==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-JUN-07 2Q8I . COMPND 2 MOLECULE: [PYRUVATE DEHYDROGENASE [LIPOAMIDE]] KINASE ISOZY . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.KATO,J.LI,J.L.CHUANG,D.T.CHUANG . 462 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24403.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 35 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 36.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 0 2 0 1 1 0 0 0 0 1 1 1 0 1 0 0 2 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 1 2 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 13 A P > 0 0 107 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 9.1 -59.5 -16.3 86.9 2 14 A K H > + 0 0 174 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.890 360.0 48.4 -69.9 -43.2 -62.6 -18.5 86.3 3 15 A Q H > S+ 0 0 98 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.787 110.6 51.2 -62.4 -29.5 -64.4 -15.5 87.9 4 16 A I H > S+ 0 0 13 2,-0.2 4,-2.5 3,-0.2 -2,-0.2 0.935 106.8 51.7 -78.9 -47.4 -62.6 -13.1 85.5 5 17 A E H X S+ 0 0 70 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.961 113.3 47.1 -43.0 -58.7 -63.5 -15.1 82.4 6 18 A R H >X S+ 0 0 128 -4,-2.4 3,-2.0 1,-0.2 4,-0.7 0.945 114.1 43.2 -53.1 -55.5 -67.1 -15.0 83.5 7 19 A Y H >< S+ 0 0 8 -4,-2.3 3,-0.9 1,-0.3 -1,-0.2 0.852 109.1 60.3 -70.3 -23.4 -67.3 -11.3 84.3 8 20 A S H 3< S+ 0 0 0 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.666 100.0 56.3 -73.4 -15.4 -65.4 -10.5 81.1 9 21 A R H << S+ 0 0 159 -3,-2.0 -1,-0.2 -4,-0.8 -2,-0.2 0.542 89.7 94.0 -89.4 -11.7 -68.2 -12.2 79.1 10 22 A F S << S- 0 0 14 -3,-0.9 376,-0.3 -4,-0.7 332,-0.2 -0.476 81.5-121.3 -73.5 151.0 -70.7 -9.8 80.6 11 23 A S - 0 0 14 374,-2.3 33,-0.1 -2,-0.1 -2,-0.1 -0.783 25.5-114.3 -94.5 137.5 -71.4 -6.6 78.6 12 24 A P - 0 0 5 0, 0.0 327,-0.1 0, 0.0 -1,-0.1 -0.310 22.5-128.1 -61.7 157.7 -70.8 -3.2 80.2 13 25 A S - 0 0 3 27,-0.1 2,-0.3 406,-0.1 406,-0.1 -0.848 22.2-149.3-114.7 98.0 -73.7 -1.0 80.8 14 26 A P - 0 0 39 0, 0.0 2,-0.2 0, 0.0 322,-0.0 -0.521 12.2-156.3 -75.4 131.2 -73.1 2.4 79.3 15 27 A L - 0 0 17 -2,-0.3 322,-3.3 3,-0.0 2,-0.3 -0.671 7.1-130.5-100.4 157.6 -74.7 5.4 81.1 16 28 A S B > -A 336 0A 3 320,-0.3 4,-2.7 -2,-0.2 5,-0.3 -0.759 22.8-119.0-107.4 152.0 -75.7 8.8 79.8 17 29 A I H > S+ 0 0 0 318,-2.0 4,-2.8 315,-0.3 5,-0.2 0.913 119.5 57.1 -51.1 -39.7 -75.0 12.2 81.2 18 30 A K H > S+ 0 0 85 314,-1.3 4,-3.9 1,-0.2 5,-0.3 0.951 106.9 46.7 -56.8 -49.1 -78.7 12.5 81.4 19 31 A Q H > S+ 0 0 77 313,-0.2 4,-3.0 1,-0.2 5,-0.2 0.922 112.6 48.8 -59.7 -45.6 -79.0 9.3 83.5 20 32 A F H X S+ 0 0 13 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.921 117.5 42.7 -58.5 -44.4 -76.2 10.4 85.9 21 33 A L H X S+ 0 0 8 -4,-2.8 4,-2.0 -5,-0.3 5,-0.3 0.928 114.2 48.8 -69.9 -47.4 -77.8 13.8 86.2 22 34 A D H X>S+ 0 0 49 -4,-3.9 4,-2.3 -5,-0.2 5,-1.2 0.925 113.7 49.4 -58.9 -44.9 -81.4 12.4 86.6 23 35 A F H X>S+ 0 0 43 -4,-3.0 5,-1.5 -5,-0.3 4,-0.8 0.965 115.4 39.0 -58.4 -57.2 -80.2 10.0 89.2 24 36 A G H <5S+ 0 0 10 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.736 122.5 42.3 -70.4 -24.1 -78.2 12.4 91.4 25 37 A R H <5S+ 0 0 125 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.911 132.5 13.0 -86.9 -47.4 -80.8 15.2 91.1 26 38 A D H <5S+ 0 0 110 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.819 136.5 26.1-104.7 -43.0 -84.1 13.4 91.4 27 39 A N T << + 0 0 90 -5,-1.2 -3,-0.2 -4,-0.8 -4,-0.1 0.886 63.1 165.1 -84.8 -85.1 -83.4 9.9 92.7 28 40 A A < + 0 0 46 -5,-1.5 2,-0.6 1,-0.2 -4,-0.1 0.987 16.7 161.8 61.9 59.9 -80.1 9.9 94.7 29 41 A C > - 0 0 40 1,-0.1 4,-1.8 -6,-0.0 -1,-0.2 -0.973 32.9-156.6-112.6 118.3 -80.6 6.6 96.3 30 42 A E H > S+ 0 0 55 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.891 93.5 58.3 -62.0 -39.8 -77.4 5.1 97.7 31 43 A K H > S+ 0 0 85 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.955 105.7 48.4 -50.1 -58.0 -78.9 1.6 97.5 32 44 A T H > S+ 0 0 69 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.873 112.8 47.9 -54.1 -42.5 -79.5 1.9 93.8 33 45 A S H X S+ 0 0 14 -4,-1.8 4,-3.2 2,-0.2 -1,-0.3 0.900 112.1 49.2 -69.3 -42.3 -76.0 3.2 93.2 34 46 A Y H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.946 111.0 49.4 -58.0 -51.0 -74.4 0.4 95.3 35 47 A M H X S+ 0 0 84 -4,-2.9 4,-0.5 1,-0.2 -2,-0.2 0.895 116.7 43.3 -57.1 -46.4 -76.5 -2.4 93.5 36 48 A F H >X S+ 0 0 45 -4,-2.3 4,-2.4 -5,-0.3 3,-1.1 0.973 117.9 42.9 -60.4 -57.1 -75.4 -1.0 90.1 37 49 A L H 3X S+ 0 0 4 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.847 102.2 64.0 -67.4 -35.0 -71.8 -0.3 91.0 38 50 A R H 3< S+ 0 0 29 -4,-2.9 -1,-0.2 1,-0.2 44,-0.1 0.727 118.2 30.3 -63.9 -20.6 -71.0 -3.6 92.9 39 51 A K H S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.853 110.4 55.1 -59.3 -33.9 -66.2 -5.8 88.3 43 55 A V H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.959 111.3 43.8 -56.8 -49.5 -67.6 -6.1 84.8 44 56 A R H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 5,-0.2 0.951 113.8 48.5 -67.4 -46.2 -65.5 -3.3 83.5 45 57 A L H X S+ 0 0 3 -4,-2.9 4,-3.0 1,-0.2 -1,-0.2 0.920 112.3 50.1 -57.1 -44.3 -62.3 -4.4 85.2 46 58 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.863 106.8 53.8 -66.6 -39.9 -62.8 -7.9 83.9 47 59 A N H X S+ 0 0 1 -4,-2.3 4,-1.1 -40,-0.2 -1,-0.2 0.928 113.9 43.4 -56.2 -44.8 -63.3 -6.7 80.3 48 60 A T H >X S+ 0 0 4 -4,-2.1 4,-2.1 1,-0.2 3,-0.9 0.946 110.9 53.0 -66.2 -49.3 -60.1 -4.8 80.5 49 61 A M H 3X S+ 0 0 6 -4,-3.0 4,-1.9 1,-0.3 -1,-0.2 0.813 103.6 57.6 -60.2 -33.7 -58.0 -7.6 82.2 50 62 A R H 3< S+ 0 0 62 -4,-1.9 4,-0.4 -5,-0.2 -1,-0.3 0.884 108.9 47.1 -61.8 -37.9 -59.0 -10.1 79.6 51 63 A E H X< S+ 0 0 5 -4,-1.1 3,-1.6 -3,-0.9 4,-0.4 0.910 105.3 56.9 -75.2 -39.8 -57.5 -7.7 77.0 52 64 A V H >< S+ 0 0 2 -4,-2.1 3,-1.5 1,-0.3 -1,-0.2 0.895 102.8 57.5 -59.4 -33.8 -54.3 -7.1 78.9 53 65 A N T 3< S+ 0 0 90 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.706 98.7 60.1 -62.5 -23.7 -53.8 -10.9 78.8 54 66 A L T < S+ 0 0 34 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.474 81.8 117.0 -83.3 -4.2 -54.0 -10.8 75.0 55 67 A L S < S- 0 0 7 -3,-1.5 5,-0.1 -4,-0.4 -3,-0.0 -0.177 82.3 -82.0 -62.7 152.0 -50.9 -8.4 74.8 56 68 A P >> - 0 0 29 0, 0.0 4,-2.8 0, 0.0 3,-1.5 -0.263 43.5-117.2 -54.9 148.1 -47.7 -9.6 73.1 57 69 A D H 3> S+ 0 0 123 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.886 112.2 58.5 -57.8 -43.1 -45.7 -11.7 75.5 58 70 A N H 34 S+ 0 0 67 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.655 114.5 37.9 -65.8 -15.6 -42.7 -9.3 75.5 59 71 A L H X4 S+ 0 0 0 -3,-1.5 3,-1.6 2,-0.1 6,-0.3 0.797 111.2 55.9 -97.0 -45.6 -45.0 -6.5 76.8 60 72 A L H 3< S+ 0 0 42 -4,-2.8 -2,-0.2 1,-0.3 6,-0.2 0.859 103.6 62.2 -52.5 -35.3 -47.1 -8.7 79.1 61 73 A N T 3< S+ 0 0 97 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.643 75.9 108.3 -61.8 -27.2 -43.8 -9.6 80.7 62 74 A R S X> S- 0 0 30 -3,-1.6 4,-2.0 -5,-0.1 3,-1.3 -0.414 74.0-128.9 -70.1 129.7 -42.8 -6.2 81.9 63 75 A P H 3> S+ 0 0 88 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.837 109.5 57.7 -37.2 -44.8 -43.0 -5.6 85.7 64 76 A S H 3> S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.907 107.3 46.2 -58.9 -41.8 -45.0 -2.5 85.1 65 77 A V H <> S+ 0 0 1 -3,-1.3 4,-2.5 -6,-0.3 -1,-0.2 0.952 111.4 52.8 -66.1 -47.4 -47.7 -4.5 83.3 66 78 A G H X S+ 0 0 31 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.908 108.1 50.9 -48.1 -49.8 -47.6 -7.2 86.0 67 79 A L H X S+ 0 0 84 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.899 109.6 49.4 -61.1 -43.0 -48.2 -4.6 88.7 68 80 A V H X S+ 0 0 1 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.972 111.5 49.4 -59.2 -56.2 -51.2 -3.1 86.9 69 81 A Q H X S+ 0 0 46 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.935 111.7 48.2 -44.2 -55.2 -52.7 -6.5 86.4 70 82 A S H X S+ 0 0 59 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.854 110.1 52.6 -63.4 -32.0 -52.3 -7.3 90.1 71 83 A W H X S+ 0 0 45 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.925 110.6 47.3 -65.6 -43.2 -53.8 -4.0 91.0 72 84 A Y H X S+ 0 0 1 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.915 113.3 48.3 -64.1 -42.9 -56.9 -4.7 88.9 73 85 A M H X S+ 0 0 50 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.926 110.7 51.4 -58.8 -49.4 -57.1 -8.2 90.4 74 86 A Q H X S+ 0 0 90 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.912 114.3 44.2 -54.8 -42.6 -56.8 -6.8 93.8 75 87 A S H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.912 112.1 51.3 -71.3 -46.6 -59.6 -4.4 93.0 76 88 A F H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 3,-0.5 0.945 111.1 47.2 -51.4 -55.8 -61.8 -6.9 91.3 77 89 A L H X S+ 0 0 95 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.897 109.8 54.2 -60.2 -37.6 -61.6 -9.3 94.2 78 90 A E H < S+ 0 0 44 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.834 110.7 45.7 -66.2 -32.5 -62.3 -6.5 96.7 79 91 A L H >< S+ 0 0 1 -4,-1.6 3,-1.6 -3,-0.5 -1,-0.2 0.806 103.5 62.9 -80.8 -31.5 -65.5 -5.5 94.9 80 92 A L H >< S+ 0 0 27 -4,-2.3 3,-2.0 1,-0.3 4,-0.3 0.808 85.0 76.8 -62.5 -26.8 -66.7 -9.1 94.5 81 93 A E T 3< S+ 0 0 126 -4,-1.1 3,-0.5 1,-0.3 -1,-0.3 0.777 93.6 54.7 -50.6 -24.5 -66.9 -9.2 98.4 82 94 A Y T X S+ 0 0 25 -3,-1.6 3,-1.7 1,-0.2 -1,-0.3 0.513 73.6 98.1 -95.6 -3.7 -70.1 -7.3 98.0 83 95 A E T < S+ 0 0 32 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.698 98.5 29.1 -57.7 -23.2 -72.1 -9.5 95.6 84 96 A N T 3 S+ 0 0 142 -3,-0.5 2,-0.7 -4,-0.3 -1,-0.3 0.113 93.3 110.5-123.9 19.9 -74.0 -11.1 98.4 85 97 A K < - 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0 0 34 -4,-1.3 2,-0.7 -5,-0.6 -3,-0.1 -0.053 30.6 -56.8 101.4 162.8 -37.8 -2.0 69.3 127 139 A F + 0 0 77 -5,-0.1 -5,-0.0 -4,-0.1 165,-0.0 -0.696 46.4 177.2 -85.5 110.8 -40.4 -0.2 67.3 128 140 A D > - 0 0 64 -2,-0.7 4,-1.5 1,-0.1 -2,-0.0 -0.948 23.8-144.9-104.3 135.6 -42.5 -2.4 64.9 129 141 A P H > S+ 0 0 85 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.946 95.4 47.3 -67.3 -47.4 -45.2 -0.5 63.0 130 142 A F H >> S+ 0 0 61 1,-0.2 3,-1.6 2,-0.2 4,-1.3 0.959 113.2 46.3 -59.9 -52.9 -47.8 -3.2 63.0 131 143 A I H 3> S+ 0 0 51 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.863 103.0 66.7 -59.6 -35.4 -47.5 -4.2 66.7 132 144 A S H 3X S+ 0 0 3 -4,-1.5 4,-2.3 1,-0.2 -1,-0.3 0.842 99.1 51.6 -50.2 -34.5 -47.7 -0.4 67.5 133 145 A T H -B 174 0B 29 3,-3.4 3,-1.7 -2,-0.1 2,-0.6 -0.849 69.9 -54.7-111.2 93.8 -74.4 17.0 90.6 172 185 A G T 3 S- 0 0 18 -2,-0.7 -5,-0.1 1,-0.2 -17,-0.1 -0.659 121.5 -24.0 67.2-118.9 -71.5 14.9 91.6 173 186 A S T 3 S+ 0 0 20 -2,-0.6 2,-0.5 -22,-0.1 53,-0.3 0.307 119.2 100.6-105.5 9.4 -68.9 15.9 89.0 174 187 A I B < -B 171 0B 0 -3,-1.7 -3,-3.4 50,-0.2 50,-0.2 -0.829 58.3-153.8 -99.3 129.8 -71.5 17.1 86.4 175 188 A D E > -C 223 0C 26 48,-3.1 48,-1.8 -2,-0.5 3,-0.9 -0.894 0.9-160.9 -97.6 114.7 -72.3 20.7 86.0 176 189 A P E 3 S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 0.730 92.9 36.8 -67.6 -17.5 -75.8 21.2 84.6 177 190 A T E 3 S+ 0 0 78 46,-0.1 2,-0.6 43,-0.1 45,-0.2 -0.439 78.8 175.4-129.9 59.5 -74.9 24.7 83.5 178 191 A C E < -C 221 0C 0 43,-2.2 43,-1.8 -3,-0.9 2,-0.9 -0.569 23.7-146.1 -72.6 113.1 -71.4 24.4 82.3 179 192 A N E > -C 220 0C 34 -2,-0.6 4,-1.4 41,-0.2 3,-0.3 -0.724 10.5-161.1 -80.1 104.7 -70.3 27.7 80.8 180 193 A V H > S+ 0 0 0 39,-1.4 4,-3.1 -2,-0.9 3,-0.5 0.918 85.8 53.2 -59.8 -47.6 -68.0 26.6 78.0 181 194 A A H > S+ 0 0 10 38,-0.5 4,-2.7 1,-0.3 -1,-0.2 0.854 105.8 56.2 -57.7 -34.9 -66.2 29.9 77.6 182 195 A D H > S+ 0 0 88 -3,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.888 109.9 44.0 -68.1 -36.1 -65.4 30.0 81.3 183 196 A V H X S+ 0 0 16 -4,-1.4 4,-2.9 -3,-0.5 5,-0.3 0.899 111.4 55.3 -73.6 -39.3 -63.7 26.7 81.1 184 197 A V H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.951 110.1 45.0 -52.3 -49.6 -62.0 27.8 77.9 185 198 A K H X S+ 0 0 99 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.926 114.1 49.3 -65.5 -43.7 -60.5 30.9 79.7 186 199 A D H X S+ 0 0 102 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.902 112.0 47.6 -58.4 -46.3 -59.5 28.8 82.8 187 200 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.908 114.0 49.3 -63.4 -41.8 -57.7 26.2 80.7 188 201 A Y H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.3 -2,-0.2 0.942 108.4 50.4 -62.9 -48.3 -56.0 28.9 78.8 189 202 A E H X S+ 0 0 113 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.896 110.7 51.6 -58.3 -39.5 -54.8 30.8 81.8 190 203 A T H X S+ 0 0 48 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.907 113.0 42.4 -66.6 -42.2 -53.4 27.6 83.2 191 204 A A H X S+ 0 0 3 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.914 111.0 59.0 -69.2 -37.0 -51.4 26.7 80.1 192 205 A K H X S+ 0 0 20 -4,-3.0 4,-3.5 1,-0.2 5,-0.3 0.908 102.9 52.1 -55.3 -45.9 -50.4 30.5 79.8 193 206 A M H X S+ 0 0 115 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.889 111.9 45.3 -59.7 -41.3 -48.7 30.4 83.2 194 207 A L H X S+ 0 0 90 -4,-1.3 4,-1.3 2,-0.2 5,-0.2 0.922 115.0 47.7 -71.7 -43.5 -46.7 27.3 82.2 195 208 A C H X S+ 0 0 13 -4,-2.9 4,-3.1 1,-0.2 5,-0.5 0.941 112.6 48.4 -57.7 -53.4 -45.8 28.7 78.8 196 209 A E H X S+ 0 0 90 -4,-3.5 4,-1.9 1,-0.2 -2,-0.2 0.900 106.1 60.1 -55.9 -40.3 -44.7 32.1 80.3 197 210 A Q H < S+ 0 0 145 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.885 120.1 23.0 -58.8 -37.8 -42.7 30.3 83.0 198 211 A Y H < S+ 0 0 163 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.878 131.9 36.3 -98.4 -41.3 -40.4 28.6 80.4 199 212 A Y H < S- 0 0 42 -4,-3.1 -3,-0.2 2,-0.2 -2,-0.2 0.563 94.4-130.3 -92.2 -9.2 -40.6 30.7 77.3 200 213 A L S < S+ 0 0 156 -4,-1.9 2,-0.3 -5,-0.5 -4,-0.2 0.689 84.7 48.4 68.0 18.9 -40.8 34.1 79.1 201 214 A V - 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