.7 165 172 A E H 34>S+ 0 0 0 2,-0.2 5,-2.5 1,-0.2 4,-0.2 0.848 104.9 49.1 -64.9 -28.5 -5.0 27.5 35.4 166 173 A I H X45S+ 0 0 22 -3,-0.8 3,-1.7 1,-0.2 -1,-0.2 0.956 112.0 47.9 -71.0 -47.5 -6.6 26.1 32.2 167 174 A L H 3<5S+ 0 0 6 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.797 109.0 54.7 -60.3 -29.8 -5.7 22.6 33.3 168 175 A L T 3<5S- 0 0 0 -4,-2.1 60,-2.7 -5,-0.2 61,-0.4 0.400 122.0-104.8 -89.5 3.8 -7.1 23.2 36.8 169 176 A G T < 5 + 0 0 17 -3,-1.7 -3,-0.2 1,-0.3 2,-0.2 0.609 56.2 165.6 89.5 15.2 -10.5 24.3 35.4 170 177 A X < - 0 0 67 -5,-2.5 3,-0.4 -6,-0.2 -1,-0.3 -0.467 22.6-158.7 -61.0 130.1 -10.4 28.1 35.8 171 178 A K S S+ 0 0 146 1,-0.2 -1,-0.2 -2,-0.2 -2,-0.0 0.820 81.8 44.0 -82.4 -33.3 -13.3 29.4 33.6 172 179 A Y S S+ 0 0 208 2,-0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.266 74.7 166.8-114.6 44.2 -12.1 33.0 33.1 173 180 A Y - 0 0 68 -3,-0.4 2,-0.1 1,-0.1 0, 0.0 -0.265 19.5-150.4 -59.0 159.7 -8.4 32.6 32.4 174 181 A S > - 0 0 34 -55,-0.0 3,-2.3 -57,-0.0 4,-0.3 -0.332 37.2 -62.9-121.5-172.4 -6.7 35.7 31.0 175 182 A T T >> S+ 0 0 32 1,-0.3 3,-1.5 2,-0.2 4,-0.9 0.715 115.4 79.3 -60.5 -23.9 -3.8 37.1 28.9 176 183 A A H 3> S+ 0 0 8 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.743 77.1 71.0 -57.1 -27.5 -1.4 35.4 31.3 177 184 A V H <> S+ 0 0 1 -3,-2.3 4,-2.0 1,-0.2 -1,-0.3 0.870 97.2 50.8 -61.1 -27.7 -2.1 32.0 29.6 178 185 A D H <> S+ 0 0 0 -3,-1.5 4,-2.4 -4,-0.3 -1,-0.2 0.840 105.9 54.3 -78.8 -33.7 -0.1 33.3 26.5 179 186 A I H X S+ 0 0 1 -4,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.917 108.1 50.4 -63.2 -41.8 2.8 34.3 28.7 180 187 A W H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.960 111.5 47.7 -59.4 -50.0 3.0 30.8 30.1 181 188 A S H X S+ 0 0 5 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.913 112.0 49.5 -58.5 -44.6 2.9 29.3 26.6 182 189 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.870 107.7 54.3 -66.8 -34.4 5.6 31.6 25.4 183 190 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 76,-0.3 -1,-0.2 0.919 107.4 50.8 -62.2 -42.9 7.8 30.8 28.4 184 191 A C H X S+ 0 0 2 -4,-2.3 4,-1.7 1,-0.2 11,-0.4 0.889 111.4 48.2 -59.0 -41.0 7.5 27.1 27.5 185 192 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.895 108.7 53.7 -68.8 -39.6 8.6 27.9 24.0 186 193 A F H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.949 109.3 48.1 -57.4 -49.7 11.5 30.0 25.2 187 194 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 6,-0.3 0.877 110.6 52.8 -57.9 -40.5 12.7 27.1 27.3 188 195 A E H X S+ 0 0 25 -4,-1.7 4,-2.2 1,-0.2 5,-0.4 0.892 107.0 50.9 -67.4 -38.3 12.3 24.8 24.3 189 196 A M H < S+ 0 0 5 -4,-2.4 -97,-0.5 1,-0.2 -1,-0.2 0.904 114.3 45.5 -63.6 -40.8 14.4 27.0 22.1 190 197 A V H < S+ 0 0 17 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.917 124.0 29.7 -67.9 -48.5 17.2 27.1 24.7 191 198 A T H < S- 0 0 44 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.646 95.5-129.4 -91.5 -16.7 17.3 23.4 25.6 192 199 A R S < S+ 0 0 138 -4,-2.2 2,-0.3 -5,-0.3 -3,-0.1 0.710 80.6 90.1 72.0 24.2 16.2 21.9 22.2 193 200 A R S S- 0 0 191 -5,-0.4 -2,-0.2 -6,-0.3 -1,-0.2 -0.991 88.4 -99.6-147.2 136.9 13.7 19.8 24.0 194 201 A A - 0 0 16 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.310 29.4-141.5 -55.5 144.0 10.0 20.5 24.9 195 202 A L S S+ 0 0 28 -11,-0.4 -1,-0.1 1,-0.2 -34,-0.1 0.943 88.7 14.2 -75.0 -47.9 9.7 21.6 28.5 196 203 A F + 0 0 2 -36,-0.3 2,-2.1 2,-0.1 -1,-0.2 -0.710 68.3 178.6-131.3 75.3 6.5 19.8 29.5 197 204 A P + 0 0 37 0, 0.0 -37,-0.1 0, 0.0 7,-0.1 -0.357 17.9 177.9 -82.2 64.2 5.6 17.2 26.8 198 205 A G - 0 0 3 -2,-2.1 -39,-0.5 1,-0.1 -38,-0.2 -0.332 25.3-163.3 -68.2 149.4 2.4 15.9 28.5 199 206 A D S S+ 0 0 133 1,-0.1 2,-0.3 -40,-0.1 -1,-0.1 0.219 76.5 17.5-120.6 18.0 0.4 13.3 26.8 200 207 A S S > S- 0 0 50 1,-0.1 4,-2.5 -41,-0.0 5,-0.2 -0.914 90.3 -96.3-169.4 165.8 -2.8 13.7 28.8 201 208 A E H > S+ 0 0 104 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.914 124.4 45.2 -61.8 -40.7 -4.1 16.4 31.1 202 209 A I H > S+ 0 0 81 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.880 112.4 50.5 -70.8 -35.3 -2.9 14.8 34.2 203 210 A D H > S+ 0 0 45 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.900 111.7 50.0 -68.6 -35.3 0.5 14.0 32.7 204 211 A Q H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.960 113.4 44.9 -62.9 -52.8 0.7 17.7 31.6 205 212 A L H X S+ 0 0 7 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.899 114.6 48.3 -57.7 -45.5 -0.2 18.9 35.1 206 213 A F H X S+ 0 0 54 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.815 108.4 54.2 -69.2 -31.3 2.2 16.4 36.8 207 214 A R H X S+ 0 0 102 -4,-2.2 4,-1.2 -5,-0.2 5,-0.2 0.931 109.5 47.9 -64.5 -42.7 5.1 17.4 34.5 208 215 A I H >X S+ 0 0 0 -4,-2.2 4,-3.1 1,-0.2 3,-0.6 0.944 113.4 48.1 -60.5 -46.6 4.6 21.0 35.4 209 216 A F H 3X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.880 105.5 57.9 -64.8 -37.6 4.5 20.1 39.1 210 217 A R H 3< S+ 0 0 147 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.780 118.7 31.9 -62.3 -31.1 7.7 17.9 38.8 211 218 A T H << S+ 0 0 13 -4,-1.2 28,-3.2 -3,-0.6 -2,-0.2 0.876 131.9 29.0 -91.2 -45.2 9.6 20.9 37.6 212 219 A L H < S- 0 0 5 -4,-3.1 26,-0.3 26,-0.2 -3,-0.2 0.489 113.4-104.6-100.1 -5.2 8.0 23.9 39.3 213 220 A G < - 0 0 7 -4,-2.2 24,-0.2 24,-0.4 -1,-0.2 0.237 45.7 -67.7 91.3 148.6 6.8 22.1 42.5 214 221 A T - 0 0 17 22,-2.2 24,-0.1 -5,-0.1 -8,-0.0 -0.493 63.5-116.2 -67.1 128.2 3.3 21.1 43.3 215 222 A P + 0 0 1 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.337 41.5 173.0 -69.3 150.2 1.4 24.4 43.7 216 223 A D > - 0 0 72 -3,-0.0 4,-2.6 7,-0.0 7,-0.2 -0.808 49.8 -81.6-142.9-177.9 -0.0 25.2 47.1 217 224 A E T 4 S+ 0 0 79 -2,-0.2 6,-0.1 1,-0.2 5,-0.0 0.736 121.8 59.3 -67.1 -21.2 -1.7 28.1 48.9 218 225 A V T 4 S+ 0 0 125 2,-0.2 -1,-0.2 1,-0.1 0, 0.0 0.954 117.3 28.4 -71.2 -48.7 1.6 29.8 49.6 219 226 A V T 4 S+ 0 0 80 1,-0.2 44,-0.5 -3,-0.1 -2,-0.2 0.794 137.0 25.6 -84.5 -22.3 2.7 30.2 46.0 220 227 A W S >< S- 0 0 12 -4,-2.6 3,-2.6 42,-0.1 4,-0.3 -0.691 79.3-149.4-144.5 80.9 -0.8 30.4 44.5 221 228 A P T 3 S+ 0 0 81 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.271 86.3 19.3 -55.9 130.2 -3.4 31.6 46.8 222 229 A G T >> S+ 0 0 32 41,-0.0 3,-2.0 4,-0.0 4,-0.7 0.263 86.4 119.4 93.5 -9.0 -6.8 30.1 45.9 223 230 A V G X4 + 0 0 0 -3,-2.6 3,-1.0 1,-0.3 6,-0.2 0.872 68.7 60.2 -58.7 -37.5 -5.3 27.2 43.9 224 231 A T G 34 S+ 0 0 65 -4,-0.3 -1,-0.3 1,-0.2 -7,-0.0 0.593 101.4 56.4 -70.9 -4.1 -6.8 24.5 46.2 225 232 A S G <4 S+ 0 0 100 -3,-2.0 -1,-0.2 3,-0.0 -2,-0.2 0.663 79.1 113.6 -96.2 -22.1 -10.3 25.8 45.4 226 233 A M S X< S- 0 0 17 -3,-1.0 3,-1.2 -4,-0.7 -57,-0.1 -0.084 78.6-108.2 -54.3 152.9 -10.1 25.5 41.6 227 234 A P T 3 S+ 0 0 67 0, 0.0 -58,-0.2 0, 0.0 -1,-0.1 0.803 112.2 33.9 -53.2 -43.3 -12.4 22.9 40.0 228 235 A D T 3 S+ 0 0 76 -60,-2.7 2,-0.3 2,-0.1 -59,-0.2 0.308 86.6 117.8-103.0 7.5 -9.9 20.3 39.0 229 236 A Y < - 0 0 31 -3,-1.2 3,-0.0 -61,-0.4 -5,-0.0 -0.594 46.2-163.8 -72.5 137.1 -7.5 20.6 41.9 230 237 A K > - 0 0 103 -2,-0.3 3,-2.4 1,-0.1 -2,-0.1 -0.989 23.2-143.0-124.4 130.0 -7.3 17.4 44.0 231 238 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.760 101.5 67.1 -59.8 -20.2 -5.8 17.3 47.5 232 239 A S T 3 + 0 0 102 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.416 69.0 123.7 -83.7 3.1 -4.5 13.9 46.5 233 240 A F S < S- 0 0 8 -3,-2.4 -19,-0.0 1,-0.1 -4,-0.0 -0.404 73.7-105.6 -57.9 137.8 -2.0 15.4 43.9 234 241 A P - 0 0 53 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.320 29.4-121.5 -63.0 150.4 1.5 14.2 44.8 235 242 A K + 0 0 122 -3,-0.1 2,-0.3 -22,-0.1 -25,-0.0 -0.860 35.0 179.5-101.7 102.8 3.7 16.9 46.3 236 243 A W - 0 0 95 -2,-0.8 -22,-2.2 -21,-0.0 2,-0.3 -0.743 25.7-119.8 -98.1 149.3 6.9 17.4 44.3 237 244 A A - 0 0 85 -2,-0.3 -24,-0.4 -24,-0.2 2,-0.1 -0.641 32.3-101.9 -88.1 149.7 9.6 19.9 45.1 238 245 A R - 0 0 115 -26,-0.3 2,-0.3 -2,-0.3 -26,-0.2 -0.410 32.4-134.3 -71.0 139.2 10.6 22.7 42.8 239 246 A Q - 0 0 33 -28,-3.2 2,-0.2 -2,-0.1 -1,-0.1 -0.659 23.5-106.3 -91.0 149.7 13.7 22.4 40.7 240 247 A D >> - 0 0 126 -2,-0.3 3,-1.9 1,-0.1 4,-1.3 -0.503 24.2-128.9 -69.1 139.3 16.3 25.1 40.3 241 248 A F H 3> S+ 0 0 20 1,-0.3 4,-2.8 2,-0.2 7,-0.2 0.759 106.8 71.3 -62.4 -21.9 16.2 26.7 36.8 242 249 A S H 34 S+ 0 0 61 1,-0.2 -1,-0.3 2,-0.2 6,-0.1 0.819 104.9 41.2 -62.5 -27.7 19.9 26.1 36.5 243 250 A K H <4 S+ 0 0 139 -3,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.775 116.4 50.1 -82.3 -36.5 18.9 22.4 36.2 244 251 A V H < S+ 0 0 22 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.2 0.898 124.6 17.1 -73.5 -48.1 15.9 23.1 33.9 245 252 A V S >< S- 0 0 0 -4,-2.8 3,-2.5 3,-0.1 -1,-0.2 -0.151 85.8-163.4-126.8 48.9 17.3 25.3 31.2 246 253 A P T 3 + 0 0 68 0, 0.0 3,-0.1 0, 0.0 -4,-0.0 -0.393 69.6 24.9 -63.8 145.0 21.2 25.2 31.2 247 254 A P T 3 S+ 0 0 119 0, 0.0 -5,-0.1 0, 0.0 -4,-0.0 -0.769 86.6 121.4-105.2 37.0 23.1 27.1 29.9 248 255 A L < - 0 0 7 -3,-2.5 -3,-0.1 -7,-0.2 -61,-0.0 -0.298 63.2-117.4 -57.5 139.8 20.7 30.0 30.0 249 256 A D > - 0 0 55 1,-0.1 4,-2.7 -3,-0.1 5,-0.2 -0.160 28.9 -96.5 -74.8 170.7 22.1 33.0 31.9 250 257 A E H > S+ 0 0 119 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.782 122.9 56.1 -63.1 -32.7 20.7 34.4 35.0 251 258 A D H > S+ 0 0 75 2,-0.2 4,-2.4 1,-0.2 27,-0.3 0.948 111.6 43.6 -63.1 -44.8 18.8 37.2 33.2 252 259 A G H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.914 114.5 49.5 -66.6 -40.5 17.1 34.6 31.0 253 260 A R H X S+ 0 0 66 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.897 110.2 51.2 -65.6 -37.4 16.4 32.3 34.0 254 261 A S H X S+ 0 0 36 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.949 113.1 44.2 -63.5 -50.1 14.9 35.2 35.9 255 262 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 3,-0.3 0.945 113.7 50.7 -61.3 -44.9 12.6 36.2 33.1 256 263 A L H X S+ 0 0 1 -4,-2.9 4,-1.5 1,-0.2 3,-0.2 0.920 107.3 53.8 -58.8 -46.4 11.6 32.6 32.4 257 264 A S H < S+ 0 0 28 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.839 109.6 48.6 -58.0 -33.8 10.8 32.1 36.1 258 265 A Q H >< S+ 0 0 56 -4,-1.6 10,-1.9 -3,-0.3 3,-0.8 0.812 109.2 51.5 -75.5 -32.2 8.5 35.1 35.9 259 266 A M H 3< S+ 0 0 0 -4,-1.8 -76,-0.3 -3,-0.2 -2,-0.2 0.687 112.3 48.7 -73.5 -21.6 6.8 33.9 32.8 260 267 A L T 3< S+ 0 0 1 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.123 77.0 139.6-108.1 20.7 6.1 30.5 34.5 261 268 A H < - 0 0 72 -3,-0.8 6,-0.2 1,-0.1 -3,-0.1 -0.369 51.4-138.6 -62.0 140.7 4.7 31.9 37.8 262 269 A Y S S+ 0 0 10 -50,-0.1 -97,-0.2 4,-0.1 -1,-0.1 0.942 85.9 74.1 -66.1 -50.5 1.8 29.7 38.9 263 270 A D S >> S- 0 0 25 -44,-0.5 4,-1.4 1,-0.2 3,-1.3 -0.540 72.8-153.7 -70.0 112.1 -0.5 32.6 40.0 264 271 A P T 34 S+ 0 0 18 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.792 92.2 59.2 -59.6 -30.2 -1.7 34.1 36.8 265 272 A N T 34 S+ 0 0 132 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.811 113.5 38.5 -68.0 -27.0 -2.3 37.5 38.5 266 273 A K T <4 S+ 0 0 135 -3,-1.3 -1,-0.2 2,-0.1 3,-0.1 0.541 87.5 110.5 -97.5 -14.6 1.4 37.6 39.4 267 274 A R S < S- 0 0 12 -4,-1.4 -8,-0.2 -6,-0.2 -9,-0.1 -0.397 84.3 -93.3 -57.4 142.9 2.9 36.1 36.2 268 275 A I - 0 0 18 -10,-1.9 2,-0.2 -13,-0.2 -1,-0.1 -0.204 37.6-126.3 -64.2 143.2 4.7 38.8 34.3 269 276 A S > - 0 0 62 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.503 22.4-112.4 -79.8 164.6 2.8 40.7 31.6 270 277 A A H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -161,-0.1 0.918 118.3 52.2 -61.6 -42.7 4.2 41.0 28.1 271 278 A K H > S+ 0 0 167 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.922 112.1 44.3 -61.3 -44.9 4.8 44.7 28.6 272 279 A A H >4 S+ 0 0 48 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.891 109.2 56.9 -68.7 -35.1 6.7 44.2 31.8 273 280 A A H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 6,-0.2 0.881 99.1 60.6 -62.3 -35.9 8.7 41.3 30.2 274 281 A L H 3< S+ 0 0 41 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.799 104.7 50.2 -60.2 -28.1 9.9 43.7 27.4 275 282 A A T << S+ 0 0 85 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.430 83.9 120.6 -86.9 -6.2 11.5 45.9 30.1 276 283 A H S X S- 0 0 19 -3,-1.7 3,-2.2 -4,-0.3 4,-0.2 -0.365 76.8-115.6 -61.9 147.0 13.3 42.9 31.7 277 284 A P G > S+ 0 0 78 0, 0.0 3,-2.1 0, 0.0 4,-0.3 0.737 108.4 77.9 -55.4 -23.4 17.2 43.2 31.8 278 285 A F G 3 S+ 0 0 0 -27,-0.3 3,-0.5 1,-0.3 -26,-0.1 0.828 93.8 51.1 -54.6 -30.3 17.4 40.1 29.6 279 286 A F G X S+ 0 0 11 -3,-2.2 3,-1.9 -6,-0.2 -1,-0.3 0.431 76.7 103.2 -91.9 6.6 16.5 42.4 26.6 280 287 A Q T < S+ 0 0 162 -3,-2.1 -1,-0.2 1,-0.3 -2,-0.1 0.853 92.9 31.9 -54.0 -41.1 19.2 45.1 27.4 281 288 A D T 3 S+ 0 0 94 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.004 86.4 149.6-107.7 27.1 21.4 43.8 24.6 282 289 A V < + 0 0 38 -3,-1.9 2,-0.2 -184,-0.1 -186,-0.1 -0.334 15.8 170.2 -64.2 145.0 18.7 42.6 22.2 283 290 A T - 0 0 82 -188,-0.4 -2,-0.0 2,-0.0 -1,-0.0 -0.790 36.7-112.9-138.4 179.7 19.5 42.8 18.5 284 291 A K - 0 0 127 -2,-0.2 -188,-0.1 -185,-0.1 -151,-0.1 -0.697 35.0-174.0-124.6 79.4 17.9 41.4 15.3 285 292 A P - 0 0 38 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.309 26.2-119.1 -67.1 159.6 20.0 38.7 13.7 286 293 A V - 0 0 107 -154,-0.0 2,-0.1 3,-0.0 -155,-0.1 -0.870 28.3-136.7-101.4 126.3 19.1 37.3 10.3 287 294 A P - 0 0 14 0, 0.0 2,-0.9 0, 0.0 -155,-0.1 -0.461 19.0-110.7 -80.3 158.4 18.4 33.5 10.4 288 295 A H - 0 0 144 -2,-0.1 2,-0.5 2,-0.0 -158,-0.0 -0.819 42.2-176.5 -92.7 109.7 19.7 31.1 7.8 289 296 A L - 0 0 14 -2,-0.9 2,-0.6 -159,-0.1 -159,-0.0 -0.943 18.2-166.4-112.8 129.6 16.7 30.0 6.0 290 297 A R 0 0 181 -2,-0.5 -2,-0.0 0, 0.0 0, 0.0 -0.971 360.0 360.0-111.6 109.5 16.8 27.4 3.3 291 298 A L 0 0 133 -2,-0.6 -213,-0.1 -213,-0.0 -2,-0.0 -0.740 360.0 360.0-104.3 360.0 13.4 27.6 1.5