==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 03-SEP-12 4GX0 . COMPND 2 MOLECULE: TRKA DOMAIN PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACTER SULFURREDUCENS; . AUTHOR C.KONG,W.ZENG,S.YE,L.CHEN,D.B.SAUER,Y.LAM,M.G.DEREBE,Y.JIANG . 1844 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 89115.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1340 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 192 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 130 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 140 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 685 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 53 2.9 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 9 5 4 9 0 11 3 3 11 2 10 0 0 0 1 4 0 0 0 0 0 0 0 0 0 0 4 RESIDUES PER ALPHA HELIX . 2 0 12 28 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 . 4 1 3 0 6 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 2 6 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 18 A Q 0 0 182 0, 0.0 4,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 150.0 -40.9 -27.6 72.1 2 19 A N > + 0 0 65 2,-0.1 4,-1.0 3,-0.1 5,-0.1 0.528 360.0 69.4-106.5 -12.2 -43.0 -30.1 70.1 3 20 A L H > S+ 0 0 107 2,-0.2 4,-2.4 3,-0.1 5,-0.3 0.876 97.4 50.3 -75.3 -38.8 -40.3 -32.7 69.6 4 21 A K H > S+ 0 0 153 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.964 110.4 47.4 -65.1 -53.6 -40.1 -33.8 73.3 5 22 A V H > S+ 0 0 90 -4,-0.4 4,-0.9 1,-0.2 -1,-0.2 0.845 113.8 53.0 -54.8 -34.2 -43.9 -34.4 73.7 6 23 A L H >X S+ 0 0 86 -4,-1.0 4,-1.7 2,-0.2 3,-0.7 0.977 114.6 34.7 -68.0 -58.7 -43.7 -36.3 70.4 7 24 A L H 3X S+ 0 0 94 -4,-2.4 4,-1.4 1,-0.3 -2,-0.2 0.697 112.5 62.2 -75.1 -17.6 -41.0 -38.8 71.1 8 25 A L H 3X S+ 0 0 119 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.3 0.785 104.4 49.8 -70.2 -28.2 -42.1 -39.0 74.7 9 26 A Y H S+ 0 0 35 -4,-2.6 4,-2.9 2,-0.2 5,-0.7 0.915 111.2 56.0 -68.7 -44.0 -52.4 -65.2 79.0 28 45 A M H X5S+ 0 0 0 -4,-2.8 6,-2.7 -5,-0.2 4,-0.9 0.877 116.1 38.5 -55.3 -38.8 -51.7 -67.6 76.1 29 46 A W H X5S+ 0 0 142 -4,-2.0 4,-1.8 4,-0.3 -2,-0.2 0.965 122.7 37.3 -77.9 -55.4 -49.8 -69.8 78.5 30 47 A H H <5S+ 0 0 113 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.777 126.0 38.1 -72.2 -26.4 -52.0 -69.6 81.7 31 48 A L H <5S+ 0 0 75 -4,-2.9 -3,-0.2 -5,-0.3 -1,-0.2 0.838 136.7 10.5 -90.7 -37.5 -55.3 -69.6 79.8 32 49 A E H < - 0 0 34 -2,-0.4 4,-1.5 1,-0.1 5,-0.1 -0.109 31.6-104.9 -68.7 173.3 -41.8 -66.5 71.9 38 55 A F H > S+ 0 0 99 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.925 122.8 49.8 -65.9 -45.5 -41.0 -62.8 72.6 39 56 A M H > S+ 0 0 37 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.880 106.8 56.8 -60.6 -38.2 -41.0 -61.9 68.9 40 57 A A H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.895 107.7 47.7 -59.9 -40.8 -44.3 -63.7 68.5 41 58 A G H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.875 112.9 46.7 -69.7 -40.5 -45.8 -61.5 71.2 42 59 A I H X S+ 0 0 19 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.941 113.3 50.8 -62.1 -48.3 -44.4 -58.3 69.6 43 60 A Y H X S+ 0 0 1 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.857 112.8 45.4 -59.0 -40.2 -45.6 -59.5 66.2 44 61 A W H X S+ 0 0 10 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.906 112.8 49.6 -70.3 -43.2 -49.1 -60.2 67.5 45 62 A T H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.919 113.6 45.4 -65.8 -43.1 -49.4 -56.9 69.4 46 63 A I H X S+ 0 0 25 -4,-2.8 4,-2.1 1,-0.2 6,-0.4 0.898 111.3 54.8 -62.4 -41.0 -48.3 -54.9 66.4 47 64 A T H <>S+ 0 0 6 -4,-1.7 6,-1.8 -5,-0.3 5,-0.8 0.836 115.0 38.9 -62.7 -35.1 -50.6 -56.9 64.2 48 65 A V H ><5S+ 0 0 20 -4,-2.0 3,-1.3 3,-0.2 -2,-0.2 0.933 118.4 43.2 -81.3 -51.3 -53.6 -56.1 66.5 49 66 A M H 3<5S+ 0 0 24 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.856 114.1 51.2 -67.0 -35.3 -52.9 -52.4 67.3 50 67 A T T 3<5S- 0 0 12 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.484 110.7-130.0 -77.6 -3.3 -52.0 -51.6 63.8 51 68 A T T < 5S+ 0 0 69 -3,-1.3 -3,-0.2 -5,-0.1 -4,-0.1 0.627 70.7 128.6 63.6 17.4 -55.3 -53.3 62.9 52 69 A L < - 0 0 6 -5,-0.8 -4,-0.2 -6,-0.4 -5,-0.1 1.000 44.4-169.8 -61.6 -64.6 -53.6 -55.4 60.3 53 70 A G + 0 0 42 -6,-1.8 -5,-0.1 -9,-0.1 -9,-0.0 0.888 18.5 177.7 78.6 49.7 -55.2 -58.5 61.8 54 71 A F - 0 0 8 1,-0.1 -10,-0.0 -10,-0.1 380,-0.0 0.811 25.4-149.9 -48.8 -38.2 -53.5 -61.5 60.2 55 72 A G + 0 0 46 2,-0.2 3,-0.2 1,-0.1 -1,-0.1 0.514 61.6 120.4 79.1 1.8 -55.6 -63.9 62.3 56 73 A D S S+ 0 0 54 1,-0.3 2,-0.4 0, 0.0 -1,-0.1 0.706 79.4 42.2 -70.7 -18.8 -52.9 -66.5 62.4 57 74 A I S S+ 0 0 6 -13,-0.1 2,-0.3 2,-0.0 -1,-0.3 -0.881 76.3 150.7-132.8 101.4 -52.8 -66.2 66.1 58 75 A T - 0 0 77 -2,-0.4 2,-0.1 -3,-0.2 7,-0.1 -0.917 40.1-117.9-127.4 153.7 -56.2 -65.8 68.0 59 76 A F - 0 0 6 -2,-0.3 3,-0.0 5,-0.2 -31,-0.0 -0.338 11.6-162.4 -77.7 169.4 -57.4 -66.8 71.4 60 77 A E + 0 0 151 -2,-0.1 2,-0.3 0, 0.0 -1,-0.1 0.388 65.0 81.7-129.9 -6.8 -60.3 -69.3 71.9 61 78 A S S > S- 0 0 33 1,-0.1 4,-2.3 0, 0.0 3,-0.3 -0.725 83.0-119.4-102.0 153.1 -61.2 -68.4 75.5 62 79 A D H > S+ 0 0 133 -2,-0.3 4,-2.7 1,-0.2 5,-0.1 0.884 114.7 52.8 -56.1 -43.5 -63.5 -65.5 76.6 63 80 A A H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.853 109.8 50.1 -62.9 -34.2 -60.8 -63.9 78.7 64 81 A G H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.878 108.8 51.3 -69.5 -39.7 -58.5 -64.0 75.6 65 82 A Y H X S+ 0 0 120 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.923 109.8 50.6 -59.8 -45.6 -61.3 -62.4 73.6 66 83 A L H X S+ 0 0 105 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.956 112.4 45.6 -57.4 -53.3 -61.6 -59.7 76.2 67 84 A F H X S+ 0 0 17 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.916 111.5 52.6 -57.2 -45.6 -57.9 -59.0 76.1 68 85 A A H X S+ 0 0 25 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.882 109.5 50.1 -58.1 -39.8 -57.8 -59.1 72.3 69 86 A S H X S+ 0 0 71 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.875 108.1 53.0 -65.1 -39.8 -60.7 -56.5 72.3 70 87 A I H X S+ 0 0 78 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.881 110.6 46.0 -64.9 -40.9 -58.8 -54.2 74.8 71 88 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.883 110.1 54.6 -70.8 -38.7 -55.6 -54.2 72.6 72 89 A T H X S+ 0 0 59 -4,-1.9 4,-1.3 -5,-0.2 -2,-0.2 0.941 111.6 44.0 -57.0 -49.1 -57.7 -53.5 69.5 73 90 A V H X S+ 0 0 80 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.875 109.3 57.1 -66.1 -38.6 -59.3 -50.5 71.0 74 91 A S H X S+ 0 0 10 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.876 105.9 51.0 -57.3 -40.0 -56.0 -49.3 72.4 75 92 A G H X S+ 0 0 1 -4,-2.0 4,-0.9 2,-0.2 5,-0.3 0.823 111.6 47.3 -69.3 -31.6 -54.6 -49.3 68.9 76 93 A V H X S+ 0 0 55 -4,-1.3 4,-1.7 3,-0.2 -2,-0.2 0.919 116.9 41.8 -75.4 -45.0 -57.5 -47.2 67.7 77 94 A I H X>S+ 0 0 70 -4,-2.8 5,-2.7 1,-0.2 4,-0.6 0.936 123.9 35.5 -66.6 -48.2 -57.4 -44.7 70.5 78 95 A F H <5S+ 0 0 48 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.559 130.7 29.8 -88.8 -8.8 -53.6 -44.3 70.6 79 96 A L H <5S+ 0 0 42 -4,-0.9 -3,-0.2 -5,-0.2 -2,-0.2 0.592 128.6 32.9-121.5 -19.4 -52.9 -44.6 66.9 80 97 A D H <5S+ 0 0 100 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.1 0.348 131.3 21.7-120.9 2.7 -56.0 -43.3 65.1 81 98 A I T X5S+ 0 0 87 -4,-0.6 4,-2.8 -5,-0.1 5,-0.3 0.555 123.9 38.0-132.0 -64.6 -57.1 -40.6 67.5 82 99 A I H > S+ 0 0 60 -6,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.946 118.1 30.2 -61.7 -50.8 -51.7 -39.4 67.2 84 101 A P H > S+ 0 0 61 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.945 119.1 53.0 -74.2 -49.1 -53.6 -37.2 64.7 85 102 A F H X S+ 0 0 130 -4,-2.8 4,-2.2 2,-0.2 5,-0.2 0.861 113.8 47.7 -51.8 -36.5 -55.5 -35.1 67.3 86 103 A G H X S+ 0 0 21 -4,-2.1 4,-3.7 -5,-0.3 5,-0.4 0.989 107.6 54.4 -63.9 -62.7 -52.0 -34.6 68.7 87 104 A F H X>S+ 0 0 49 -4,-2.6 4,-2.2 -5,-0.2 5,-1.0 0.870 117.0 36.4 -31.9 -60.5 -50.5 -33.7 65.3 88 105 A V H X>S+ 0 0 61 -4,-2.7 4,-0.9 1,-0.2 5,-0.7 0.937 123.6 40.0 -69.3 -48.7 -53.1 -31.0 64.7 89 106 A S H <5S+ 0 0 64 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.711 117.5 52.6 -74.1 -20.3 -53.4 -29.6 68.2 90 107 A M H <5S- 0 0 41 -4,-3.7 -2,-0.2 -5,-0.2 -3,-0.2 0.935 135.7 -11.1 -82.1 -50.7 -49.7 -29.9 68.8 91 108 A F H X5S+ 0 0 64 -4,-2.2 4,-0.6 -5,-0.4 -3,-0.2 0.470 124.4 66.8-136.0 -4.8 -48.2 -28.1 65.8 92 109 A L H X>X S+ 0 0 39 -4,-0.6 4,-1.0 1,-0.2 3,-0.8 0.914 104.2 41.1 -57.8 -47.7 -49.2 -22.7 62.5 96 113 A I H S+ 0 0 74 -4,-0.8 4,-1.7 -3,-0.7 5,-0.7 0.903 112.7 54.0 -67.9 -41.2 -52.5 -20.7 62.4 97 114 A E H 3<5S+ 0 0 122 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.442 122.3 29.6 -76.5 2.0 -51.6 -18.5 65.3 98 115 A R H <45S+ 0 0 161 -3,-0.8 -1,-0.2 -4,-0.4 5,-0.2 0.377 129.5 31.4-139.2 -0.6 -48.3 -17.5 63.6 99 116 A R H <5S+ 0 0 115 -4,-1.0 -3,-0.2 -3,-0.4 3,-0.2 0.514 122.0 39.7-135.5 -16.0 -49.0 -17.7 59.9 100 117 A L T <5S+ 0 0 29 -4,-1.7 2,-0.3 -5,-0.4 -3,-0.2 0.532 125.7 33.5-108.2 -14.5 -52.7 -16.8 59.4 101 118 A R S - 0 0 78 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.162 42.0-111.8 -51.8 147.4 -36.2 -14.7 75.8 110 127 A D T 3 S+ 0 0 132 1,-0.3 -2,-0.1 -3,-0.1 64,-0.0 0.819 114.0 48.6 -50.1 -40.2 -35.0 -14.5 79.4 111 128 A D T 3 S+ 0 0 136 2,-0.1 2,-0.3 67,-0.0 -1,-0.3 0.177 74.5 136.4 -96.2 17.7 -31.4 -15.2 78.6 112 129 A T < + 0 0 17 -3,-1.8 2,-0.3 -4,-0.0 66,-0.1 -0.511 30.6 169.5 -67.2 124.3 -31.0 -12.7 75.8 113 130 A R + 0 0 199 -2,-0.3 66,-0.2 1,-0.1 25,-0.1 -0.979 45.3 21.4-141.5 151.3 -27.7 -10.9 76.2 114 131 A G S S+ 0 0 35 64,-2.3 24,-0.4 -2,-0.3 65,-0.2 0.658 81.4 145.0 70.8 18.1 -25.3 -8.5 74.4 115 132 A H - 0 0 0 63,-0.2 65,-2.7 60,-0.2 66,-0.9 -0.474 48.0-129.3 -87.4 159.1 -28.1 -7.2 72.2 116 133 A I E -bc 139 181A 0 22,-2.1 24,-2.2 64,-0.2 2,-0.3 -0.925 18.1-147.6-111.4 108.9 -28.4 -3.7 70.8 117 134 A L E -bc 140 182A 0 64,-1.7 66,-2.9 -2,-0.6 2,-0.5 -0.595 9.9-160.3 -73.7 129.0 -31.9 -2.1 71.4 118 135 A I E -bc 141 183A 0 22,-3.4 24,-3.1 -2,-0.3 2,-0.6 -0.959 5.4-170.3-111.3 122.0 -32.9 0.4 68.6 119 136 A F E +bc 142 184A 0 64,-2.6 66,-2.6 -2,-0.5 24,-0.1 -0.945 68.9 20.4-112.8 115.8 -35.7 2.9 69.5 120 137 A G S S- 0 0 17 22,-1.0 -1,-0.2 -2,-0.6 2,-0.2 0.861 78.3-144.6 91.9 80.9 -37.0 4.8 66.5 121 138 A I + 0 0 18 21,-0.3 -1,-0.0 -3,-0.2 3,-0.0 -0.539 36.9 136.0 -79.3 141.3 -36.2 3.0 63.2 122 139 A D > - 0 0 41 -2,-0.2 4,-2.9 1,-0.0 5,-0.3 -0.939 69.1 -67.8-167.0-179.1 -35.4 5.1 60.1 123 140 A P H > S+ 0 0 50 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.884 129.1 50.2 -53.6 -40.3 -32.9 5.3 57.2 124 141 A I H > S+ 0 0 18 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.969 116.4 37.9 -62.0 -55.6 -30.1 6.1 59.5 125 142 A T H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.782 115.1 56.0 -68.3 -26.4 -30.6 3.3 62.0 126 143 A R H X S+ 0 0 69 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.893 108.6 46.9 -70.5 -39.9 -31.6 1.0 59.1 127 144 A T H X S+ 0 0 9 -4,-2.3 4,-0.6 -5,-0.3 -2,-0.2 0.792 108.4 57.6 -69.5 -29.9 -28.3 1.7 57.5 128 145 A L H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 3,-0.4 0.922 106.8 48.0 -64.1 -46.1 -26.6 1.1 60.9 129 146 A I H < S+ 0 0 8 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.944 112.6 45.6 -61.2 -51.9 -28.0 -2.4 61.1 130 147 A R H < S+ 0 0 123 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.618 112.7 55.7 -70.5 -10.0 -27.1 -3.5 57.6 131 148 A K H >< S+ 0 0 63 -4,-0.6 3,-0.5 -3,-0.4 -1,-0.2 0.887 108.0 41.8 -89.6 -44.6 -23.6 -2.0 58.2 132 149 A L T 3<>S+ 0 0 3 -4,-2.0 5,-0.9 1,-0.2 3,-0.3 -0.007 82.1 112.3 -92.0 30.3 -22.5 -3.8 61.3 133 150 A E T > 5 + 0 0 104 -3,-0.3 3,-0.8 1,-0.2 -1,-0.2 0.803 69.8 57.9 -73.4 -29.9 -24.0 -7.1 60.0 134 151 A S T < 5S+ 0 0 81 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.746 99.0 58.9 -73.4 -23.9 -20.5 -8.7 59.7 135 152 A R T 3 5S- 0 0 119 -3,-0.3 -1,-0.3 -4,-0.1 -2,-0.2 0.615 105.9-139.2 -75.1 -12.9 -19.9 -8.2 63.4 136 153 A N T < 5 + 0 0 145 -3,-0.8 2,-0.2 -4,-0.2 -3,-0.2 0.890 36.3 169.1 53.5 49.6 -23.1 -10.3 63.8 137 154 A H < - 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0 0 68 1,-0.1 4,-2.2 25,-0.0 -2,-0.2 -0.965 67.6-156.1-121.8 116.8 -37.9 14.2 50.4 318 422 A D H > S+ 0 0 12 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.860 93.7 50.9 -59.9 -41.9 -35.2 12.6 48.2 319 423 A S H > S+ 0 0 4 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.888 110.4 50.2 -64.0 -38.4 -37.3 12.7 45.0 320 424 A T H > S+ 0 0 24 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.908 111.0 50.3 -65.7 -40.1 -38.1 16.4 45.5 321 425 A N H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.901 110.3 49.2 -60.5 -43.7 -34.4 16.9 46.1 322 426 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.922 111.8 49.1 -63.2 -43.8 -33.5 15.1 42.9 323 427 A F H X S+ 0 0 5 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.926 111.3 48.6 -61.6 -46.9 -36.1 17.1 40.9 324 428 A L H X S+ 0 0 5 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.892 110.2 52.3 -62.1 -40.5 -34.8 20.5 42.3 325 429 A T H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.923 110.5 48.2 -60.7 -46.0 -31.3 19.5 41.4 326 430 A L H X S+ 0 0 9 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.956 113.1 47.1 -54.8 -55.1 -32.3 18.7 37.9 327 431 A A H X S+ 0 0 21 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.904 114.8 46.9 -57.7 -44.2 -34.2 22.0 37.5 328 432 A C H X S+ 0 0 3 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.963 112.0 47.6 -63.4 -53.9 -31.3 23.9 39.0 329 433 A R H < S+ 0 0 45 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.786 112.9 53.2 -58.6 -25.8 -28.6 22.3 36.8 330 434 A H H < S+ 0 0 87 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.895 112.0 41.8 -75.8 -41.3 -30.9 22.9 33.9 331 435 A L H < S+ 0 0 84 -4,-2.1 2,-0.4 1,-0.3 -2,-0.2 0.806 131.0 23.4 -75.0 -31.2 -31.3 26.6 34.6 332 436 A H < - 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0 0 68 -2,-0.3 4,-2.0 1,-0.1 5,-0.1 -0.216 32.1-104.5 -70.8 166.1 -44.1 -66.4 42.9 415 55 B F H > S+ 0 0 105 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.912 123.4 52.6 -54.9 -44.4 -43.3 -62.8 42.2 416 56 B M H > S+ 0 0 118 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.905 106.0 52.3 -61.9 -42.6 -47.0 -62.0 42.1 417 57 B A H > S+ 0 0 16 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.889 108.0 54.0 -59.9 -38.9 -47.6 -63.6 45.4 418 58 B G H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.954 111.9 41.9 -59.0 -53.6 -44.8 -61.4 46.8 419 59 B I H X S+ 0 0 19 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.957 115.4 52.3 -56.1 -52.1 -46.4 -58.2 45.5 420 60 B Y H X S+ 0 0 79 -4,-3.3 4,-2.1 1,-0.2 -2,-0.2 0.904 112.6 43.6 -52.0 -50.7 -49.8 -59.5 46.7 421 61 B W H X S+ 0 0 4 -4,-3.2 4,-1.6 2,-0.2 -1,-0.2 0.951 114.3 49.7 -60.1 -51.2 -48.6 -60.2 50.2 422 62 B T H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 3,-0.4 0.921 113.2 45.3 -58.1 -49.0 -46.7 -56.9 50.5 423 63 B I H X S+ 0 0 79 -4,-3.1 4,-2.0 1,-0.2 6,-0.3 0.906 110.0 57.6 -57.1 -42.3 -49.6 -54.8 49.3 424 64 B T H <>S+ 0 0 8 -4,-2.1 6,-2.2 -5,-0.3 5,-1.5 0.799 115.8 35.0 -60.1 -31.1 -51.8 -56.9 51.7 425 65 B V H ><5S+ 0 0 0 -4,-1.6 3,-2.1 -3,-0.4 -2,-0.2 0.921 116.5 48.2 -90.3 -54.5 -49.6 -55.9 54.7 426 66 B M H 3<5S+ 0 0 18 -4,-2.9 -3,-0.2 1,-0.3 -2,-0.2 0.869 115.9 47.9 -53.8 -37.1 -48.5 -52.3 53.9 427 67 B T T 3<5S- 0 0 69 -4,-2.0 -1,-0.3 -5,-0.4 -2,-0.2 0.475 111.8-127.1 -84.0 -4.3 -52.2 -51.6 53.1 428 68 B T T < 5S+ 0 0 38 -3,-2.1 -3,-0.2 -5,-0.1 -4,-0.1 0.711 72.3 125.5 64.3 26.9 -53.2 -53.3 56.4 429 69 B L < - 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