==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 22-APR-09 3H5L . COMPND 2 MOLECULE: PUTATIVE BRANCHED-CHAIN AMINO ACID ABC . SOURCE 2 ORGANISM_SCIENTIFIC: RUEGERIA POMEROYI; . AUTHOR J.B.BONANNO,J.FREEMAN,K.T.BAIN,M.IIZUKA,P.SAMPATHKUMAR, . 799 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 561 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 88 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 45 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 268 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.8 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 0 0 0 2 0 6 0 2 0 6 2 0 2 0 0 1 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 4 4 4 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 PARALLEL BRIDGES PER LADDER . 4 0 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 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 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 41 A D 0 0 97 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.5 -4.7 130.9 -0.4 2 42 A P - 0 0 55 0, 0.0 2,-0.6 0, 0.0 42,-0.2 -0.248 360.0-123.2 -63.2 152.8 -3.9 127.9 1.8 3 43 A V E -a 44 0A 0 40,-2.8 42,-2.9 39,-0.0 2,-0.6 -0.906 25.3-146.0 -95.9 117.9 -2.2 128.4 5.2 4 44 A V E -a 45 0A 23 -2,-0.6 69,-2.6 67,-0.3 70,-0.8 -0.766 16.2-173.4 -91.0 119.5 1.0 126.4 5.2 5 45 A I E -ab 46 74A 0 40,-2.9 42,-2.4 -2,-0.6 2,-0.4 -0.966 9.4-153.2-111.6 129.2 1.9 125.0 8.6 6 46 A G E -ab 47 75A 0 68,-2.8 70,-2.8 -2,-0.5 42,-0.2 -0.826 6.1-164.8-104.2 140.7 5.3 123.2 9.0 7 47 A C E -a 48 0A 0 40,-2.6 42,-2.0 -2,-0.4 2,-0.7 -0.925 4.9-164.2-128.2 106.3 6.0 120.5 11.6 8 48 A P E +a 49 0A 0 0, 0.0 70,-0.4 0, 0.0 42,-0.2 -0.814 31.6 157.9 -86.6 116.3 9.6 119.5 12.4 9 49 A A E -a 50 0A 0 40,-2.4 42,-2.0 -2,-0.7 2,-1.5 -0.971 52.8-107.6-142.0 150.5 9.3 116.2 14.2 10 50 A P + 0 0 0 0, 0.0 9,-0.7 0, 0.0 10,-0.3 -0.638 46.4 161.4 -83.1 88.2 11.4 113.2 14.9 11 51 A L + 0 0 33 -2,-1.5 2,-0.3 8,-0.2 5,-0.1 0.610 66.0 32.6 -84.3 -16.1 9.7 110.7 12.5 12 52 A T S S+ 0 0 64 -3,-0.2 3,-0.3 3,-0.0 2,-0.1 -0.890 95.6 41.7-132.0 167.9 12.7 108.4 12.5 13 53 A G S > S- 0 0 48 -2,-0.3 3,-2.1 1,-0.2 4,-0.2 -0.396 107.4 -27.9 87.5-167.7 15.4 107.4 15.1 14 54 A I T 3 S+ 0 0 152 38,-0.3 3,-0.2 1,-0.3 -1,-0.2 0.720 139.5 37.6 -66.8 -23.1 15.2 106.7 18.8 15 55 A V T >> S+ 0 0 26 -3,-0.3 4,-1.9 1,-0.1 3,-0.5 0.027 76.2 123.4-113.1 29.4 12.1 108.9 19.5 16 56 A A H <> + 0 0 26 -3,-2.1 4,-2.6 1,-0.2 5,-0.2 0.833 67.3 64.6 -51.4 -38.7 10.2 108.1 16.2 17 57 A A H 3> S+ 0 0 75 -4,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.927 106.1 41.8 -59.9 -44.1 7.3 106.9 18.2 18 58 A D H <> S+ 0 0 26 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.912 111.9 54.8 -67.2 -41.7 6.7 110.4 19.7 19 59 A G H X S+ 0 0 0 -4,-1.9 4,-2.0 -9,-0.7 -8,-0.2 0.876 105.8 53.1 -58.2 -39.3 7.3 112.1 16.3 20 60 A I H X S+ 0 0 53 -4,-2.6 4,-2.3 -10,-0.3 -1,-0.2 0.877 109.2 49.3 -64.2 -37.9 4.6 109.9 14.7 21 61 A E H X S+ 0 0 17 -4,-1.3 4,-2.9 -5,-0.2 -2,-0.2 0.869 107.3 54.1 -71.3 -34.8 2.1 111.0 17.4 22 62 A F H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.907 110.5 47.4 -63.7 -39.0 3.0 114.6 16.9 23 63 A Q H X S+ 0 0 45 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.934 112.8 48.7 -63.6 -44.8 2.2 114.2 13.2 24 64 A R H X S+ 0 0 67 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.919 111.1 50.5 -62.8 -43.9 -1.1 112.3 14.0 25 65 A G H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.910 112.4 44.6 -61.6 -44.7 -2.1 115.0 16.5 26 66 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.871 112.0 53.6 -73.6 -32.1 -1.5 117.9 14.1 27 67 A Q H X S+ 0 0 63 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.914 108.6 49.6 -64.4 -42.2 -3.2 116.0 11.2 28 68 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.942 112.2 46.9 -64.0 -46.0 -6.4 115.5 13.4 29 69 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.928 112.1 50.9 -62.9 -41.9 -6.6 119.1 14.4 30 70 A A H X S+ 0 0 2 -4,-2.4 4,-2.8 1,-0.2 14,-0.3 0.921 110.4 49.5 -61.9 -41.2 -6.1 120.3 10.7 31 71 A D H X S+ 0 0 79 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.925 113.4 45.8 -63.5 -45.9 -8.8 117.9 9.6 32 72 A E H < S+ 0 0 65 -4,-2.5 4,-0.4 2,-0.2 -2,-0.2 0.906 116.3 44.7 -63.2 -45.7 -11.3 119.2 12.2 33 73 A I H ><>S+ 0 0 9 -4,-2.7 5,-2.3 1,-0.2 3,-1.1 0.890 112.9 51.4 -66.0 -42.5 -10.5 122.9 11.6 34 74 A N H ><5S+ 0 0 48 -4,-2.8 3,-1.9 -5,-0.3 -1,-0.2 0.796 97.1 67.5 -64.8 -29.8 -10.6 122.4 7.8 35 75 A A T 3<5S+ 0 0 86 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.677 104.6 45.3 -66.9 -18.4 -14.1 120.7 8.0 36 76 A V T < 5S- 0 0 124 -3,-1.1 -1,-0.3 -4,-0.4 5,-0.2 -0.061 139.6 -78.5-112.2 30.8 -15.4 124.2 9.1 37 77 A G T < 5 - 0 0 36 -3,-1.9 2,-0.3 4,-0.1 -3,-0.2 0.308 62.0-109.7 100.8 -5.0 -13.5 126.1 6.4 38 78 A G S S-F 42 0B 2 3,-2.9 3,-1.9 -2,-0.3 -2,-0.1 -0.876 136.7 -26.3 -99.5 106.2 -8.6 129.6 9.0 40 80 A L T 3 S- 0 0 100 -2,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.906 128.5 -48.7 54.7 42.5 -11.0 132.4 7.8 41 81 A G T 3 S+ 0 0 62 1,-0.2 -1,-0.3 -5,-0.2 -3,-0.1 0.387 115.1 120.2 79.3 -2.0 -11.9 130.1 4.9 42 82 A R B < -F 39 0B 68 -3,-1.9 -3,-2.9 -40,-0.1 -1,-0.2 -0.833 64.0-126.9 -97.2 119.4 -8.2 129.3 4.0 43 83 A P - 0 0 60 0, 0.0 -40,-2.8 0, 0.0 2,-0.4 -0.396 17.8-119.3 -69.5 146.0 -7.5 125.6 4.3 44 84 A I E -a 3 0A 9 -14,-0.3 2,-0.4 -42,-0.2 -40,-0.2 -0.698 26.9-165.1 -82.2 126.3 -4.6 124.4 6.5 45 85 A E E -a 4 0A 95 -42,-2.9 -40,-2.9 -2,-0.4 2,-0.5 -0.914 8.6-146.5-108.7 139.9 -1.9 122.5 4.6 46 86 A L E -a 5 0A 43 -2,-0.4 2,-0.4 -42,-0.2 -40,-0.2 -0.945 15.0-177.6-115.4 127.8 0.7 120.5 6.5 47 87 A V E -a 6 0A 36 -42,-2.4 -40,-2.6 -2,-0.5 2,-0.3 -0.965 12.9-155.1-119.4 138.7 4.3 120.0 5.5 48 88 A F E -a 7 0A 38 -2,-0.4 2,-0.4 -42,-0.2 -42,-0.0 -0.865 11.4-167.5-116.3 145.8 6.6 117.8 7.6 49 89 A A E -a 8 0A 2 -42,-2.0 -40,-2.4 -2,-0.3 2,-0.7 -0.999 21.9-135.0-128.9 128.8 10.4 117.6 8.1 50 90 A D E -a 9 0A 50 -2,-0.4 -2,-0.0 -42,-0.2 12,-0.0 -0.744 15.1-172.3 -85.4 112.2 12.0 114.6 9.8 51 91 A T > - 0 0 0 -42,-2.0 3,-2.4 -2,-0.7 -1,-0.1 0.433 32.3-137.2 -84.7 -0.8 14.6 115.7 12.3 52 92 A Q T 3 - 0 0 76 -43,-0.5 -38,-0.3 1,-0.3 3,-0.1 0.613 53.5 -73.7 61.5 22.8 15.6 112.0 12.7 53 93 A S T 3 S+ 0 0 15 1,-0.2 -1,-0.3 -40,-0.2 -39,-0.2 0.753 103.8 133.2 55.8 27.3 15.8 112.2 16.5 54 94 A K < - 0 0 103 -3,-2.4 27,-0.5 1,-0.2 -1,-0.2 -0.413 51.7 -97.5 -99.9 178.2 19.0 114.2 15.8 55 95 A G >> - 0 0 32 -2,-0.1 4,-2.5 -3,-0.1 3,-0.6 0.229 52.0 -53.1 -91.7-158.0 20.3 117.4 17.3 56 96 A V H 3> S+ 0 0 28 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.837 123.1 52.5 -50.4 -49.8 20.5 121.1 16.7 57 97 A D H 3> S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.900 115.7 42.2 -58.3 -42.2 22.1 121.3 13.3 58 98 A V H <> S+ 0 0 27 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.883 112.9 52.2 -74.6 -39.2 19.4 118.9 11.8 59 99 A V H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.938 112.5 46.2 -59.7 -47.7 16.5 120.6 13.7 60 100 A I H X S+ 0 0 26 -4,-2.9 4,-2.8 -5,-0.2 -2,-0.2 0.936 112.1 50.3 -60.7 -45.7 17.6 124.0 12.3 61 101 A Q H X S+ 0 0 128 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.891 113.0 47.6 -55.9 -43.6 18.1 122.6 8.7 62 102 A S H X S+ 0 0 10 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.913 112.8 46.7 -67.8 -45.7 14.6 121.0 9.0 63 103 A A H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.918 112.6 50.9 -62.4 -43.3 12.9 124.2 10.2 64 104 A Q H X S+ 0 0 90 -4,-2.8 4,-3.2 -5,-0.2 5,-0.4 0.890 108.0 52.5 -61.7 -42.0 14.7 126.3 7.6 65 105 A R H X>S+ 0 0 65 -4,-2.0 4,-2.2 1,-0.2 5,-1.5 0.914 105.3 54.8 -60.8 -44.2 13.5 123.9 4.8 66 106 A L H <5S+ 0 0 0 -4,-2.0 6,-2.3 3,-0.2 -1,-0.2 0.865 118.0 35.7 -59.4 -35.6 9.9 124.2 6.0 67 107 A I H X5S+ 0 0 4 -4,-1.6 4,-1.1 4,-0.2 -2,-0.2 0.948 125.2 36.6 -79.4 -52.5 10.2 128.0 5.6 68 108 A D H <5S+ 0 0 105 -4,-3.2 -3,-0.2 2,-0.2 -2,-0.2 0.880 131.0 26.7 -73.5 -44.8 12.4 128.4 2.6 69 109 A R T <5S+ 0 0 166 -4,-2.2 -3,-0.2 -5,-0.4 -1,-0.1 0.892 133.6 30.8 -87.2 -42.8 11.2 125.5 0.5 70 110 A D T 4 + 0 0 15 1,-0.1 4,-0.6 2,-0.1 3,-0.4 0.168 57.3 105.8-116.4 17.8 16.4 127.1 21.5 86 126 A A H > S+ 0 0 8 1,-0.2 4,-0.7 2,-0.1 3,-0.2 0.833 80.7 51.4 -66.4 -33.1 17.1 126.0 17.9 87 127 A L H > S+ 0 0 1 1,-0.2 4,-2.8 -3,-0.2 5,-0.3 0.744 89.6 78.1 -75.9 -25.6 13.8 127.4 16.6 88 128 A H H > S+ 0 0 0 -3,-0.4 4,-2.4 1,-0.2 5,-0.2 0.894 99.3 37.4 -61.8 -47.4 14.0 130.9 18.0 89 129 A D H X S+ 0 0 10 -4,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.840 115.1 55.3 -72.5 -34.5 16.4 132.5 15.5 90 130 A V H X S+ 0 0 13 -4,-0.7 4,-1.5 2,-0.2 -2,-0.2 0.957 114.2 40.9 -60.5 -50.3 15.0 130.5 12.5 91 131 A A H X>S+ 0 0 0 -4,-2.8 5,-2.1 2,-0.2 4,-0.7 0.933 117.2 47.7 -61.1 -48.0 11.5 132.0 13.3 92 132 A A H ><5S+ 0 0 15 -4,-2.4 3,-1.0 -5,-0.3 -2,-0.2 0.928 110.5 50.7 -63.4 -44.4 12.7 135.5 14.1 93 133 A D H 3<5S+ 0 0 84 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.827 116.7 41.1 -67.9 -27.6 14.9 135.7 11.0 94 134 A A H 3<5S- 0 0 4 -4,-1.5 223,-3.4 -5,-0.2 224,-0.3 0.399 107.7-122.8 -96.5 0.1 11.9 134.7 8.8 95 135 A G T <<5 + 0 0 0 -3,-1.0 227,-0.2 -4,-0.7 2,-0.2 0.835 68.9 126.9 60.7 34.6 9.3 136.7 10.6 96 136 A V < - 0 0 1 -5,-2.1 2,-0.4 -6,-0.2 -1,-0.2 -0.637 62.1-102.4-116.8 170.3 7.2 133.6 11.4 97 137 A I E -c 74 0A 0 -24,-1.4 -22,-2.5 -2,-0.2 2,-0.4 -0.786 29.3-170.0 -91.6 136.8 5.6 132.0 14.4 98 138 A A E -cd 75 121A 0 22,-2.6 24,-2.8 -2,-0.4 2,-0.4 -0.998 1.5-173.0-123.6 137.6 7.1 128.9 16.0 99 139 A M E +cd 76 122A 0 -24,-2.7 -22,-2.9 -2,-0.4 2,-0.3 -0.990 14.4 161.7-125.3 134.5 5.3 126.9 18.7 100 140 A H E - d 0 123A 0 22,-2.4 24,-2.1 -2,-0.4 25,-0.5 -0.978 39.5-149.3-146.8 162.1 7.0 124.0 20.6 101 141 A A + 0 0 1 -23,-3.2 22,-0.1 -2,-0.3 -23,-0.1 -0.334 46.5 138.1-122.6 49.2 6.7 121.9 23.7 102 142 A N - 0 0 19 -18,-0.2 -1,-0.1 2,-0.1 -23,-0.1 0.767 58.8-138.9 -62.7 -24.8 10.4 121.3 24.2 103 143 A T + 0 0 22 1,-0.2 25,-0.6 22,-0.1 2,-0.4 0.978 47.9 146.0 68.4 56.8 9.7 121.8 28.0 104 144 A V >> - 0 0 15 23,-0.2 3,-1.0 -20,-0.1 4,-0.9 -0.985 57.3-148.1-136.4 134.3 12.8 123.9 28.7 105 145 A A H 3> S+ 0 0 24 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.793 99.5 71.2 -62.8 -28.6 13.7 126.8 31.0 106 146 A V H 3> S+ 0 0 27 1,-0.2 4,-2.1 -23,-0.2 -1,-0.2 0.811 92.4 56.8 -62.0 -29.5 16.2 127.8 28.3 107 147 A H H <> S+ 0 0 0 -3,-1.0 4,-2.5 2,-0.2 5,-0.3 0.940 106.4 49.0 -60.3 -49.5 13.3 128.9 26.1 108 148 A D H X S+ 0 0 22 -4,-0.9 4,-2.4 1,-0.2 -2,-0.2 0.925 113.4 46.5 -56.8 -45.9 12.1 131.3 28.9 109 149 A E H X S+ 0 0 81 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.868 110.0 53.4 -70.4 -32.1 15.5 132.7 29.2 110 150 A M H X S+ 0 0 14 -4,-2.1 4,-0.7 2,-0.2 3,-0.3 0.945 111.4 44.6 -65.7 -49.9 16.0 133.1 25.4 111 151 A V H >< S+ 0 0 0 -4,-2.5 3,-1.2 1,-0.2 7,-0.3 0.940 114.2 50.4 -59.8 -44.7 12.7 135.1 25.0 112 152 A K H 3< S+ 0 0 77 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.765 101.4 64.4 -62.8 -26.8 13.6 137.2 28.1 113 153 A S H 3< S- 0 0 16 -4,-1.3 373,-0.3 -3,-0.3 -1,-0.2 0.693 129.6 -0.6 -70.5 -22.9 17.1 137.9 26.6 114 154 A D XX + 0 0 11 -3,-1.2 4,-2.4 -4,-0.7 3,-1.2 -0.295 69.0 169.2-164.3 69.4 15.6 139.8 23.7 115 155 A P T 34 S+ 0 0 59 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 0.805 78.7 60.5 -62.5 -27.9 11.8 139.9 23.8 116 156 A D T 34 S+ 0 0 103 1,-0.2 3,-0.3 2,-0.1 -5,-0.0 0.807 115.4 34.9 -67.4 -30.3 11.5 142.5 21.0 117 157 A R T <4 S+ 0 0 55 -3,-1.2 3,-0.4 -6,-0.2 2,-0.2 0.846 115.6 52.9 -88.6 -42.2 13.2 140.1 18.7 118 158 A Y >< + 0 0 7 -4,-2.4 3,-0.8 -7,-0.3 -1,-0.2 -0.138 66.7 125.5 -91.5 39.4 11.8 136.8 19.9 119 159 A W T 3 + 0 0 22 -3,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 0.642 69.3 56.1 -67.4 -17.7 8.1 137.9 19.7 120 160 A G T 3 S+ 0 0 4 -3,-0.4 -22,-2.6 -32,-0.1 2,-0.5 0.479 83.8 84.7 -99.2 -10.2 7.3 134.8 17.5 121 161 A T E < -d 98 0A 2 -3,-0.8 2,-0.4 -24,-0.2 -22,-0.2 -0.890 52.7-177.8-107.7 124.0 8.4 131.7 19.5 122 162 A F E -d 99 0A 0 -24,-2.8 -22,-2.4 -2,-0.5 2,-0.7 -0.946 22.7-149.3-123.9 138.3 6.0 130.2 22.0 123 163 A Q E -de 100 349A 0 225,-3.0 227,-1.2 -2,-0.4 -22,-0.2 -0.926 12.0-162.8-105.0 111.4 6.4 127.3 24.4 124 164 A Y S S+ 0 0 0 -24,-2.1 -23,-0.2 -2,-0.7 -1,-0.1 0.368 72.4 48.5 -91.2 8.3 2.9 125.9 24.8 125 165 A D S S- 0 0 5 -25,-0.5 225,-0.9 225,-0.1 -22,-0.1 -0.861 98.1 -93.4-122.4 170.6 3.7 123.9 27.9 126 166 A P - 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0 0 93 1,-0.1 -1,-0.3 32,-0.0 4,-0.2 -0.926 49.0-166.3-159.8 124.3 22.4 98.7 39.9 196 236 A W > + 0 0 2 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.260 59.5 114.8 -90.7 7.9 20.7 101.0 42.3 197 237 A G H > S+ 0 0 27 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.873 72.2 49.3 -47.6 -52.6 22.4 99.2 45.3 198 238 A P H > S+ 0 0 84 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.924 116.3 43.2 -57.7 -44.2 24.5 102.2 46.5 199 239 A T H > S+ 0 0 4 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.938 112.5 53.1 -65.2 -47.0 21.5 104.5 46.4 200 240 A L H X S+ 0 0 2 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.896 105.9 53.5 -57.7 -39.3 19.3 102.0 48.0 201 241 A A H X S+ 0 0 63 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.924 109.8 48.7 -62.0 -39.8 21.8 101.5 50.9 202 242 A K H X S+ 0 0 100 -4,-1.6 4,-0.8 1,-0.2 -2,-0.2 0.935 111.9 48.7 -65.2 -45.2 21.7 105.3 51.6 203 243 A L H >< S+ 0 0 3 -4,-2.5 3,-0.9 1,-0.2 -2,-0.2 0.927 113.0 46.7 -58.0 -47.3 17.9 105.4 51.5 204 244 A R H 3< S+ 0 0 73 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.827 107.8 56.4 -71.0 -30.3 17.6 102.4 53.9 205 245 A A H 3< S+ 0 0 89 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.693 127.4 19.2 -66.1 -19.7 20.2 103.9 56.3 206 246 A D S << S- 0 0 60 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 -0.443 85.7-150.2-153.1 66.5 18.0 107.0 56.5 207 247 A P - 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0 0 0 -3,-1.7 112,-2.6 111,-0.1 -1,-0.4 -0.373 44.2-147.3 -63.1 140.8 4.0 104.9 42.3 260 300 A T E +jK 238 370C 0 -23,-2.2 -21,-2.4 110,-0.2 2,-0.3 -0.805 22.7 162.1-108.5 156.4 3.2 108.5 41.4 261 301 A Y E - K 0 369C 10 108,-1.7 108,-2.9 -2,-0.3 2,-0.3 -0.910 12.9-160.8-159.1 174.6 4.1 110.4 38.2 262 302 A A E - K 0 368C 5 -23,-0.3 -21,-0.4 -2,-0.3 2,-0.3 -0.982 12.9-147.0-160.5 162.2 3.0 113.5 36.4 263 303 A T E - K 0 367C 48 104,-2.2 104,-1.7 -2,-0.3 3,-0.2 -0.993 14.2-147.8-138.2 144.4 2.8 115.6 33.3 264 304 A V S S+ 0 0 0 -2,-0.3 2,-0.3 1,-0.3 89,-0.1 0.521 96.9 31.2 -84.7 -9.9 2.8 119.4 32.8 265 305 A L S S+ 0 0 5 102,-0.1 2,-0.3 -140,-0.1 -1,-0.3 -0.851 83.0 133.5-149.1 110.6 0.6 119.0 29.7 266 306 A G - 0 0 6 72,-0.4 2,-0.3 99,-0.4 25,-0.1 -0.986 56.7 -80.6-153.4 165.8 -1.8 116.1 29.3 267 307 A T - 0 0 21 -2,-0.3 71,-0.2 1,-0.1 2,-0.1 -0.494 45.1-136.5 -67.3 126.7 -5.3 115.1 28.3 268 308 A L - 0 0 1 69,-2.3 71,-0.1 -2,-0.3 -1,-0.1 -0.331 8.0-131.7 -75.3 164.6 -7.8 115.7 31.0 269 309 A Q S S+ 0 0 62 117,-0.3 2,-0.1 4,-0.2 -1,-0.1 -0.085 71.8 106.9-112.8 31.9 -10.4 113.0 31.8 270 310 A D S > S- 0 0 40 67,-0.2 4,-3.1 1,-0.0 5,-0.3 -0.302 94.8 -78.6 -86.8-174.3 -13.4 115.3 31.9 271 311 A E H > S+ 0 0 176 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.929 132.0 44.4 -54.9 -49.0 -16.0 115.3 29.0 272 312 A M H > S+ 0 0 90 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.907 116.3 47.0 -65.9 -41.1 -13.9 117.3 26.6 273 313 A G H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.945 112.3 48.8 -66.0 -47.2 -10.7 115.3 27.4 274 314 A D H X S+ 0 0 86 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.896 108.9 54.9 -56.8 -41.4 -12.5 112.0 27.1 275 315 A A H X S+ 0 0 58 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.905 109.2 47.0 -61.9 -40.3 -13.9 113.1 23.8 276 316 A F H X S+ 0 0 7 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.937 112.5 48.4 -65.5 -47.6 -10.5 113.9 22.4 277 317 A A H X S+ 0 0 25 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.919 112.3 49.5 -61.8 -40.1 -9.0 110.7 23.5 278 318 A K H X S+ 0 0 168 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.936 113.4 45.4 -65.1 -45.5 -11.9 108.7 22.0 279 319 A A H X S+ 0 0 38 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.874 112.7 51.3 -64.9 -40.6 -11.6 110.4 18.7 280 320 A Y H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.917 111.4 46.9 -62.8 -43.2 -7.8 110.1 18.6 281 321 A K H X S+ 0 0 58 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.826 108.4 55.6 -72.3 -31.0 -8.0 106.3 19.3 282 322 A E H < S+ 0 0 157 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.873 114.9 40.2 -63.8 -38.8 -10.7 105.9 16.7 283 323 A R H < S+ 0 0 99 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.921 132.8 19.6 -74.5 -45.3 -8.4 107.5 14.1 284 324 A Y H < S- 0 0 44 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.466 110.2 -96.9-115.6 -2.5 -5.1 105.9 15.1 285 325 A G >< - 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