==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 23-MAY-05 2BSK . COMPND 2 MOLECULE: MITOCHONDRIAL IMPORT INNER MEMBRANE TRANSLOCASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.T.WEBB,M.A.GORMAN,M.LAZARUS,M.T.RYAN,J.M.GULBIS . 434 7 12 12 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25534.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 348 80.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 271 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 1 1 0 1 0 0 0 0 0 1 2 0 1 0 0 1 0 1 0 1 1 0 0 1 3 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 Q 0 0 134 0, 0.0 4,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -74.7 54.1 37.4 68.8 2 14 A F > + 0 0 139 2,-0.2 4,-1.7 1,-0.1 3,-0.2 0.652 360.0 66.9 -92.4 -23.8 51.3 36.5 66.4 3 15 A K H > S+ 0 0 39 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.961 90.3 61.3 -60.8 -53.2 53.8 36.7 63.5 4 16 A E H > S+ 0 0 65 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.835 105.8 48.6 -42.0 -43.0 55.8 33.7 64.8 5 17 A F H > S+ 0 0 94 -4,-0.4 4,-3.4 2,-0.2 -1,-0.3 0.935 112.6 44.5 -67.2 -48.9 52.6 31.6 64.3 6 18 A L H X S+ 0 0 31 -4,-1.7 4,-3.2 2,-0.2 5,-0.2 0.902 112.8 54.7 -62.6 -37.2 51.9 32.8 60.8 7 19 A G H X S+ 0 0 22 -4,-3.6 4,-1.4 2,-0.2 -2,-0.2 0.965 111.8 42.6 -57.7 -54.0 55.6 32.3 60.1 8 20 A T H >X S+ 0 0 57 -4,-2.7 3,-2.7 -5,-0.3 4,-1.8 0.992 113.0 54.7 -52.4 -66.2 55.4 28.8 61.3 9 21 A Y H >X S+ 0 0 30 -4,-3.4 3,-2.5 1,-0.3 4,-2.2 0.848 107.4 47.8 -30.2 -73.5 52.2 28.3 59.4 10 22 A N H 3X S+ 0 0 4 -4,-3.2 4,-1.5 1,-0.3 -1,-0.3 0.718 111.2 52.7 -44.4 -28.2 53.6 29.5 56.1 11 23 A K H X S+ 0 0 30 -4,-1.5 4,-1.9 -5,-0.2 3,-0.8 0.990 113.8 47.5 -56.0 -72.8 55.6 24.7 52.2 15 27 A T H 3X S+ 0 0 40 -4,-2.2 4,-1.3 1,-0.3 -2,-0.2 0.825 114.6 46.7 -42.1 -45.3 57.0 21.6 53.9 16 28 A a H 3X S+ 0 0 0 -4,-3.5 4,-1.9 2,-0.2 5,-0.3 0.899 110.8 55.8 -67.9 -34.0 53.7 19.7 53.6 17 29 A F H XX S+ 0 0 0 -4,-2.1 4,-2.0 -3,-0.8 3,-0.5 0.976 107.9 44.0 -57.6 -61.7 53.5 20.8 49.9 18 30 A L H 3< S+ 0 0 47 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.748 119.3 44.3 -57.4 -27.5 56.9 19.5 48.8 19 31 A D H 3< S+ 0 0 46 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.715 123.8 32.2 -91.8 -21.1 56.3 16.2 50.7 20 32 A b H << S+ 0 0 8 -4,-1.9 2,-0.2 -3,-0.5 -3,-0.2 0.896 102.1 67.1-100.6 -55.2 52.7 15.7 49.6 21 33 A V < + 0 0 1 -4,-2.0 3,-0.1 -5,-0.3 -1,-0.0 -0.510 51.0 140.9 -71.3 136.1 52.0 17.0 46.1 22 34 A K + 0 0 145 1,-0.3 2,-0.4 -2,-0.2 -1,-0.2 0.581 42.5 73.4-142.5 -45.4 53.8 15.2 43.3 23 35 A D - 0 0 68 1,-0.1 -1,-0.3 2,-0.0 7,-0.2 -0.668 49.8-173.1 -83.2 129.9 51.9 14.6 40.1 24 36 A F + 0 0 35 -2,-0.4 250,-0.1 1,-0.1 251,-0.1 -0.315 47.6 112.2-121.1 54.4 51.5 17.7 37.9 25 37 A T S S+ 0 0 79 249,-0.1 2,-0.2 246,-0.0 -1,-0.1 0.598 82.5 24.4 -96.0 -14.7 49.2 16.6 35.1 26 38 A T S S- 0 0 71 -3,-0.2 252,-0.2 2,-0.1 3,-0.0 -0.537 73.6-117.5-131.3-162.5 46.3 18.8 36.2 27 39 A R S S+ 0 0 143 -2,-0.2 2,-0.4 250,-0.1 -1,-0.0 0.458 85.1 88.8-118.9 -12.6 45.4 21.9 38.1 28 40 A E S S- 0 0 160 1,-0.1 2,-1.0 249,-0.0 -2,-0.1 -0.774 91.1-104.8 -95.9 130.2 43.3 20.2 40.9 29 41 A V - 0 0 27 -2,-0.4 5,-0.2 249,-0.1 -1,-0.1 -0.295 45.9-120.0 -53.7 93.5 44.9 18.9 44.0 30 42 A K > - 0 0 79 -2,-1.0 4,-2.2 -7,-0.2 3,-0.4 0.052 19.2-121.4 -32.4 141.2 44.8 15.2 43.2 31 43 A P H > S+ 0 0 99 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.856 108.2 58.9 -63.0 -38.5 42.7 13.4 45.9 32 44 A E H > S+ 0 0 149 1,-0.2 4,-1.1 2,-0.2 -2,-0.1 0.851 115.3 37.5 -60.3 -33.0 45.4 11.0 47.1 33 45 A E H > S+ 0 0 11 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.829 99.8 70.1 -88.0 -35.2 47.6 14.0 48.0 34 46 A T H X S+ 0 0 50 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.736 107.2 47.7 -54.3 -18.2 44.9 16.3 49.3 35 47 A T H X S+ 0 0 55 -4,-0.7 4,-2.4 2,-0.2 5,-0.3 0.924 103.0 54.6 -85.4 -58.8 45.0 13.7 52.1 36 48 A b H X S+ 0 0 19 -4,-1.1 4,-3.9 1,-0.2 5,-0.3 0.937 106.4 58.6 -40.2 -53.3 48.7 13.4 52.7 37 49 A S H X S+ 0 0 5 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.921 106.6 45.0 -40.3 -66.5 48.5 17.1 53.2 38 50 A E H X S+ 0 0 112 -4,-1.0 4,-2.7 1,-0.3 -1,-0.2 0.865 114.8 46.7 -48.0 -49.7 45.9 16.8 56.0 39 51 A H H X S+ 0 0 47 -4,-2.4 4,-3.0 1,-0.2 5,-0.4 0.943 112.7 51.8 -60.8 -43.6 47.8 14.0 57.7 40 52 A a H X S+ 0 0 0 -4,-3.9 4,-1.9 -5,-0.3 -2,-0.2 0.905 109.2 50.0 -58.3 -42.2 51.0 16.1 57.3 41 53 A L H X S+ 0 0 4 -4,-2.9 4,-2.1 -5,-0.3 -1,-0.2 0.956 118.8 37.7 -60.0 -52.1 49.3 19.0 58.9 42 54 A Q H X S+ 0 0 58 -4,-2.7 4,-2.5 2,-0.2 5,-0.4 0.999 114.0 52.5 -60.7 -69.3 48.1 16.9 61.9 43 55 A K H X S+ 0 0 3 -4,-3.0 4,-1.2 1,-0.2 -1,-0.2 0.791 111.7 52.1 -35.8 -40.2 51.2 14.8 62.2 44 56 A Y H >X S+ 0 0 24 -4,-1.9 4,-2.4 -5,-0.4 3,-0.8 0.981 108.7 43.7 -65.8 -62.5 53.1 18.0 62.3 45 57 A L H 3X S+ 0 0 42 -4,-2.1 4,-3.0 1,-0.3 5,-0.3 0.946 112.9 55.1 -47.7 -52.0 51.3 19.9 65.0 46 58 A K H 3X S+ 0 0 25 -4,-2.5 4,-1.9 1,-0.2 -1,-0.3 0.849 109.1 49.9 -50.5 -35.8 51.3 16.7 67.0 47 59 A M H X S+ 0 0 42 -4,-3.2 4,-1.8 -5,-0.2 3,-0.9 0.932 106.5 51.1 -42.3 -61.0 57.7 21.3 73.1 53 65 A M H >X S+ 0 0 103 -4,-2.5 3,-2.1 1,-0.3 4,-1.5 0.933 107.3 48.5 -41.9 -78.2 56.8 19.2 76.1 54 66 A R H 3< S+ 0 0 42 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.756 108.2 61.1 -37.6 -29.0 60.2 17.4 76.4 55 67 A F H XX S+ 0 0 31 -4,-1.9 4,-1.1 -3,-0.9 3,-1.1 0.940 107.7 40.1 -67.8 -46.0 61.6 20.9 76.1 56 68 A Q H XX S+ 0 0 128 -3,-2.1 3,-2.7 -4,-1.8 4,-2.0 0.999 108.4 60.7 -61.9 -60.3 59.9 22.0 79.2 57 69 A E H 3< S+ 0 0 94 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.558 104.6 55.5 -42.2 -5.8 60.7 18.7 80.9 58 70 A Y H <4 S+ 0 0 53 -3,-1.1 -1,-0.3 -5,-0.4 3,-0.2 0.764 109.6 40.3 -98.2 -37.0 64.2 19.9 80.2 59 71 A H H << S+ 0 0 66 -3,-2.7 3,-0.4 -4,-1.1 4,-0.3 0.874 115.0 49.9 -79.6 -39.5 64.0 23.2 82.0 60 72 A I S < S+ 0 0 89 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.394 115.4 46.9 -78.1 3.7 62.0 22.0 85.0 61 73 A Q S S+ 0 0 58 -5,-0.4 -1,-0.2 -3,-0.2 -2,-0.2 0.418 113.8 46.6-115.3 -14.0 64.7 19.3 85.1 62 74 A Q S S+ 0 0 97 -3,-0.4 -2,-0.2 -4,-0.2 -3,-0.2 0.320 111.2 54.2-106.8 -1.2 67.3 21.9 84.7 63 75 A N S >> S+ 0 0 116 -4,-0.3 3,-1.4 2,-0.1 4,-1.1 0.788 104.9 50.5 -97.6 -42.7 65.5 24.0 87.4 64 76 A E H 3> S+ 0 0 137 -4,-0.3 4,-1.4 1,-0.3 -2,-0.1 0.705 102.2 64.4 -67.7 -21.7 65.5 21.2 90.0 65 77 A A H 3> S+ 0 0 63 2,-0.2 4,-0.7 1,-0.2 -1,-0.3 0.533 98.3 53.2 -79.9 -8.9 69.2 20.8 89.4 66 78 A L H <> S+ 0 0 48 -3,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.796 103.4 58.0 -89.6 -36.4 69.9 24.3 90.7 67 79 A A H < S+ 0 0 61 -4,-1.1 -2,-0.2 2,-0.2 -3,-0.1 0.900 100.1 56.9 -57.5 -45.4 67.9 23.4 93.9 68 80 A A H >X S+ 0 0 70 -4,-1.4 3,-1.8 1,-0.2 4,-1.2 0.952 106.5 48.9 -51.8 -52.8 70.3 20.5 94.6 69 81 A K H >X S+ 0 0 172 -4,-0.7 3,-1.1 1,-0.3 2,-1.0 0.964 103.8 62.6 -50.1 -53.9 73.2 23.0 94.5 70 82 A A H 3< S+ 0 0 85 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.213 108.0 43.1 -59.3 18.1 71.1 25.1 96.9 71 83 A G H <4 S+ 0 0 57 -3,-1.8 -1,-0.2 -2,-1.0 -2,-0.2 0.568 88.2 76.9-135.3 -27.4 71.2 22.4 99.5 72 84 A L H << 0 0 100 -4,-1.2 -2,-0.1 -3,-1.1 -3,-0.1 0.797 360.0 360.0 -56.7 -28.5 74.8 21.0 99.6 73 85 A L < 0 0 130 -4,-0.8 -1,-0.3 0, 0.0 -4,-0.0 -0.595 360.0 360.0-131.1 360.0 75.6 24.2 101.6 74 !* 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 75 13 B L > 0 0 92 0, 0.0 4,-1.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -8.0 69.1 38.2 74.3 76 14 B E T 4 + 0 0 72 1,-0.2 5,-0.0 2,-0.2 0, 0.0 0.458 360.0 51.1 -75.0 0.1 68.9 34.6 75.5 77 15 B V T >> S+ 0 0 109 3,-0.1 4,-2.6 2,-0.1 3,-2.0 0.850 104.4 47.8-101.3 -54.0 65.3 34.6 74.1 78 16 B E T 34 S+ 0 0 109 1,-0.3 -2,-0.2 2,-0.2 -1,-0.0 0.781 121.6 42.1 -59.2 -24.8 65.6 35.8 70.6 79 17 B X T 3< S+ 0 0 43 -4,-1.1 4,-0.3 2,-0.1 -1,-0.3 0.114 113.6 50.3-109.9 19.3 68.5 33.4 70.2 80 18 B X T <> S+ 0 0 81 -3,-2.0 4,-1.5 2,-0.1 -2,-0.2 0.606 102.6 57.0-117.4 -44.6 66.9 30.5 72.1 81 19 B A H X S+ 0 0 54 -4,-2.6 4,-1.0 1,-0.2 -3,-0.1 0.558 106.4 60.3 -65.0 -5.1 63.6 30.4 70.2 82 20 B D H >> S+ 0 0 36 -5,-0.2 4,-2.6 2,-0.2 3,-0.6 0.935 100.5 44.9 -86.2 -61.0 66.0 30.0 67.3 83 21 B X H 3> S+ 0 0 4 -4,-0.3 4,-4.0 1,-0.3 -2,-0.2 0.765 110.7 62.1 -55.0 -21.8 67.7 26.8 68.2 84 22 B Y H 3X S+ 0 0 48 -4,-1.5 4,-2.9 2,-0.2 -1,-0.3 0.952 105.8 40.9 -68.3 -50.5 64.2 25.7 69.0 85 23 B N H X S+ 0 0 18 -4,-2.5 4,-2.0 -5,-0.2 3,-0.5 0.980 106.5 44.8 -65.0 -56.3 61.4 16.4 62.2 93 31 B R H 3< S+ 0 0 163 -4,-1.7 -2,-0.2 1,-0.2 3,-0.2 0.917 119.4 41.8 -51.8 -50.9 63.8 15.3 59.4 94 32 B K H 3< S+ 0 0 52 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.641 126.0 31.3 -75.6 -16.2 65.3 12.5 61.5 95 33 B d H << S+ 0 0 8 -4,-1.4 18,-0.2 -3,-0.5 -1,-0.2 0.442 109.4 62.4-123.5 0.1 62.2 11.2 63.1 96 34 B V < - 0 0 6 -4,-2.0 -1,-0.2 -3,-0.2 -52,-0.0 -0.913 64.8-151.3-135.5 110.7 59.4 11.8 60.6 97 35 B P > - 0 0 58 0, 0.0 3,-1.2 0, 0.0 2,-0.1 -0.584 25.2-120.6 -79.9 137.4 59.2 10.2 57.1 98 36 B P T 3 S+ 0 0 60 0, 0.0 -58,-0.1 0, 0.0 -5,-0.0 0.262 92.2 93.5 -58.8 8.2 57.4 12.1 54.3 99 37 B H T 3 - 0 0 152 -2,-0.1 -59,-0.1 -59,-0.0 -63,-0.0 0.800 59.6-172.7 -76.6 -27.1 54.9 9.2 53.7 100 38 B Y < + 0 0 5 -3,-1.2 -61,-0.2 1,-0.1 -60,-0.2 0.843 22.6 155.2 32.5 55.9 52.3 10.7 56.1 101 39 B K + 0 0 154 1,-0.2 2,-0.4 -62,-0.1 -1,-0.1 0.915 65.8 30.7 -73.1 -43.9 50.2 7.5 55.7 102 40 B E S S- 0 0 93 2,-0.1 -1,-0.2 -63,-0.1 4,-0.1 -0.950 74.4-137.0-122.3 139.9 48.5 8.1 59.1 103 41 B A S S+ 0 0 19 -2,-0.4 2,-0.4 -3,-0.1 -57,-0.2 0.268 79.5 69.5 -76.5 8.2 47.7 11.4 60.8 104 42 B E S S- 0 0 110 -62,-0.1 -2,-0.1 -58,-0.0 -61,-0.1 -0.985 93.5 -86.0-131.6 143.9 48.8 10.5 64.4 105 43 B L - 0 0 33 -2,-0.4 2,-0.2 1,-0.1 -2,-0.1 -0.084 40.6-122.7 -49.1 128.5 52.2 9.8 65.8 106 44 B S > - 0 0 42 1,-0.1 4,-4.1 -4,-0.1 5,-0.3 -0.475 21.2-118.6 -72.5 141.4 53.7 6.3 65.5 107 45 B K H > S+ 0 0 83 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.919 120.3 40.1 -42.1 -52.4 54.6 4.7 68.8 108 46 B G H >> S+ 0 0 41 2,-0.2 4,-2.7 1,-0.2 3,-0.7 0.964 111.7 53.8 -63.3 -54.7 58.1 4.6 67.5 109 47 B E H 3> S+ 0 0 35 1,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.890 107.4 55.6 -47.3 -40.4 58.0 8.0 65.9 110 48 B S H 3X S+ 0 0 17 -4,-4.1 4,-1.5 2,-0.2 -1,-0.3 0.904 111.1 42.0 -59.6 -44.4 57.0 9.2 69.3 111 49 B V H X S+ 0 0 36 -4,-2.9 3,-1.7 1,-0.2 4,-1.5 0.995 111.3 46.4 -58.1 -61.8 73.1 17.5 74.7 123 61 B I H 3X S+ 0 0 0 -4,-2.8 4,-0.6 1,-0.3 -1,-0.2 0.799 107.8 61.3 -49.9 -31.1 74.9 18.3 71.4 124 62 B H H 3X S+ 0 0 30 -4,-1.9 4,-1.0 -5,-0.3 -1,-0.3 0.837 107.3 41.4 -67.0 -34.6 73.8 21.9 71.8 125 63 B E H X S+ 0 0 78 -4,-1.4 3,-2.1 -3,-0.4 4,-0.6 0.887 105.5 58.9 -58.3 -39.3 84.0 28.9 74.9 133 71 B E H >X S+ 0 0 62 -4,-2.6 4,-2.4 1,-0.3 3,-1.4 0.935 105.1 49.0 -53.7 -48.5 87.1 26.9 75.8 134 72 B L H 3< S+ 0 0 66 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.197 101.4 64.5 -79.6 17.9 88.6 27.9 72.5 135 73 B S H <4 S+ 0 0 68 -3,-2.1 -1,-0.3 3,-0.1 -2,-0.2 0.490 114.3 30.5-111.4 -13.3 87.7 31.5 73.1 136 74 B X H X< S+ 0 0 152 -3,-1.4 3,-1.0 -4,-0.6 -2,-0.2 0.781 115.4 55.6-105.1 -59.4 90.0 31.7 76.1 137 75 B Q T 3< S+ 0 0 125 -4,-2.4 -3,-0.2 1,-0.3 -4,-0.1 0.861 101.6 60.5 -42.0 -50.6 92.7 29.3 75.2 138 76 B D T 3 0 0 79 -5,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.869 360.0 360.0 -48.4 -47.6 93.5 31.1 72.0 139 77 B E < 0 0 204 -3,-1.0 -2,-0.2 -4,-0.1 -1,-0.1 0.956 360.0 360.0 -57.0 360.0 94.4 34.3 73.7 140 !* 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 0.0 141 9 C D 0 0 137 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 57.4 52.9 48.9 142 ! 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 0.0 143 10 C Q > 0 0 86 0, 0.0 3,-0.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -2.7 61.1 53.4 47.0 144 11 C I G > + 0 0 113 1,-0.2 3,-1.0 2,-0.2 4,-0.2 0.746 360.0 60.8 -80.7 -26.0 63.4 51.8 49.6 145 12 C K G 3 S+ 0 0 69 1,-0.3 -1,-0.2 2,-0.2 4,-0.0 0.250 105.4 52.2 -82.8 13.3 60.9 48.9 50.1 146 13 C Q G < S+ 0 0 63 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.337 108.5 48.1-121.0 -9.0 61.7 48.3 46.4 147 14 C F S < S+ 0 0 96 -3,-1.0 4,-0.4 2,-0.2 -2,-0.2 0.229 108.2 55.6-112.9 3.4 65.4 48.4 47.1 148 15 C K S > S+ 0 0 124 -4,-0.2 4,-0.9 2,-0.1 -3,-0.1 0.675 112.4 41.7-101.9 -33.8 65.0 46.0 50.0 149 16 C E H > S+ 0 0 57 3,-0.2 4,-2.0 2,-0.2 5,-0.3 0.707 114.5 54.9 -84.5 -27.1 63.3 43.5 47.7 150 17 C F H > S+ 0 0 77 2,-0.2 4,-2.5 3,-0.2 5,-0.2 0.930 112.0 37.5 -66.6 -87.8 65.8 44.1 44.9 151 18 C L H > S+ 0 0 25 -4,-0.4 4,-2.7 1,-0.2 5,-0.2 0.769 119.6 53.4 -29.5 -45.9 69.0 43.5 46.8 152 19 C G H X S+ 0 0 19 -4,-0.9 4,-2.6 2,-0.2 5,-0.2 0.993 111.4 40.8 -57.4 -71.7 67.2 40.6 48.6 153 20 C T H X S+ 0 0 73 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.907 112.7 59.3 -40.6 -53.6 65.9 38.8 45.5 154 21 C Y H >X S+ 0 0 29 -4,-2.5 4,-2.2 -5,-0.3 3,-1.3 0.940 108.1 42.1 -42.8 -67.9 69.3 39.5 43.9 155 22 C N H 3X S+ 0 0 4 -4,-2.7 4,-2.3 1,-0.3 -1,-0.3 0.904 111.6 57.8 -46.3 -45.3 71.2 37.6 46.6 156 23 C K H 3X S+ 0 0 62 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.3 0.865 112.5 40.9 -53.9 -37.8 68.5 35.0 46.4 157 24 C L H > - 0 0 96 -2,-1.2 3,-2.2 -7,-0.2 4,-1.4 -0.192 19.5-126.8 -42.2 131.2 84.5 26.6 33.5 176 43 C P H 3> S+ 0 0 95 0, 0.0 4,-1.1 0, 0.0 5,-0.2 0.736 109.5 67.4 -59.6 -25.8 82.4 27.8 30.4 177 44 C E H 3> S+ 0 0 64 1,-0.2 4,-0.6 2,-0.2 -2,-0.1 0.652 110.6 38.3 -67.8 -13.5 80.1 24.8 30.7 178 45 C E H <> S+ 0 0 8 -3,-2.2 4,-1.9 2,-0.2 5,-0.3 0.676 104.5 66.7-104.0 -31.3 79.1 26.7 34.0 179 46 C T H X S+ 0 0 25 -4,-1.4 4,-0.7 -5,-0.2 -2,-0.2 0.730 110.2 38.9 -65.6 -19.3 79.2 30.2 32.6 180 47 C T H X S+ 0 0 69 -4,-1.1 4,-1.8 2,-0.2 5,-0.3 0.868 108.6 57.4 -97.1 -43.5 76.3 29.3 30.4 181 48 C f H >X S+ 0 0 20 -4,-0.6 4,-2.8 -5,-0.2 3,-1.1 0.970 113.3 43.1 -47.0 -60.7 74.2 27.2 32.8 182 49 C S H 3X S+ 0 0 6 -4,-1.9 4,-2.9 1,-0.3 5,-0.3 0.935 107.2 57.9 -53.9 -53.4 74.1 30.1 35.2 183 50 C E H 3X S+ 0 0 109 -4,-0.7 4,-0.7 -5,-0.3 -1,-0.3 0.805 112.6 42.1 -52.0 -26.7 73.5 32.7 32.6 184 51 C H H X S+ 0 0 18 -4,-3.3 4,-3.2 -5,-0.5 3,-1.0 0.985 109.2 42.1 -57.8 -70.2 64.5 32.4 36.7 190 57 C L H 3X S+ 0 0 46 -4,-1.5 4,-1.2 1,-0.3 -2,-0.2 0.907 114.2 52.6 -46.7 -49.4 63.3 35.9 36.0 191 58 C K H 3X S+ 0 0 40 -4,-3.0 4,-1.9 2,-0.2 -1,-0.3 0.872 115.1 44.4 -59.2 -30.1 61.1 34.6 33.2 192 59 C M H X S+ 0 0 0 -4,-2.3 3,-3.9 2,-0.2 4,-1.6 0.986 108.6 44.7 -52.7 -75.8 54.2 32.9 38.5 197 64 C S H 3X S+ 0 0 46 -4,-1.0 4,-1.3 1,-0.3 -2,-0.2 0.846 105.3 60.5 -33.8 -60.6 53.1 36.4 39.3 198 65 C M H 3< S+ 0 0 110 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.786 113.2 41.7 -41.9 -30.0 50.9 36.6 36.2 199 66 C R H X< S+ 0 0 49 -3,-3.9 3,-2.6 -4,-1.0 -1,-0.3 0.846 105.3 57.7 -88.1 -41.3 49.1 33.6 37.8 200 67 C F H 3X S+ 0 0 28 -4,-1.6 4,-0.8 1,-0.3 3,-0.5 0.596 102.1 64.1 -65.5 -6.0 49.0 34.8 41.4 201 68 C Q T 3< S+ 0 0 88 -4,-1.3 4,-0.3 -5,-0.4 -1,-0.3 0.346 86.6 64.6 -98.9 4.1 47.2 37.7 39.8 202 69 C E T <4 S+ 0 0 109 -3,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.101 101.8 56.3-106.0 17.2 44.3 35.6 38.6 203 70 C Y T 4 S+ 0 0 84 -3,-0.5 4,-0.4 3,-0.1 -2,-0.2 0.702 112.3 35.5-109.7 -47.9 43.7 35.1 42.4 204 71 C H S < S+ 0 0 123 -4,-0.8 4,-0.2 1,-0.1 -2,-0.1 0.594 124.8 44.2 -85.4 -12.3 43.4 38.8 43.3 205 72 C I S > S+ 0 0 84 -4,-0.3 4,-0.9 2,-0.2 3,-0.3 0.733 100.0 65.0-102.3 -29.2 41.7 39.7 40.1 206 73 C Q T 4 S+ 0 0 70 1,-0.2 -2,-0.1 2,-0.2 -1,-0.1 0.719 107.5 46.1 -66.4 -19.5 39.2 36.9 39.8 207 74 C Q T >> S+ 0 0 113 -4,-0.4 4,-1.0 1,-0.1 3,-0.9 0.652 101.6 62.9 -96.5 -20.2 37.5 38.2 42.9 208 75 C N H 3> S+ 0 0 59 -3,-0.3 4,-1.2 1,-0.2 -2,-0.2 0.698 89.1 69.1 -78.6 -17.9 37.5 41.9 41.9 209 76 C E H 3< S+ 0 0 72 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.587 107.7 41.2 -72.9 -8.2 35.2 41.1 39.0 210 77 C A H <> S+ 0 0 58 -3,-0.9 4,-2.0 2,-0.1 3,-0.2 0.654 113.8 48.6-106.7 -30.2 32.6 40.4 41.8 211 78 C L H < S+ 0 0 99 -4,-1.0 -2,-0.2 2,-0.2 -3,-0.2 0.563 108.3 55.8 -86.6 -8.8 33.5 43.3 44.0 212 79 C A T < S+ 0 0 64 -4,-1.2 -1,-0.2 -5,-0.1 -3,-0.1 0.402 107.9 52.7 -95.1 -3.1 33.3 45.5 40.9 213 80 C A T >> S+ 0 0 51 -3,-0.2 3,-2.8 2,-0.2 4,-1.0 0.811 99.9 54.4 -96.1 -47.2 29.8 43.9 40.8 214 81 C K T 3< S+ 0 0 139 -4,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.477 107.0 60.4 -66.7 6.3 28.8 44.9 44.3 215 82 C A T 34 S+ 0 0 55 -5,-0.1 4,-0.4 2,-0.1 3,-0.4 0.591 94.2 62.2-102.7 -18.9 29.9 48.2 42.8 216 83 C G T <4 S+ 0 0 26 -3,-2.8 -2,-0.2 1,-0.2 -3,-0.1 0.780 86.3 68.2 -80.0 -28.4 27.2 48.0 40.1 217 84 C L S < S+ 0 0 146 -4,-1.0 -1,-0.2 3,-0.0 -2,-0.1 0.743 109.7 37.4 -63.1 -22.4 24.1 48.0 42.3 218 85 C L S S+ 0 0 142 -3,-0.4 -2,-0.1 -4,-0.1 -3,-0.1 0.829 117.2 7.8 -92.8 -98.5 24.9 51.6 43.2 219 86 C G 0 0 54 -4,-0.4 -3,-0.0 0, 0.0 -4,-0.0 0.772 360.0 360.0 -58.6-124.0 26.3 54.2 40.9 220 87 C Q 0 0 223 -5,-0.0 -4,-0.0 0, 0.0 -3,-0.0 -0.136 360.0 360.0 47.7 360.0 26.7 53.6 37.2 221 !* 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 0.0 222 1 D X 0 0 220 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-176.6 44.0 61.7 71.6 223 2 D D - 0 0 133 4,-0.0 2,-0.3 3,-0.0 0, 0.0 -0.937 360.0 -82.9 171.3 173.5 45.1 59.1 69.0 224 3 D P - 0 0 82 0, 0.0 3,-0.3 0, 0.0 4,-0.2 -0.779 18.5-144.2-100.4 147.8 43.6 56.8 66.3 225 4 D L S > S+ 0 0 120 -2,-0.3 4,-1.1 1,-0.2 3,-0.4 0.402 87.3 90.3 -86.9 4.5 42.2 53.4 67.1 226 5 D R H > + 0 0 147 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.935 63.8 73.8 -62.9 -53.1 43.7 52.4 63.8 227 6 D A H > S+ 0 0 71 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.840 102.1 47.6 -28.6 -49.6 47.0 51.3 65.1 228 7 D Q H > S+ 0 0 63 -3,-0.4 4,-0.8 -4,-0.2 -1,-0.2 0.990 119.0 34.8 -58.5 -67.1 45.1 48.3 66.5 229 8 D Q H < S+ 0 0 80 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.601 113.5 62.2 -66.8 -13.3 43.2 47.4 63.3 230 9 D L H >< S+ 0 0 112 -4,-3.5 3,-3.8 1,-0.2 -1,-0.2 0.978 94.3 57.3 -75.3 -59.2 46.0 48.4 61.1 231 10 D A H >< S+ 0 0 56 -4,-1.9 3,-2.4 1,-0.3 -1,-0.2 0.785 88.6 80.4 -38.5 -31.6 48.5 45.8 62.4 232 11 D A T >< S+ 0 0 67 -4,-0.8 3,-0.7 1,-0.3 -1,-0.3 0.607 72.8 79.6 -54.8 -9.6 45.8 43.4 61.3 233 12 D E T X> + 0 0 80 -3,-3.8 3,-3.7 1,-0.2 4,-0.6 0.429 52.6 109.6 -80.4 2.4 47.3 43.9 57.9 234 13 D L H <> + 0 0 48 -3,-2.4 4,-0.7 1,-0.3 -1,-0.2 0.636 59.9 83.2 -52.1 -9.7 50.1 41.5 58.8 235 14 D E H X> S+ 0 0 125 -3,-0.7 4,-2.1 1,-0.2 3,-0.5 0.926 91.0 48.6 -59.9 -38.5 48.2 39.4 56.2 236 15 D V H <> S+ 0 0 84 -3,-3.7 4,-1.8 1,-0.2 3,-0.3 0.961 107.9 48.7 -65.9 -54.6 50.3 41.4 53.8 237 16 D E H 3X S+ 0 0 119 -4,-0.6 4,-0.8 1,-0.2 -1,-0.2 0.572 118.4 46.5 -63.9 -5.7 53.7 41.0 55.3 238 17 D X H X S+ 0 0 48 -4,-1.8 4,-2.3 2,-0.2 3,-0.7 0.994 109.4 44.3 -62.2 -71.9 54.8 38.1 51.0 241 20 D D H 3X S+ 0 0 46 -4,-0.8 4,-2.0 1,-0.3 -2,-0.2 0.842 118.6 44.3 -37.7 -49.7 56.5 35.4 53.0 242 21 D X H 3X S+ 0 0 7 -4,-3.2 4,-2.7 1,-0.2 -1,-0.3 0.895 109.1 58.5 -66.5 -37.4 54.1 32.9 51.7 243 22 D Y H X S+ 0 0 99 -4,-2.3 4,-2.0 2,-0.2 3,-1.3 0.984 111.9 52.3 -51.5 -71.1 58.3 33.7 48.3 245 24 D R H 3X S+ 0 0 51 -4,-2.0 4,-2.1 1,-0.3 5,-0.2 0.829 110.3 47.6 -28.0 -67.1 57.9 30.2 49.7 246 25 D X H 3X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.3 0.867 111.5 52.1 -48.0 -43.6 55.5 29.2 47.0 247 26 D T H - 0 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4,-2.1 1,-0.2 3,-1.2 0.972 120.1 42.5 -48.9 -64.7 56.6 24.6 27.2 267 46 D G H 3>>S+ 0 0 27 1,-0.3 4,-3.6 2,-0.3 5,-0.5 0.928 105.3 63.0 -47.4 -56.0 55.8 22.2 30.0 268 47 D E H 3>5S+ 0 0 24 1,-0.3 4,-2.5 2,-0.2 -1,-0.3 0.856 110.1 42.1 -37.5 -42.8 58.0 24.1 32.4 269 48 D S H X S+ 0 0 18 -4,-0.8 4,-1.9 -3,-0.5 3,-0.9 0.964 113.1 46.8 -77.5 -67.5 47.7 26.7 41.3 278 57 D K H 3X S+ 0 0 7 -4,-3.0 4,-2.5 1,-0.3 5,-0.3 0.865 110.0 56.2 -41.8 -46.4 48.0 23.5 43.4 279 58 D Y H 3X S+ 0 0 0 -4,-3.6 4,-1.8 -5,-0.3 -1,-0.3 0.916 106.8 48.6 -56.1 -46.6 50.1 25.3 45.9 280 59 D L H XX S+ 0 0 24 -4,-1.0 4,-2.2 -3,-0.9 3,-0.7 0.982 113.1 47.7 -54.4 -61.3 47.5 28.0 46.5 281 60 D D H >X S+ 0 0 41 -4,-1.9 4,-2.1 1,-0.3 3,-1.4 0.948 111.8 48.2 -43.1 -69.9 44.7 25.3 47.0 282 61 D I H 3X S+ 0 0 2 -4,-2.5 4,-1.9 1,-0.3 -1,-0.3 0.787 111.7 53.2 -45.1 -30.2 46.8 23.2 49.4 283 62 D H H X S+ 0 0 17 -4,-2.2 4,-2.0 1,-0.2 3,-0.6 0.934 111.3 60.6 -43.9 -51.8 41.7 22.8 58.7 290 69 D L H 3< S+ 0 0 18 -4,-2.5 -1,-0.2 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