==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-APR-06 2GPH . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR T.ZHOU,L.SUN,J.HUMPHREYS,E.J.GOLDSMITH . 361 2 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17241.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 220 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 10.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 24 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 3 2 0 1 0 1 1 1 1 0 0 0 2 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 2 2 1 0 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 . 1 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 10 A E 0 0 148 0, 0.0 8,-0.1 0, 0.0 14,-0.0 0.000 360.0 360.0 360.0 65.2 23.0 -5.2 3.4 2 11 A M + 0 0 158 6,-0.2 2,-0.5 5,-0.1 5,-0.1 -0.319 360.0 153.7-169.3 77.8 23.6 -7.3 6.5 3 12 A V B > -A 6 0A 6 3,-0.9 3,-1.0 1,-0.1 15,-0.1 -0.951 66.5 -68.5-119.9 125.6 22.0 -6.5 9.9 4 13 A R T 3 S- 0 0 165 -2,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.477 114.9 -11.2 -1.4 82.0 21.4 -9.1 12.5 5 14 A G T 3 S+ 0 0 85 1,-0.1 -1,-0.2 0, 0.0 2,-0.2 -0.487 111.1 43.0 121.7 -71.2 18.7 -11.2 10.8 6 15 A Q B < S-A 3 0A 82 -3,-1.0 -3,-0.9 -2,-0.4 2,-0.3 -0.616 81.2 -67.2-124.5-179.5 17.1 -9.8 7.7 7 16 A V + 0 0 77 -2,-0.2 2,-0.1 -5,-0.1 -1,-0.1 -0.414 37.2 172.8 -60.9 115.9 17.1 -8.1 4.3 8 17 A F + 0 0 0 -2,-0.3 2,-1.6 36,-0.0 -6,-0.2 -0.568 11.9 168.9-125.0 61.8 18.2 -4.4 4.8 9 18 A D + 0 0 75 1,-0.1 2,-0.1 -2,-0.1 82,-0.1 -0.593 10.3 165.2 -82.2 83.4 18.4 -3.7 1.1 10 19 A V > - 0 0 4 -2,-1.6 4,-1.5 1,-0.3 -1,-0.1 -0.171 51.0-121.5 -91.5 40.1 18.7 0.0 1.0 11 20 A G T 4 - 0 0 47 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.080 43.5 -54.5 52.3-160.9 19.8 -0.4 -2.6 12 21 A P T 4 S+ 0 0 116 0, 0.0 -1,-0.2 0, 0.0 22,-0.2 0.741 126.9 69.8 -80.9 -29.6 23.2 0.8 -4.0 13 22 A R T 4 S+ 0 0 65 1,-0.1 21,-3.5 20,-0.1 2,-0.5 0.889 101.2 47.2 -58.7 -40.8 22.8 4.4 -2.8 14 23 A Y E < S+B 33 0B 4 -4,-1.5 2,-0.2 19,-0.2 -4,-0.2 -0.908 71.7 143.2-110.2 126.8 23.2 3.4 0.9 15 24 A T E +B 32 0B 44 17,-1.6 17,-3.3 -2,-0.5 3,-0.2 -0.781 38.8 70.9-144.0-175.7 26.0 1.1 1.9 16 25 A N E S- 0 0 110 -2,-0.2 2,-0.7 15,-0.2 -1,-0.1 0.909 71.2-161.1 64.3 41.3 28.4 0.6 4.9 17 26 A L E + 0 0 25 -3,-0.1 14,-0.2 14,-0.1 -1,-0.2 -0.429 15.5 176.7 -64.4 102.9 25.4 -0.6 7.0 18 27 A S E -B 30 0B 59 12,-1.3 12,-1.8 -2,-0.7 2,-0.5 -0.535 31.9-110.0 -97.2 168.9 26.2 -0.5 10.7 19 28 A Y E -B 29 0B 72 10,-0.2 10,-0.2 -2,-0.2 2,-0.1 -0.884 37.8-173.9-105.7 132.2 23.6 -1.3 13.4 20 29 A I - 0 0 47 8,-2.2 2,-0.4 -2,-0.5 8,-0.3 -0.348 31.7 -64.2-111.0-167.5 22.2 1.5 15.6 21 30 A G - 0 0 39 -2,-0.1 -1,-0.1 1,-0.1 8,-0.0 -0.682 58.5 -95.5 -89.3 133.0 19.9 1.9 18.6 22 31 A E + 0 0 114 -2,-0.4 5,-0.1 1,-0.1 -1,-0.1 0.027 36.0 179.8 -45.3 137.2 16.2 1.0 18.6 23 32 A G - 0 0 59 3,-0.8 -1,-0.1 120,-0.0 4,-0.1 0.768 49.2 -91.6-101.4 -86.2 13.6 3.6 17.8 24 33 A A S S+ 0 0 46 2,-0.1 3,-0.1 3,-0.0 -2,-0.1 0.249 111.3 66.7-169.6 -23.8 10.0 2.2 17.9 25 34 A Y S S- 0 0 14 1,-0.2 2,-0.4 31,-0.0 21,-0.4 0.521 109.5 -93.5 -90.0 -8.3 9.2 1.1 14.3 26 35 A G S S+ 0 0 27 19,-0.1 -3,-0.8 2,-0.0 2,-0.3 -0.992 81.6 17.6 139.1-143.6 11.7 -1.7 14.2 27 36 A M - 0 0 30 -2,-0.4 17,-3.1 17,-0.3 2,-0.4 -0.519 57.7-165.0 -75.4 132.1 15.3 -2.2 13.2 28 37 A V E + C 0 43B 17 -8,-0.3 -8,-2.2 -2,-0.3 2,-0.3 -0.973 8.8 178.6-120.8 130.6 17.4 0.9 12.7 29 38 A C E -BC 19 42B 0 13,-3.5 13,-3.5 -2,-0.4 2,-0.3 -0.802 23.3-131.6-123.9 165.2 20.8 1.0 10.9 30 39 A S E +BC 18 41B 8 -12,-1.8 -12,-1.3 -2,-0.3 2,-0.3 -0.771 36.1 168.9-109.4 161.8 23.4 3.7 10.1 31 40 A A E - C 0 40B 0 9,-1.8 9,-2.9 -2,-0.3 2,-0.5 -0.985 36.7 -98.3-164.9 172.0 24.7 4.0 6.5 32 41 A Y E -BC 15 39B 70 -17,-3.3 -17,-1.6 -2,-0.3 2,-1.0 -0.904 26.1-144.8-105.9 126.9 26.6 5.9 3.9 33 42 A D E >> -BC 14 38B 0 5,-2.9 4,-1.7 -2,-0.5 5,-0.9 -0.801 11.3-169.1 -91.4 99.3 24.6 7.9 1.4 34 43 A N T 45S+ 0 0 58 -21,-3.5 -1,-0.2 -2,-1.0 -20,-0.1 0.547 84.4 51.5 -67.4 -7.0 26.6 7.5 -1.8 35 44 A L T 45S+ 0 0 104 -22,-0.3 -1,-0.2 3,-0.1 -21,-0.1 0.883 121.7 26.0 -94.2 -54.2 24.6 10.3 -3.4 36 45 A N T 45S- 0 0 96 2,-0.2 -2,-0.2 0, 0.0 3,-0.1 0.509 103.2-130.7 -87.5 -2.1 24.8 13.1 -0.8 37 46 A K T <5 + 0 0 127 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.930 67.5 104.9 53.7 55.2 28.2 11.6 0.3 38 47 A V E + 0 0 0 0, 0.0 3,-1.5 0, 0.0 7,-0.5 0.337 30.2 110.8-112.8 8.5 3.5 -2.8 9.4 48 57 A F T 3 S+ 0 0 26 40,-0.5 285,-0.2 1,-0.3 284,-0.1 0.582 76.4 53.3 -64.4 -12.5 1.1 -4.0 6.7 49 58 A E T 3 S+ 0 0 167 -3,-0.2 2,-0.5 1,-0.1 -1,-0.3 0.598 103.6 67.3 -93.6 -14.6 -0.5 -6.8 8.7 50 59 A H <> - 0 0 109 -3,-1.5 4,-2.2 1,-0.1 3,-0.2 -0.929 67.8-152.6-117.3 119.0 -1.3 -4.5 11.6 51 60 A Q H > S+ 0 0 51 -2,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.869 98.7 43.8 -49.4 -44.1 -3.9 -1.8 11.4 52 61 A T H > S+ 0 0 62 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.802 109.1 53.3 -78.5 -30.9 -2.1 0.3 14.1 53 62 A Y H > S+ 0 0 111 -6,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.882 112.9 48.4 -67.9 -36.0 1.5 -0.2 12.9 54 63 A C H X S+ 0 0 0 -4,-2.2 4,-2.8 -7,-0.5 -2,-0.2 0.908 109.0 51.8 -67.4 -44.8 0.2 1.1 9.6 55 64 A Q H X S+ 0 0 7 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.931 113.3 44.1 -57.4 -49.5 -1.6 4.1 11.1 56 65 A R H X S+ 0 0 45 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.891 112.6 51.4 -65.9 -39.7 1.5 5.2 13.0 57 66 A T H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.930 112.8 46.4 -63.4 -44.5 3.7 4.6 9.9 58 67 A L H X S+ 0 0 1 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.887 113.1 48.8 -65.2 -40.5 1.4 6.7 7.8 59 68 A R H X S+ 0 0 4 -4,-2.4 4,-2.6 -5,-0.2 5,-0.3 0.965 110.4 50.3 -63.8 -51.2 1.1 9.5 10.4 60 69 A E H X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.903 116.3 42.6 -52.7 -46.4 4.8 9.8 10.9 61 70 A I H X S+ 0 0 1 -4,-2.0 4,-1.9 -5,-0.2 5,-0.2 0.914 112.3 50.4 -70.8 -44.9 5.3 10.0 7.2 62 71 A K H X S+ 0 0 47 -4,-2.9 4,-0.7 1,-0.2 -2,-0.2 0.902 119.1 39.3 -60.8 -39.1 2.5 12.4 6.3 63 72 A I H >X S+ 0 0 5 -4,-2.6 4,-0.7 -5,-0.2 3,-0.6 0.943 115.2 47.3 -78.6 -48.3 3.6 14.8 9.0 64 73 A L H >< S+ 0 0 2 -4,-2.4 3,-0.6 -5,-0.3 11,-0.4 0.837 108.0 57.2 -64.9 -32.6 7.4 14.7 8.8 65 74 A L H 3< S+ 0 0 25 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.821 112.0 43.4 -64.4 -31.0 7.3 15.1 5.0 66 75 A R H << S+ 0 0 123 -4,-0.7 2,-0.3 -3,-0.6 -1,-0.2 0.478 99.9 82.3 -96.0 -2.0 5.4 18.3 5.5 67 76 A F << + 0 0 14 -4,-0.7 2,-0.3 -3,-0.6 62,-0.0 -0.790 49.3 179.8-101.6 146.1 7.4 19.8 8.4 68 77 A R + 0 0 221 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.825 25.6 134.7-145.8 102.0 10.7 21.6 7.8 69 78 A H > - 0 0 18 3,-0.5 3,-2.1 -2,-0.3 -2,-0.0 -0.982 58.0-125.4-155.1 141.0 12.4 22.9 10.9 70 79 A E T 3 S+ 0 0 65 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.789 113.5 44.7 -53.8 -34.6 15.9 22.9 12.4 71 80 A N T 3 S+ 0 0 3 82,-0.1 83,-2.2 53,-0.1 2,-0.4 0.041 102.4 78.0-102.8 26.1 14.7 21.3 15.6 72 81 A I B < S-f 154 0C 7 -3,-2.1 -3,-0.5 81,-0.3 83,-0.2 -0.996 84.0-117.8-134.7 128.0 12.5 18.6 13.9 73 82 A I - 0 0 2 81,-2.4 2,-0.2 -2,-0.4 -6,-0.1 -0.336 35.2-152.9 -61.9 140.9 14.0 15.5 12.3 74 83 A G - 0 0 22 -4,-0.1 2,-0.6 -6,-0.1 21,-0.4 -0.627 16.4-112.6-112.1 172.5 13.2 15.4 8.6 75 84 A I - 0 0 23 -11,-0.4 19,-0.2 -2,-0.2 3,-0.1 -0.950 26.4-179.3-109.3 116.8 12.8 12.6 6.0 76 85 A N - 0 0 55 17,-2.7 2,-0.3 -2,-0.6 18,-0.2 0.780 66.9 -17.7 -82.0 -32.0 15.6 12.6 3.5 77 86 A D E -E 93 0B 17 16,-1.3 16,-2.8 2,-0.0 2,-0.4 -0.981 52.4-140.8-169.7 160.6 14.3 9.6 1.5 78 87 A I E -E 92 0B 1 -2,-0.3 2,-0.5 14,-0.2 14,-0.2 -0.962 12.9-158.5-138.1 120.1 12.0 6.7 1.6 79 88 A I E +E 91 0B 35 12,-2.7 12,-2.8 -2,-0.4 2,-0.3 -0.871 28.7 142.2-102.7 123.6 12.8 3.3 0.1 80 89 A R - 0 0 19 -2,-0.5 10,-0.1 10,-0.2 7,-0.1 -0.971 50.7 -76.0-152.2 161.6 10.0 0.9 -0.8 81 90 A A - 0 0 25 8,-0.5 6,-0.2 -2,-0.3 263,-0.0 -0.138 41.6-110.9 -61.9 154.6 9.1 -1.6 -3.6 82 91 A P S S+ 0 0 84 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.817 96.2 36.4 -52.8 -43.8 7.9 -0.7 -7.1 83 92 A T S >> S- 0 0 55 1,-0.1 4,-1.6 0, 0.0 3,-1.4 -0.921 82.8-116.2-122.4 148.2 4.3 -1.9 -6.8 84 93 A I T 34 S+ 0 0 40 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.1 0.732 116.9 55.8 -47.3 -24.5 1.8 -1.9 -4.0 85 94 A E T 34 S+ 0 0 161 1,-0.2 -1,-0.3 3,-0.0 -4,-0.0 0.843 107.9 43.7 -78.2 -38.4 1.9 -5.7 -4.2 86 95 A Q T <4 S+ 0 0 114 -3,-1.4 2,-0.7 2,-0.0 3,-0.3 0.631 90.6 104.4 -81.9 -16.5 5.7 -6.1 -3.8 87 96 A M < + 0 0 2 -4,-1.6 3,-0.1 1,-0.2 250,-0.0 -0.582 26.3 134.0 -74.0 111.4 5.8 -3.6 -0.9 88 97 A K + 0 0 140 -2,-0.7 -40,-0.5 1,-0.2 2,-0.2 0.578 67.0 37.9-123.6 -33.9 6.1 -5.3 2.4 89 98 A D - 0 0 24 -3,-0.3 -8,-0.5 -43,-0.1 2,-0.3 -0.694 62.8-155.4-115.4 170.1 8.8 -3.2 4.1 90 99 A V E -D 45 0B 0 -45,-2.2 -45,-2.1 -2,-0.2 2,-0.6 -0.955 3.7-155.5-148.6 125.4 9.6 0.6 4.2 91 100 A Y E -DE 44 79B 7 -12,-2.8 -12,-2.7 -2,-0.3 2,-0.6 -0.912 7.4-161.2-107.3 121.9 12.9 2.2 4.8 92 101 A I E -DE 43 78B 0 -49,-2.5 -49,-2.5 -2,-0.6 2,-0.5 -0.902 7.2-155.6-105.7 121.1 12.9 5.8 6.2 93 102 A V E +DE 42 77B 0 -16,-2.8 -17,-2.7 -2,-0.6 -16,-1.3 -0.836 22.7 159.0 -99.5 130.6 16.1 7.7 5.8 94 103 A Q E -D 41 0B 18 -53,-2.7 -53,-2.6 -2,-0.5 2,-0.1 -0.830 47.6 -65.8-140.5 174.6 16.9 10.6 8.1 95 104 A D E -D 40 0B 71 -21,-0.4 2,-0.3 -2,-0.3 -55,-0.2 -0.441 56.1-113.3 -66.2 136.0 19.8 12.7 9.4 96 105 A L - 0 0 55 -57,-0.6 2,-0.4 -2,-0.1 -1,-0.1 -0.525 33.9-163.4 -71.3 130.4 22.2 10.6 11.5 97 106 A M - 0 0 27 -2,-0.3 50,-0.2 1,-0.1 55,-0.0 -0.981 17.0-138.6-122.1 133.6 22.1 11.8 15.1 98 107 A E S S- 0 0 115 -2,-0.4 2,-0.3 48,-0.1 49,-0.2 0.798 70.0 -33.2 -56.0 -42.1 24.8 11.0 17.6 99 108 A T E -G 146 0C 4 47,-2.5 47,-3.0 263,-0.0 2,-0.3 -0.871 58.5-115.9-163.9-169.8 22.7 10.2 20.7 100 109 A D E > -G 145 0C 23 45,-0.3 4,-2.5 -2,-0.3 3,-0.3 -0.942 33.2-100.7-143.1 167.1 19.5 11.3 22.5 101 110 A L H > S+ 0 0 0 43,-2.3 4,-2.6 40,-0.8 41,-0.2 0.798 118.5 60.1 -58.8 -31.1 18.5 12.8 25.8 102 111 A Y H > S+ 0 0 122 39,-0.7 4,-0.8 42,-0.2 -1,-0.2 0.951 110.5 39.9 -61.7 -48.6 17.6 9.4 27.2 103 112 A K H >> S+ 0 0 82 -3,-0.3 3,-0.9 1,-0.2 4,-0.7 0.933 115.6 52.3 -66.3 -46.3 21.2 8.2 26.8 104 113 A L H >X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 3,-1.2 0.893 104.5 54.9 -57.4 -43.7 22.7 11.5 27.9 105 114 A L H 3< S+ 0 0 8 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.728 105.2 56.0 -66.0 -19.4 20.7 11.6 31.1 106 115 A K H << S+ 0 0 148 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.647 122.2 22.8 -84.2 -15.4 22.1 8.2 32.0 107 116 A a H << S+ 0 0 58 -3,-1.2 2,-0.4 -4,-0.7 -2,-0.2 0.620 112.8 58.5-126.6 -18.1 25.7 9.3 31.7 108 117 A Q < - 0 0 25 -4,-2.7 2,-0.7 -5,-0.2 -1,-0.2 -0.939 61.4-137.5-127.4 143.3 26.1 13.0 32.2 109 118 A H - 0 0 151 -2,-0.4 2,-0.5 -3,-0.1 102,-0.1 -0.833 35.6-135.8 -90.2 118.6 25.3 15.6 34.8 110 119 A L - 0 0 5 -2,-0.7 103,-0.0 100,-0.4 -5,-0.0 -0.667 9.5-136.9 -84.1 123.2 23.9 18.6 32.7 111 120 A S >> - 0 0 44 -2,-0.5 4,-2.6 1,-0.1 3,-0.5 -0.337 30.5-105.8 -67.9 161.9 25.1 22.0 33.6 112 121 A N H 3> S+ 0 0 64 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.820 123.1 58.5 -58.7 -32.4 22.4 24.7 33.8 113 122 A D H 3> S+ 0 0 57 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.914 107.9 45.7 -64.9 -41.1 23.8 26.0 30.4 114 123 A H H <> S+ 0 0 18 -3,-0.5 4,-2.7 2,-0.2 5,-0.3 0.939 113.4 49.5 -64.5 -49.6 23.1 22.6 28.8 115 124 A I H X S+ 0 0 7 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.919 110.9 50.1 -55.5 -45.2 19.6 22.4 30.4 116 125 A C H X S+ 0 0 2 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.926 114.2 43.1 -60.2 -47.8 18.8 26.0 29.2 117 126 A Y H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.832 114.8 49.2 -70.5 -36.1 19.8 25.3 25.6 118 127 A F H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.949 113.1 47.2 -67.2 -49.6 18.2 21.9 25.4 119 128 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.3 -2,-0.2 0.867 109.8 53.8 -59.3 -39.3 14.9 23.2 26.8 120 129 A Y H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.921 110.7 45.8 -61.1 -45.9 15.0 26.1 24.4 121 130 A Q H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.862 110.0 54.1 -66.0 -38.8 15.4 23.9 21.3 122 131 A I H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.954 114.4 41.8 -59.4 -49.8 12.6 21.5 22.5 123 132 A L H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.839 110.6 55.4 -67.8 -34.5 10.3 24.5 22.8 124 133 A R H X S+ 0 0 3 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.920 113.3 42.8 -66.2 -39.8 11.4 26.1 19.6 125 134 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.904 113.8 51.3 -70.2 -40.5 10.5 22.9 17.8 126 135 A L H X S+ 0 0 0 -4,-2.3 4,-3.5 -5,-0.2 5,-0.3 0.902 103.0 59.6 -63.9 -39.3 7.3 22.5 19.7 127 136 A K H X S+ 0 0 15 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.912 109.3 44.5 -54.5 -43.3 6.3 26.1 18.8 128 137 A Y H X S+ 0 0 5 -4,-1.3 4,-1.1 2,-0.2 186,-0.5 0.951 112.8 50.4 -68.0 -47.5 6.5 25.0 15.2 129 138 A I H ><>S+ 0 0 0 -4,-2.5 5,-1.7 1,-0.2 3,-0.9 0.948 115.3 42.6 -56.1 -50.2 4.6 21.7 15.8 130 139 A H H ><5S+ 0 0 5 -4,-3.5 3,-1.6 1,-0.3 -1,-0.2 0.817 106.5 60.8 -68.2 -29.1 1.8 23.5 17.6 131 140 A S H 3<5S+ 0 0 32 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.726 101.1 56.3 -69.7 -17.7 1.7 26.3 15.1 132 141 A A T <<5S- 0 0 0 -4,-1.1 186,-2.5 -3,-0.9 -1,-0.3 0.340 122.1-111.0 -91.1 4.4 0.8 23.6 12.6 133 142 A N T < 5S+ 0 0 39 -3,-1.6 30,-2.6 1,-0.3 2,-0.4 0.824 74.7 137.1 67.1 35.2 -2.1 22.6 14.8 134 143 A V E < -I 162 0D 0 -5,-1.7 2,-0.5 28,-0.2 -1,-0.3 -0.897 45.5-153.1-116.9 143.7 -0.4 19.3 15.7 135 144 A L E -I 161 0D 7 26,-2.6 26,-1.7 -2,-0.4 61,-0.1 -0.954 2.8-160.3-108.8 128.2 -0.1 17.6 19.1 136 145 A H - 0 0 0 -2,-0.5 23,-0.2 24,-0.2 -1,-0.2 0.928 16.3-173.9 -73.5 -46.6 2.9 15.3 19.4 137 146 A R + 0 0 18 59,-0.1 -1,-0.1 23,-0.1 20,-0.1 0.306 65.8 60.8 69.8 -5.1 1.4 13.4 22.3 138 147 A D + 0 0 10 18,-0.1 2,-0.1 2,-0.0 -1,-0.1 -0.001 60.9 156.2-142.4 40.2 4.5 11.3 23.1 139 148 A L + 0 0 3 43,-0.1 3,-0.1 3,-0.1 17,-0.0 -0.443 16.2 139.9 -67.1 136.7 7.3 13.6 24.0 140 149 A K > - 0 0 12 -2,-0.1 3,-1.9 1,-0.1 -39,-0.1 -0.954 65.0 -86.8-166.9 163.7 10.0 11.8 26.1 141 150 A P G > S+ 0 0 1 0, 0.0 3,-2.0 0, 0.0 -40,-0.8 0.864 122.0 55.9 -50.9 -42.8 13.8 11.8 26.4 142 151 A S G 3 S+ 0 0 46 1,-0.3 -3,-0.1 -41,-0.2 -39,-0.0 0.635 101.7 59.4 -67.8 -11.1 14.4 9.1 23.8 143 152 A N G < S+ 0 0 10 -3,-1.9 12,-1.9 1,-0.1 2,-0.7 0.314 88.5 84.0 -96.6 8.5 12.4 11.1 21.3 144 153 A L E < - H 0 154C 1 -3,-2.0 -43,-2.3 10,-0.2 -42,-0.2 -0.871 68.1-164.4-115.3 96.4 14.9 14.0 21.6 145 154 A L E -GH 100 153C 30 8,-2.6 8,-2.6 -2,-0.7 2,-0.3 -0.548 5.7-168.9 -82.2 146.3 17.8 13.3 19.3 146 155 A L E -GH 99 152C 0 -47,-3.0 -47,-2.5 6,-0.2 6,-0.2 -0.976 13.0-146.4-137.9 148.7 21.1 15.2 19.6 147 156 A N > - 0 0 33 4,-1.7 3,-1.5 -2,-0.3 -50,-0.1 -0.451 45.0 -90.8-100.1 178.7 24.3 15.7 17.6 148 157 A T T 3 S+ 0 0 80 1,-0.3 212,-0.3 -2,-0.2 -51,-0.0 0.585 126.2 56.2 -68.0 -11.8 27.8 16.1 19.1 149 158 A T T 3 S- 0 0 37 2,-0.1 -1,-0.3 210,-0.1 209,-0.1 0.110 119.8-106.3-107.5 20.4 27.3 19.9 19.1 150 159 A C < + 0 0 0 -3,-1.5 2,-0.3 1,-0.2 -2,-0.1 0.630 66.1 153.1 66.1 17.7 24.2 19.8 21.2 151 160 A D - 0 0 34 -30,-0.0 -4,-1.7 197,-0.0 2,-0.3 -0.655 33.5-148.3 -75.7 133.4 21.8 20.5 18.3 152 161 A L E - H 0 146C 1 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.841 18.3-174.4-113.5 143.8 18.5 19.0 19.2 153 162 A K E - H 0 145C 37 -8,-2.6 -8,-2.6 -2,-0.3 2,-0.3 -0.991 19.3-137.2-141.6 131.1 15.7 17.4 17.1 154 163 A I E +fH 72 144C 0 -83,-2.2 -81,-2.4 -2,-0.4 2,-0.2 -0.648 34.1 170.4 -83.5 137.3 12.3 16.1 18.0 155 164 A C + 0 0 17 -12,-1.9 -81,-0.0 -2,-0.3 -12,-0.0 -0.776 33.8 63.9-136.9-177.9 11.3 12.8 16.3 156 165 A D + 0 0 13 -2,-0.2 3,-0.4 1,-0.1 -1,-0.2 0.998 38.1 171.5 60.8 80.3 8.7 10.0 16.3 157 166 A F > + 0 0 0 1,-0.2 3,-1.5 2,-0.1 -1,-0.1 0.085 39.8 118.4-101.6 22.6 5.4 11.5 15.3 158 167 A G T 3 S+ 0 0 0 1,-0.3 -99,-0.2 -99,-0.1 -1,-0.2 0.761 82.1 39.3 -60.7 -26.7 3.6 8.1 15.0 159 168 A L T 3 S+ 0 0 3 -3,-0.4 -1,-0.3 -23,-0.2 -2,-0.1 0.297 89.8 121.9-104.7 6.9 1.2 9.0 17.8 160 169 A A < - 0 0 0 -3,-1.5 2,-0.3 -104,-0.1 -24,-0.2 -0.374 40.1-169.1 -72.9 150.9 0.7 12.7 16.7 161 170 A R E -I 135 0D 48 -26,-1.7 -26,-2.6 -2,-0.1 2,-0.4 -0.972 27.9-112.7-137.6 151.8 -2.8 14.0 15.9 162 171 A V E -I 134 0D 6 -2,-0.3 2,-2.8 -28,-0.2 -28,-0.2 -0.685 40.5-112.7 -80.8 134.7 -4.1 17.1 14.3 163 172 A A + 0 0 29 -30,-2.6 -1,-0.1 -2,-0.4 5,-0.1 -0.441 52.0 173.0 -71.0 78.4 -6.0 19.0 16.9 164 173 A D > - 0 0 19 -2,-2.8 3,-1.5 3,-0.3 156,-0.1 -0.812 22.2-166.0 -95.1 106.5 -9.3 18.5 15.1 165 174 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.910 84.1 65.4 -54.0 -48.3 -12.2 19.7 17.2 166 175 A D T 3 S+ 0 0 156 1,-0.1 2,-0.2 0, 0.0 -2,-0.0 0.381 116.5 13.6 -60.6 3.3 -14.8 17.9 14.9 167 176 A H < + 0 0 60 -3,-1.5 -3,-0.3 2,-0.0 2,-0.2 -0.757 56.0 150.8 177.9 134.3 -13.4 14.5 16.0 168 177 A D - 0 0 52 -2,-0.2 2,-0.1 -5,-0.1 -5,-0.0 -0.777 31.7-140.0-168.4 118.4 -11.1 12.9 18.6 169 178 A H - 0 0 125 -2,-0.2 3,-0.3 1,-0.1 2,-0.2 -0.342 11.7-111.2 -89.1 167.1 -11.5 9.3 19.8 170 179 A T S S+ 0 0 103 1,-0.2 22,-0.1 -2,-0.1 -1,-0.1 -0.520 82.4 62.7 -90.0 156.3 -11.2 7.3 23.1 171 180 A G + 0 0 26 20,-0.4 4,-0.4 -2,-0.2 -1,-0.2 0.560 50.8 126.4 107.9 9.6 -8.5 4.8 23.9 172 181 A F S > S+ 0 0 8 19,-0.4 3,-1.5 -3,-0.3 -2,-0.1 0.916 77.3 54.1 -65.4 -41.6 -5.2 6.7 23.8 173 182 A L T 3 S+ 0 0 37 1,-0.3 -1,-0.2 14,-0.2 4,-0.1 0.873 104.7 56.8 -57.2 -37.9 -4.3 5.5 27.3 174 183 A T T 3 S+ 0 0 108 2,-0.1 -1,-0.3 0, 0.0 -2,-0.2 0.556 83.9 107.5 -73.2 -10.4 -4.8 1.9 26.0 175 184 A E S < S- 0 0 43 -3,-1.5 2,-0.5 -4,-0.4 -4,-0.0 -0.257 82.3-104.8 -62.5 155.4 -2.2 2.4 23.2 176 185 A Y + 0 0 186 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.766 49.3 166.9 -86.7 129.7 1.1 0.6 23.6 177 186 A V - 0 0 11 -2,-0.5 3,-0.1 -4,-0.1 -39,-0.0 -0.978 44.7-125.9-139.7 148.7 3.8 3.0 24.6 178 187 A A S S+ 0 0 73 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.796 94.9 6.4 -65.8 -26.9 7.3 2.3 25.9 179 188 A T - 0 0 27 1,-0.1 -1,-0.2 -3,-0.0 3,-0.2 -0.982 45.2-164.6-158.6 145.1 6.6 4.5 28.9 180 189 A R > + 0 0 51 -2,-0.3 3,-1.4 39,-0.2 39,-0.1 0.228 65.3 106.3-110.6 9.7 3.8 6.5 30.5 181 190 A W T 3 S+ 0 0 90 1,-0.2 36,-0.3 38,-0.1 -1,-0.1 0.655 82.0 47.5 -65.4 -14.5 6.0 8.6 32.8 182 191 A Y T 3 S+ 0 0 14 -3,-0.2 2,-0.4 2,-0.1 -1,-0.2 0.300 82.6 117.8-111.1 7.8 5.5 11.7 30.6 183 192 A R < - 0 0 6 -3,-1.4 16,-0.1 1,-0.1 5,-0.1 -0.627 66.4-117.6 -82.4 131.1 1.8 11.6 30.2 184 193 A A >> - 0 0 0 -2,-0.4 3,-1.1 14,-0.2 4,-0.5 -0.242 25.4-113.1 -61.2 151.3 -0.3 14.6 31.5 185 194 A P H >> S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 4,-0.7 0.851 113.0 64.1 -60.4 -35.3 -2.8 13.8 34.3 186 195 A E H >> S+ 0 0 7 1,-0.3 4,-3.2 99,-0.2 3,-0.9 0.843 92.7 64.9 -58.1 -28.2 -5.8 14.6 32.1 187 196 A I H <4 S+ 0 0 4 -3,-1.1 -1,-0.3 1,-0.3 -14,-0.2 0.825 107.9 40.6 -64.7 -28.9 -4.9 11.6 29.8 188 197 A M H << S+ 0 0 32 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.484 123.7 39.9 -94.0 -6.6 -5.6 9.4 32.8 189 198 A L H << S+ 0 0 9 -3,-0.9 2,-0.3 -4,-0.7 60,-0.3 0.788 112.2 42.2-112.5 -40.8 -8.7 11.3 33.9 190 199 A N S < S- 0 0 20 -4,-3.2 -1,-0.2 -5,-0.1 3,-0.1 -0.805 73.4-133.0-107.1 154.1 -10.7 12.3 30.8 191 200 A S S S- 0 0 56 -2,-0.3 -20,-0.4 -3,-0.1 -19,-0.4 0.580 78.2 -30.1 -81.9 -11.6 -11.2 10.0 27.9 192 201 A K S S+ 0 0 103 -22,-0.1 -22,-0.1 -6,-0.1 -23,-0.1 -0.911 84.7 105.7-176.2-161.6 -10.4 12.5 25.2 193 202 A G + 0 0 54 -2,-0.3 2,-0.1 1,-0.2 -1,-0.1 0.771 52.0 167.4 74.8 24.0 -10.5 16.2 24.6 194 203 A Y - 0 0 26 -3,-0.1 -1,-0.2 1,-0.1 2,-0.2 -0.437 15.8-159.9 -72.0 144.2 -6.7 16.5 25.1 195 204 A T > - 0 0 66 -2,-0.1 3,-2.1 -32,-0.0 4,-0.3 -0.531 39.7 -81.7-115.3-174.3 -5.1 19.8 24.0 196 205 A K T >> S+ 0 0 79 1,-0.3 3,-1.5 -2,-0.2 4,-1.0 0.717 116.4 79.6 -58.0 -23.2 -1.6 21.1 23.1 197 206 A S H 3> S+ 0 0 12 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.690 76.2 69.2 -63.9 -18.4 -1.1 21.4 26.8 198 207 A I H <> S+ 0 0 2 -3,-2.1 4,-1.6 1,-0.2 -1,-0.3 0.854 99.3 51.1 -69.1 -27.7 -0.4 17.7 27.1 199 208 A D H <> S+ 0 0 0 -3,-1.5 4,-1.8 -4,-0.3 -2,-0.2 0.857 107.1 52.0 -73.1 -36.1 2.9 18.4 25.2 200 209 A I H X S+ 0 0 2 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.889 107.8 53.2 -66.5 -37.0 3.8 21.2 27.6 201 210 A W H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.945 107.3 50.4 -61.9 -45.2 3.3 18.7 30.5 202 211 A S H X S+ 0 0 6 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.889 109.6 51.3 -59.0 -41.5 5.7 16.2 28.9 203 212 A V H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.869 106.1 54.9 -64.2 -37.1 8.3 19.0 28.5 204 213 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 78,-0.2 -1,-0.2 0.916 107.8 49.2 -63.3 -40.1 7.9 19.8 32.1 205 214 A C H X S+ 0 0 1 -4,-2.0 4,-2.1 1,-0.2 11,-0.3 0.889 111.3 49.4 -66.0 -36.9 8.7 16.2 33.0 206 215 A I H X S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.900 110.2 50.3 -68.2 -41.0 11.7 16.2 30.7 207 216 A L H X S+ 0 0 0 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.931 110.4 50.1 -62.4 -45.5 13.0 19.5 32.3 208 217 A A H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 6,-0.3 0.925 110.3 50.3 -58.1 -45.0 12.6 18.0 35.8 209 218 A E H X S+ 0 0 13 -4,-2.1 4,-2.1 1,-0.2 3,-0.4 0.834 107.0 53.7 -63.4 -35.9 14.5 14.9 34.7 210 219 A M H < S+ 0 0 2 -4,-2.0 -100,-0.4 1,-0.2 -1,-0.2 0.815 105.1 57.5 -66.9 -30.3 17.4 17.1 33.3 211 220 A L H < S+ 0 0 29 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.752 128.0 10.5 -72.3 -24.0 17.6 18.8 36.7 212 221 A S H < S- 0 0 26 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.377 92.1-119.9-136.7 1.7 18.2 15.6 38.6 213 222 A N S < S+ 0 0 47 -4,-2.1 -3,-0.1 -5,-0.2 -4,-0.1 0.664 85.1 98.0 61.9 17.1 18.9 12.8 36.1 214 223 A R S S- 0 0 163 -5,-0.3 -2,-0.2 -6,-0.3 -1,-0.2 -0.991 83.9-104.3-133.9 143.4 15.9 10.9 37.5 215 224 A P - 0 0 36 0, 0.0 -9,-0.1 0, 0.0 -33,-0.0 -0.390 25.4-147.2 -63.8 140.7 12.3 10.7 36.2 216 225 A I S S+ 0 0 20 -11,-0.3 -10,-0.0 1,-0.2 -11,-0.0 0.867 90.5 27.8 -80.3 -33.2 10.0 12.8 38.4 217 226 A F + 0 0 1 -36,-0.3 2,-1.6 -12,-0.1 -1,-0.2 -0.587 69.9 167.0-127.3 71.3 6.9 10.7 38.1 218 227 A P + 0 0 39 0, 0.0 -37,-0.1 0, 0.0 7,-0.1 -0.368 16.4 173.7 -84.2 61.2 8.0 7.0 37.5 219 228 A G - 0 0 6 -2,-1.6 -39,-0.2 1,-0.1 3,-0.1 -0.226 34.7-143.1 -66.5 157.2 4.7 5.2 38.1 220 229 A K S S- 0 0 180 1,-0.2 2,-0.3 -40,-0.0 -1,-0.1 0.312 82.6 -1.2-101.8 7.6 4.4 1.5 37.5 221 230 A H S > S- 0 0 110 1,-0.1 4,-3.5 -41,-0.0 -1,-0.2 -0.916 88.5 -81.7 178.9 165.3 0.8 1.9 36.2 222 231 A Y H > S+ 0 0 85 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.846 127.4 45.4 -46.9 -46.3 -1.9 4.5 35.6 223 232 A L H > S+ 0 0 90 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.935 116.1 45.3 -68.0 -43.9 -3.0 4.5 39.1 224 233 A D H > S+ 0 0 34 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.857 110.5 56.6 -64.3 -36.8 0.5 4.6 40.5 225 234 A Q H X S+ 0 0 3 -4,-3.5 4,-2.3 2,-0.2 3,-0.4 0.968 107.4 46.0 -59.6 -53.9 1.3 7.4 37.9 226 235 A L H X S+ 0 0 5 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.874 110.5 56.0 -60.1 -34.6 -1.4 9.7 39.1 227 236 A N H X S+ 0 0 59 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.874 106.3 48.7 -66.0 -36.9 -0.3 9.0 42.7 228 237 A H H X S+ 0 0 60 -4,-2.0 4,-0.8 -3,-0.4 5,-0.2 0.922 113.3 49.2 -66.7 -43.1 3.3 10.1 41.9 229 238 A I H >X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 3,-1.0 0.951 114.3 42.5 -60.3 -50.4 1.8 13.2 40.3 230 239 A L H 3X S+ 0 0 2 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.784 105.2 66.7 -69.2 -25.2 -0.5 14.1 43.2 231 240 A G H 3< S+ 0 0 33 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.744 114.7 27.9 -67.0 -21.2 2.3 13.3 45.7 232 241 A I H << S+ 0 0 21 -3,-1.0 30,-3.1 -4,-0.8 -2,-0.2 0.804 127.5 39.8-106.0 -43.3 4.3 16.2 44.4 233 242 A L H < S- 0 0 21 -4,-2.6 -3,-0.2 28,-0.2 28,-0.2 0.806 105.4-130.9 -76.6 -29.1 1.7 18.7 43.2 234 243 A G < - 0 0 7 -4,-1.7 26,-0.2 -5,-0.4 -1,-0.1 -0.189 44.1 -38.8 95.3 165.8 -0.7 18.0 46.0 235 244 A S S S- 0 0 40 24,-2.3 26,-0.1 1,-0.1 23,-0.1 -0.288 74.4-100.5 -60.1 142.6 -4.5 17.2 45.8 236 245 A P - 0 0 22 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.333 37.0-116.1 -65.1 149.4 -6.3 19.2 43.1 237 246 A S >> - 0 0 50 1,-0.1 4,-2.4 -3,-0.1 3,-0.7 -0.413 30.6-102.9 -79.3 162.5 -8.2 22.3 44.4 238 247 A Q H 3> S+ 0 0 137 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.878 128.2 56.8 -51.2 -36.9 -12.0 22.3 44.0 239 248 A E H >4 S+ 0 0 119 1,-0.2 3,-0.6 2,-0.2 -1,-0.3 0.877 106.1 47.6 -61.7 -42.0 -11.2 24.7 41.1 240 249 A D H X4 S+ 0 0 37 -3,-0.7 3,-2.5 1,-0.2 4,-0.3 0.881 100.9 64.8 -68.2 -39.8 -8.9 22.1 39.4 241 250 A L H >< S+ 0 0 20 -4,-2.4 3,-1.4 1,-0.3 -1,-0.2 0.753 88.8 72.4 -54.4 -24.6 -11.6 19.3 39.8 242 251 A N T << S+ 0 0 97 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.639 88.5 59.0 -67.2 -15.8 -13.7 21.4 37.4 243 252 A C T < S+ 0 0 11 -3,-2.5 2,-0.8 -4,-0.1 -1,-0.3 0.550 88.9 82.9 -89.6 -6.7 -11.4 20.4 34.5 244 253 A I < + 0 0 1 -3,-1.4 -1,-0.1 -4,-0.3 -54,-0.1 -0.855 51.3 169.6 -99.2 108.2 -12.2 16.8 35.1 245 254 A I + 0 0 135 -2,-0.8 2,-0.3 4,-0.0 -1,-0.2 0.715 44.1 101.4 -91.7 -21.4 -15.5 16.1 33.3 246 255 A N > - 0 0 51 1,-0.1 4,-2.5 -57,-0.1 5,-0.2 -0.498 65.1-145.8 -69.7 124.6 -15.5 12.2 33.6 247 256 A L H > S+ 0 0 154 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.891 96.5 44.5 -56.9 -50.4 -17.8 11.1 36.4 248 257 A K H > S+ 0 0 173 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.892 114.1 51.0 -66.6 -36.0 -15.8 8.1 37.6 249 258 A A H > S+ 0 0 10 -60,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.899 111.0 47.7 -67.6 -42.5 -12.5 10.0 37.4 250 259 A R H X S+ 0 0 93 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.919 113.5 47.6 -66.2 -40.8 -13.9 12.9 39.5 251 260 A N H X S+ 0 0 113 -4,-2.3 4,-0.5 -5,-0.2 -2,-0.2 0.885 109.2 55.1 -65.8 -35.6 -15.2 10.3 42.0 252 261 A Y H >X S+ 0 0 69 -4,-2.3 3,-0.9 1,-0.2 4,-0.6 0.916 107.6 48.7 -62.8 -43.3 -11.8 8.6 42.0 253 262 A L H >< S+ 0 0 14 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.888 108.6 52.4 -64.5 -40.1 -10.0 11.8 42.9 254 263 A L H 3< S+ 0 0 117 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.554 106.4 55.7 -73.2 -6.9 -12.4 12.7 45.8 255 264 A S H << S+ 0 0 80 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.567 89.1 95.8 -98.0 -14.3 -11.8 9.2 47.2 256 265 A L S << S- 0 0 29 -3,-0.9 3,-0.1 -4,-0.6 2,-0.0 -0.518 85.7-102.2 -77.9 144.6 -8.0 9.7 47.3 257 266 A P - 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.301 45.4 -93.0 -65.8 147.5 -6.4 10.9 50.6 258 267 A H - 0 0 145 -4,-0.1 2,-0.4 -23,-0.1 -24,-0.0 -0.322 45.0-168.5 -63.5 144.9 -5.4 14.5 50.9 259 268 A K - 0 0 41 -3,-0.1 -24,-2.3 -23,-0.1 2,-0.2 -0.999 14.0-133.5-138.9 138.4 -1.9 15.4 49.9 260 269 A N - 0 0 119 -2,-0.4 -26,-0.3 -26,-0.2 2,-0.2 -0.509 32.3-100.3 -86.9 158.2 0.2 18.5 50.4 261 270 A K - 0 0 98 -28,-0.2 -28,-0.2 -2,-0.2 -29,-0.1 -0.574 29.2-137.7 -77.5 139.1 2.3 20.1 47.6 262 271 A V - 0 0 32 -30,-3.1 5,-0.1 -2,-0.2 -1,-0.0 -0.898 28.8-114.8 -96.5 122.0 6.0 19.4 47.8 263 272 A P >> - 0 0 43 0, 0.0 3,-1.7 0, 0.0 4,-1.2 -0.342 14.7-131.6 -59.0 137.5 8.0 22.6 47.1 264 273 A W H 3> S+ 0 0 17 1,-0.3 4,-2.8 2,-0.2 3,-0.4 0.886 107.2 59.1 -56.4 -40.5 10.0 22.4 43.9 265 274 A N H 34 S+ 0 0 105 1,-0.2 -1,-0.3 2,-0.2 6,-0.1 0.623 101.8 55.3 -67.3 -11.0 13.1 23.8 45.7 266 275 A R H <4 S+ 0 0 164 -3,-1.7 -1,-0.2 2,-0.1 -2,-0.2 0.831 112.8 40.1 -87.0 -35.9 12.8 20.8 48.1 267 276 A L H < S+ 0 0 56 -4,-1.2 -2,-0.2 -3,-0.4 -3,-0.1 0.842 131.1 28.8 -76.1 -37.1 13.0 18.3 45.2 268 277 A F >< + 0 0 15 -4,-2.8 3,-1.2 -5,-0.2 -1,-0.2 -0.608 66.7 161.8-127.6 71.8 15.6 20.3 43.3 269 278 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.696 78.3 48.3 -62.5 -22.9 17.8 22.3 45.8 270 279 A N T 3 S+ 0 0 160 -59,-0.1 2,-0.1 2,-0.1 3,-0.1 0.437 89.6 110.0-102.0 1.9 20.6 22.9 43.3 271 280 A A S < S- 0 0 23 -3,-1.2 2,-0.1 1,-0.1 -3,-0.0 -0.402 79.3 -95.5 -80.8 153.6 18.5 24.1 40.4 272 281 A D > - 0 0 49 1,-0.1 4,-1.9 -2,-0.1 5,-0.2 -0.429 31.3-131.3 -64.1 131.2 18.2 27.6 39.0 273 282 A S H > S+ 0 0 99 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.824 106.7 52.2 -55.5 -37.6 15.3 29.4 40.6 274 283 A K H > S+ 0 0 89 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.868 105.7 54.1 -69.9 -36.8 14.0 30.6 37.2 275 284 A A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.914 110.1 48.4 -63.4 -39.9 14.1 27.0 35.9 276 285 A L H X S+ 0 0 17 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.874 107.6 53.7 -67.7 -37.1 11.9 26.0 38.8 277 286 A D H X S+ 0 0 68 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.926 113.5 43.9 -63.3 -40.1 9.5 28.9 38.3 278 287 A L H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.896 110.6 54.6 -69.8 -39.3 9.1 27.7 34.7 279 288 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-0.2 0.910 105.7 53.9 -59.7 -41.6 8.8 24.0 35.8 280 289 A D H < S+ 0 0 52 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.859 108.3 48.9 -61.3 -37.4 6.0 25.0 38.1 281 290 A K H < S+ 0 0 77 -4,-1.3 10,-2.3 1,-0.2 3,-0.4 0.767 113.4 46.5 -76.9 -23.1 4.1 26.6 35.2 282 291 A M H < S+ 0 0 0 -4,-1.6 2,-0.6 1,-0.2 -78,-0.2 0.813 109.1 54.3 -84.9 -33.7 4.5 23.6 32.9 283 292 A L S < S+ 0 0 2 -4,-2.4 2,-0.5 -5,-0.2 -1,-0.2 -0.367 75.3 141.5 -99.4 54.1 3.6 21.0 35.6 284 293 A T - 0 0 34 -2,-0.6 6,-0.2 -3,-0.4 5,-0.1 -0.849 49.9-142.4 -97.3 125.1 0.2 22.6 36.4 285 294 A F S S+ 0 0 10 -2,-0.5 -99,-0.2 4,-0.1 -1,-0.1 0.902 85.2 73.6 -52.2 -49.6 -2.5 20.1 37.0 286 295 A N S >> S- 0 0 12 1,-0.2 3,-1.5 -3,-0.1 4,-1.2 -0.616 75.7-148.2 -74.7 115.1 -5.2 22.1 35.3 287 296 A P T 34 S+ 0 0 16 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.773 95.9 55.4 -51.4 -34.8 -4.7 21.9 31.5 288 297 A H T 34 S+ 0 0 142 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.766 108.0 46.5 -75.5 -23.8 -6.1 25.4 31.0 289 298 A K T <4 S+ 0 0 152 -3,-1.5 -1,-0.2 2,-0.1 3,-0.1 0.657 86.7 111.9 -90.7 -16.0 -3.7 27.1 33.5 290 299 A R S < S- 0 0 8 -4,-1.2 -8,-0.2 -6,-0.2 -9,-0.1 -0.284 80.8-100.0 -59.4 137.7 -0.6 25.3 32.1 291 300 A I - 0 0 13 -10,-2.3 2,-0.1 -13,-0.2 -1,-0.1 -0.290 36.2-123.9 -61.5 143.4 1.8 27.7 30.3 292 301 A E > - 0 0 134 -3,-0.1 4,-2.6 1,-0.1 3,-0.2 -0.472 24.5-107.4 -84.2 160.6 1.6 27.8 26.4 293 302 A V H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.920 118.9 48.8 -58.3 -43.3 4.6 27.2 24.2 294 303 A E H > S+ 0 0 68 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.854 112.8 46.3 -64.6 -37.4 4.9 30.8 23.2 295 304 A Q H 4 S+ 0 0 99 -3,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.852 109.9 56.7 -71.2 -35.7 4.8 32.1 26.9 296 305 A A H >< S+ 0 0 0 -4,-2.6 3,-1.6 1,-0.2 6,-0.3 0.938 105.5 49.0 -60.0 -48.0 7.2 29.3 27.8 297 306 A L H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.834 109.7 54.1 -60.3 -31.9 9.8 30.6 25.3 298 307 A A T 3< S+ 0 0 53 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.471 82.9 120.0 -81.1 -5.8 9.3 34.1 26.7 299 308 A H S X S- 0 0 9 -3,-1.6 3,-1.5 -4,-0.4 7,-0.2 -0.320 75.6-118.8 -60.8 144.0 10.1 32.9 30.2 300 309 A P G > S+ 0 0 56 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.781 110.4 67.8 -54.7 -34.4 13.1 34.6 32.0 301 310 A Y G 3 S+ 0 0 7 -27,-0.3 3,-0.3 1,-0.3 -26,-0.1 0.863 107.3 40.0 -57.0 -32.7 14.9 31.3 32.3 302 311 A L G X> S+ 0 0 0 -3,-1.5 4,-2.1 -6,-0.3 3,-1.9 0.189 79.4 118.6-101.8 16.5 15.2 31.2 28.5 303 312 A E T <4 + 0 0 115 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.807 68.5 59.2 -54.7 -35.0 16.0 34.9 28.0 304 313 A Q T 34 S+ 0 0 93 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.689 118.5 30.7 -72.3 -11.6 19.4 34.4 26.5 305 314 A Y T <4 S+ 0 0 1 -3,-1.9 -2,-0.2 -8,-0.1 -1,-0.2 0.613 85.8 112.8-116.7 -21.3 17.9 32.3 23.6 306 315 A Y < + 0 0 73 -4,-2.1 -8,-0.1 -7,-0.2 5,-0.0 -0.343 30.1 151.7 -57.9 133.4 14.4 33.7 23.1 307 316 A D > - 0 0 56 3,-0.0 3,-3.0 1,-0.0 -1,-0.1 -0.434 25.1-172.0-165.0 82.6 14.3 35.4 19.7 308 317 A P G > S+ 0 0 76 0, 0.0 3,-0.5 0, 0.0 -2,-0.1 0.554 85.7 67.6 -58.3 -6.9 10.9 35.5 18.0 309 318 A S G 3 S+ 0 0 109 1,-0.2 -2,-0.0 3,-0.0 0, 0.0 0.684 109.4 37.4 -84.8 -15.3 12.5 36.8 14.8 310 319 A D G < S+ 0 0 45 -3,-3.0 -1,-0.2 1,-0.1 -3,-0.0 -0.320 91.0 94.3-129.7 50.4 14.2 33.4 14.4 311 320 A E < - 0 0 7 -3,-0.5 -1,-0.1 -5,-0.0 -5,-0.0 -0.647 67.8-146.6-141.4 78.9 11.6 30.9 15.6 312 321 A P - 0 0 58 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.029 10.7-161.6 -46.8 146.1 9.7 29.6 12.5 313 322 A I - 0 0 97 -182,-0.1 2,-0.2 -183,-0.1 -185,-0.1 -0.860 36.2 -87.4-126.3 160.2 6.1 28.7 12.5 314 323 A A - 0 0 9 -186,-0.5 -247,-0.1 -2,-0.3 -181,-0.0 -0.519 28.7-145.0 -68.8 134.0 4.2 26.5 10.0 315 324 A E S S+ 0 0 170 1,-0.3 -1,-0.2 -2,-0.2 -183,-0.0 0.872 90.2 31.5 -67.6 -34.8 3.0 28.7 7.1 316 325 A A S S- 0 0 72 -3,-0.0 -1,-0.3 -184,-0.0 2,-0.1 -0.926 79.5-145.3-131.3 110.2 -0.1 26.5 6.9 317 326 A P - 0 0 70 0, 0.0 2,-0.3 0, 0.0 -184,-0.2 -0.449 27.4-111.7 -72.3 141.5 -1.7 24.7 9.9 318 327 A F - 0 0 45 -186,-2.5 -155,-0.2 1,-0.2 3,-0.1 -0.565 31.4-172.0 -70.4 129.0 -3.3 21.3 9.3 319 328 A K + 0 0 150 -2,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.757 61.0 46.1 -97.1 -24.0 -7.0 21.8 9.7 320 329 A F - 0 0 147 -156,-0.1 2,-0.2 -155,-0.1 -1,-0.1 -0.933 66.2-141.4-126.5 145.3 -8.2 18.2 9.6 321 330 A D - 0 0 19 -2,-0.4 2,-0.4 -159,-0.1 -160,-0.1 -0.596 35.5-102.6 -92.7 159.5 -7.2 14.9 11.2 322 331 A M - 0 0 29 -2,-0.2 2,-1.9 1,-0.1 3,-0.2 -0.702 15.8-128.2 -93.3 131.8 -7.3 11.7 9.2 323 332 A E + 0 0 120 -2,-0.4 -1,-0.1 1,-0.2 0, 0.0 -0.565 54.6 144.0 -71.8 86.1 -10.0 9.0 9.5 324 333 A L + 0 0 6 -2,-1.9 -1,-0.2 2,-0.1 -269,-0.1 0.463 57.7 61.1-106.8 -4.4 -7.5 6.2 10.0 325 334 A D S S+ 0 0 89 -3,-0.2 -2,-0.1 1,-0.2 -1,-0.1 0.852 102.7 48.2 -88.9 -39.0 -9.4 4.1 12.5 326 335 A D S S+ 0 0 130 2,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.386 97.9 97.0 -81.2 5.4 -12.4 3.3 10.3 327 336 A L S S- 0 0 19 -276,-0.0 5,-0.0 2,-0.0 -3,-0.0 -0.854 75.4-129.7-102.8 125.3 -9.9 2.4 7.6 328 337 A P >> - 0 0 75 0, 0.0 3,-1.1 0, 0.0 4,-0.9 -0.290 30.6-109.0 -64.1 154.5 -8.9 -1.2 6.9 329 338 A K H >> S+ 0 0 71 1,-0.3 4,-3.6 2,-0.2 3,-0.7 0.846 116.7 64.8 -56.4 -35.4 -5.2 -1.8 6.7 330 339 A E H 3> S+ 0 0 110 1,-0.3 4,-1.4 2,-0.2 -1,-0.3 0.865 103.8 46.0 -57.3 -37.1 -5.4 -2.4 3.0 331 340 A K H <> S+ 0 0 114 -3,-1.1 4,-2.0 2,-0.2 -1,-0.3 0.685 114.0 50.5 -78.2 -17.4 -6.5 1.2 2.5 332 341 A L H X S+ 0 0 92 -4,-1.4 4,-1.6 -5,-0.3 3,-1.2 0.975 109.3 43.0 -59.2 -61.0 -2.6 2.0 -0.0 335 344 A L H 3X S+ 0 0 46 -4,-2.0 4,-2.4 1,-0.3 -1,-0.2 0.822 111.2 56.7 -57.0 -34.4 -2.3 5.5 1.3 336 345 A I H 3X S+ 0 0 1 -4,-2.9 4,-0.9 1,-0.2 -1,-0.3 0.783 104.6 54.1 -67.6 -26.8 1.2 4.7 2.5 337 346 A F H << S+ 0 0 50 -3,-1.2 -2,-0.2 -4,-1.1 -1,-0.2 0.885 110.1 45.5 -73.3 -39.9 2.0 3.7 -1.1 338 347 A E H >< S+ 0 0 111 -4,-1.6 3,-1.1 1,-0.2 4,-0.4 0.902 110.8 51.9 -69.5 -43.8 0.8 7.1 -2.4 339 348 A E H 3< S+ 0 0 40 -4,-2.4 3,-0.2 1,-0.3 -1,-0.2 0.711 110.9 47.7 -66.7 -24.2 2.7 9.2 0.3 340 349 A T T >< S+ 0 0 0 -4,-0.9 3,-1.3 -5,-0.2 -1,-0.3 0.402 87.2 92.8 -96.3 0.9 6.0 7.5 -0.4 341 350 A A G X + 0 0 45 -3,-1.1 3,-3.0 1,-0.3 -1,-0.2 0.897 67.3 72.6 -61.0 -44.1 5.6 7.9 -4.2 342 351 A R G 3 S+ 0 0 173 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.596 97.1 52.9 -50.2 -10.8 7.5 11.2 -4.3 343 352 A F G < S+ 0 0 45 -3,-1.3 -1,-0.3 -265,-0.1 -2,-0.2 0.445 86.9 98.8-106.9 0.0 10.7 9.2 -3.8 344 353 A Q < 0 0 61 -3,-3.0 -263,-0.0 -4,-0.2 -265,-0.0 -0.582 360.0 360.0 -87.6 150.7 10.3 6.7 -6.6 345 354 A P 0 0 172 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.902 360.0 360.0 -46.5 360.0 12.1 7.0 -10.0 346 !* 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 0.0 347 16 B R >> 0 0 133 0, 0.0 4,-2.4 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 128.0 24.9 26.4 15.1 348 17 B L H 3> + 0 0 1 1,-0.3 4,-1.5 2,-0.2 5,-0.1 0.842 360.0 56.5 -45.3 -37.6 21.6 27.9 16.5 349 18 B Q H 34>S+ 0 0 11 2,-0.2 5,-2.4 1,-0.2 -1,-0.3 0.896 106.2 45.9 -64.7 -43.9 23.7 28.5 19.7 350 19 B E H X45S+ 0 0 111 -3,-0.8 3,-2.7 1,-0.2 -2,-0.2 0.942 108.7 58.5 -63.6 -45.8 26.4 30.6 18.0 351 20 B R H 3<5S+ 0 0 115 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.840 104.1 50.8 -49.0 -40.6 23.6 32.5 16.2 352 21 B R T 3<5S- 0 0 33 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.417 121.7-110.1 -81.5 1.2 22.2 33.4 19.6 353 22 B G T < 5 + 0 0 60 -3,-2.7 2,-0.5 1,-0.3 -3,-0.2 0.659 68.1 147.3 80.3 16.4 25.7 34.6 20.7 354 23 B S < + 0 0 14 -5,-2.4 -1,-0.3 1,-0.1 -2,-0.1 -0.771 22.5 178.2 -90.2 125.8 26.3 31.8 23.2 355 24 B N + 0 0 147 -2,-0.5 -1,-0.1 -3,-0.1 -5,-0.1 0.638 37.0 124.7 -97.2 -22.5 30.0 30.9 23.4 356 25 B V - 0 0 46 1,-0.1 2,-1.5 -7,-0.1 -2,-0.1 -0.184 64.7-129.6 -45.5 119.1 29.7 28.2 26.1 357 26 B A - 0 0 79 1,-0.0 2,-0.7 2,-0.0 -1,-0.1 -0.608 25.4-160.2 -77.5 91.9 31.2 25.1 24.6 358 27 B L - 0 0 12 -2,-1.5 2,-0.3 -209,-0.1 -1,-0.0 -0.640 13.4-173.0 -80.1 114.6 28.5 22.6 25.4 359 28 B M - 0 0 136 -2,-0.7 2,-0.4 -210,-0.1 -210,-0.1 -0.753 16.9-145.4-110.4 158.1 29.8 19.0 25.3 360 29 B L - 0 0 36 -212,-0.3 -256,-0.0 -2,-0.3 -212,-0.0 -0.904 4.1-162.4-117.1 145.8 28.3 15.6 25.5 361 30 B D 0 0 132 -2,-0.4 -1,-0.1 -257,-0.1 -257,-0.0 0.545 360.0 360.0-104.2 -10.3 29.9 12.6 27.1 362 31 B a 0 0 60 -262,-0.0 -258,-0.1 -214,-0.0 -259,-0.0 -0.727 360.0 360.0-158.3 360.0 27.8 10.0 25.5