==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 18-OCT-07 2VEB . COMPND 2 MOLECULE: PROTOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOSARCINA ACETIVORANS; . AUTHOR M.NARDINI,A.PESCE,L.THIJS,J.A.SAITO,S.DEWILDE,M.ALAM, . 190 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10536.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 143 75.3 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 . 2 1.1 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 0.5 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 . 5 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 52.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 2 0 2 0 0 0 0 1 0 1 2 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 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 . 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 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 6 A I > 0 0 100 0, 0.0 3,-2.2 0, 0.0 82,-0.0 0.000 360.0 360.0 360.0 106.0 14.4 48.5 24.0 2 7 A P T 3 + 0 0 95 0, 0.0 85,-0.1 0, 0.0 3,-0.1 -0.255 360.0 8.5 -55.9 132.4 15.6 51.9 23.2 3 8 A G T 3 S+ 0 0 28 1,-0.2 2,-0.7 120,-0.0 121,-0.0 0.301 90.3 130.6 85.4 -8.6 13.0 54.0 21.2 4 9 A Y < + 0 0 37 -3,-2.2 -1,-0.2 1,-0.1 83,-0.0 -0.709 21.7 163.9 -84.1 113.6 10.2 51.5 21.7 5 10 A T > + 0 0 38 -2,-0.7 3,-2.2 -3,-0.1 4,-0.2 0.031 7.9 157.8-123.7 27.2 7.2 53.5 23.0 6 11 A Y T 3 S+ 0 0 25 1,-0.3 98,-0.1 2,-0.2 97,-0.1 -0.265 75.6 8.5 -55.0 130.0 4.3 51.1 22.4 7 12 A G T 3 S+ 0 0 53 96,-0.5 -1,-0.3 95,-0.1 97,-0.1 0.518 123.4 69.2 78.5 5.3 1.4 52.0 24.7 8 13 A E < + 0 0 110 -3,-2.2 -2,-0.2 95,-0.1 -1,-0.1 0.080 53.1 107.5-145.3 25.7 3.0 55.3 25.9 9 14 A T - 0 0 35 -4,-0.2 3,-0.1 2,-0.1 -3,-0.1 0.801 66.9-149.1 -69.1 -26.3 3.1 57.6 22.9 10 15 A E + 0 0 165 1,-0.2 2,-0.5 0, 0.0 -1,-0.1 0.701 61.1 114.8 57.7 24.6 0.3 59.7 24.7 11 16 A N - 0 0 74 95,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.977 64.6-138.3-126.0 119.9 -0.9 60.5 21.2 12 17 A R - 0 0 182 -2,-0.5 4,-0.1 -3,-0.1 91,-0.1 -0.643 28.9-122.5 -76.2 124.1 -4.3 59.4 19.9 13 18 A A - 0 0 9 -2,-0.4 93,-0.1 89,-0.3 -1,-0.1 -0.166 17.9-114.1 -61.3 157.4 -4.0 58.2 16.3 14 19 A P S S+ 0 0 57 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.380 101.1 66.6 -75.0 3.5 -6.2 59.9 13.6 15 20 A F - 0 0 4 87,-0.1 -2,-0.2 90,-0.1 2,-0.2 -0.967 68.3-167.2-125.5 145.8 -7.9 56.5 13.2 16 21 A N > - 0 0 80 -2,-0.4 4,-2.3 -4,-0.1 5,-0.1 -0.454 43.0 -78.3-120.2-172.1 -10.1 54.7 15.7 17 22 A L H > S+ 0 0 93 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.787 126.4 55.0 -68.0 -28.1 -11.7 51.3 16.4 18 23 A E H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.932 108.3 48.8 -68.3 -43.8 -14.5 51.9 13.8 19 24 A D H > S+ 0 0 73 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.920 112.4 49.8 -56.1 -44.2 -11.8 52.7 11.2 20 25 A L H X S+ 0 0 6 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.909 106.5 54.5 -64.1 -40.7 -10.1 49.5 12.2 21 26 A K H X S+ 0 0 115 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.935 111.4 45.1 -56.4 -46.7 -13.2 47.4 12.0 22 27 A L H X S+ 0 0 87 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.859 113.2 49.8 -68.4 -36.5 -13.8 48.6 8.4 23 28 A L H X S+ 0 0 52 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.905 108.7 52.4 -69.1 -40.2 -10.2 48.0 7.5 24 29 A K H X>S+ 0 0 44 -4,-3.0 5,-2.4 1,-0.2 4,-0.6 0.905 108.4 52.1 -58.8 -39.5 -10.3 44.5 9.0 25 30 A E H ><5S+ 0 0 115 -4,-2.0 3,-0.9 -5,-0.2 -2,-0.2 0.928 108.3 50.8 -63.8 -40.3 -13.4 43.7 6.9 26 31 A A H 3<5S+ 0 0 81 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.845 114.5 42.5 -67.5 -34.9 -11.6 44.9 3.7 27 32 A V H 3<5S- 0 0 31 -4,-1.9 -1,-0.3 2,-0.1 -2,-0.2 0.410 112.6-119.1 -90.9 0.6 -8.5 42.7 4.4 28 33 A M T <<5 + 0 0 143 -3,-0.9 2,-0.5 -4,-0.6 -3,-0.2 0.782 57.0 157.3 68.3 31.5 -10.8 39.7 5.5 29 34 A F < + 0 0 11 -5,-2.4 -1,-0.2 -6,-0.2 2,-0.2 -0.778 12.2 162.7 -91.2 126.1 -9.3 39.6 9.0 30 35 A T >> - 0 0 76 -2,-0.5 4,-1.9 -5,-0.0 3,-0.6 -0.699 57.7 -80.0-130.2-178.9 -11.7 37.9 11.5 31 36 A A H 3> S+ 0 0 67 1,-0.2 4,-2.1 -2,-0.2 5,-0.1 0.802 126.5 63.0 -55.3 -30.3 -11.6 36.3 15.0 32 37 A E H 3> S+ 0 0 115 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.922 103.8 46.6 -61.8 -42.3 -10.3 33.2 13.2 33 38 A D H <> S+ 0 0 11 -3,-0.6 4,-2.9 2,-0.2 5,-0.3 0.868 107.8 56.4 -69.3 -35.4 -7.2 35.1 12.2 34 39 A E H X S+ 0 0 73 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.936 107.7 49.7 -57.9 -44.3 -6.8 36.6 15.7 35 40 A E H X S+ 0 0 68 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.940 116.6 40.1 -57.7 -49.0 -6.7 33.0 17.0 36 41 A Y H X S+ 0 0 42 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.822 110.2 54.8 -80.6 -29.2 -4.1 31.9 14.6 37 42 A I H X S+ 0 0 4 -4,-2.9 4,-0.6 1,-0.2 -1,-0.2 0.887 109.7 51.4 -67.4 -34.4 -1.9 34.9 14.6 38 43 A Q H >X S+ 0 0 93 -4,-1.8 3,-0.7 -5,-0.3 4,-0.6 0.858 106.4 52.8 -68.3 -36.2 -1.7 34.4 18.4 39 44 A K H 3X S+ 0 0 80 -4,-1.5 4,-1.1 1,-0.2 3,-0.3 0.827 98.8 63.7 -68.7 -29.7 -0.7 30.8 17.9 40 45 A A H 3X S+ 0 0 0 -4,-1.6 4,-2.9 1,-0.2 5,-0.3 0.792 89.7 76.9 -59.5 -28.4 2.1 32.0 15.7 41 46 A G H X S+ 0 0 1 -4,-2.9 3,-2.1 1,-0.2 4,-0.5 0.663 93.2 92.6 -89.7 -19.3 8.0 32.5 16.2 45 50 A E G >< S+ 0 0 119 -4,-2.0 3,-0.7 1,-0.3 -1,-0.2 0.844 94.1 37.0 -44.3 -50.8 9.2 33.6 19.7 46 51 A D G 34 S+ 0 0 129 -4,-0.5 -1,-0.3 -3,-0.2 3,-0.2 0.466 114.5 57.7 -84.5 -2.2 12.5 31.6 19.6 47 52 A Q G <> + 0 0 38 -3,-2.1 4,-2.2 1,-0.1 3,-0.4 0.350 68.5 105.5-110.3 3.3 13.1 32.3 15.9 48 53 A V H S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.906 111.5 46.3 -66.9 -39.7 16.9 36.5 15.4 50 55 A E H > S+ 0 0 119 -3,-0.4 4,-1.7 2,-0.2 -2,-0.2 0.859 111.2 52.6 -69.9 -36.0 16.9 34.1 12.4 51 56 A I H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.952 111.2 46.1 -63.5 -49.2 13.9 35.9 10.9 52 57 A L H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.853 107.1 57.9 -64.2 -33.3 15.7 39.3 11.2 53 58 A D H X S+ 0 0 76 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.902 109.7 46.2 -57.3 -41.4 18.8 37.7 9.7 54 59 A T H X S+ 0 0 56 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.948 116.4 42.6 -66.5 -48.8 16.7 36.9 6.7 55 60 A W H X S+ 0 0 9 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.921 117.0 45.5 -67.6 -47.1 15.1 40.3 6.4 56 61 A Y H X S+ 0 0 33 -4,-3.1 4,-3.0 1,-0.2 -1,-0.2 0.836 110.8 56.4 -64.5 -30.5 18.3 42.3 7.0 57 62 A G H X S+ 0 0 41 -4,-1.6 4,-1.4 -5,-0.3 -2,-0.2 0.914 108.2 46.9 -63.4 -44.8 20.0 39.9 4.6 58 63 A F H < S+ 0 0 79 -4,-2.1 3,-0.4 2,-0.2 4,-0.3 0.948 116.0 43.8 -62.1 -50.8 17.5 40.8 1.9 59 64 A V H >< S+ 0 0 16 -4,-2.5 3,-1.6 1,-0.2 7,-0.7 0.947 113.5 52.0 -59.1 -47.4 17.8 44.6 2.6 60 65 A G H 3< S+ 0 0 38 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.723 103.3 57.3 -65.5 -23.4 21.6 44.4 2.8 61 66 A S T 3< S+ 0 0 78 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.482 99.3 66.5 -88.3 -1.7 22.0 42.6 -0.5 62 67 A H X> - 0 0 76 -3,-1.6 4,-2.8 -4,-0.3 3,-2.4 -0.904 67.2-159.9-122.0 101.2 20.2 45.4 -2.4 63 68 A P H 3> S+ 0 0 103 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.832 93.1 56.4 -49.6 -36.4 22.0 48.8 -2.4 64 69 A H H 34 S+ 0 0 152 2,-0.2 4,-0.1 1,-0.2 -5,-0.1 0.640 115.1 38.1 -73.9 -14.2 18.8 50.7 -3.2 65 70 A L H X4 S+ 0 0 23 -3,-2.4 3,-1.9 -6,-0.3 4,-0.2 0.796 111.9 54.2 -97.4 -44.3 17.1 49.2 -0.1 66 71 A L H >< S+ 0 0 35 -4,-2.8 3,-2.5 -7,-0.7 4,-0.2 0.820 91.7 82.3 -58.5 -28.1 20.1 49.4 2.2 67 72 A Y G >< S+ 0 0 113 -4,-1.8 3,-1.9 -5,-0.3 62,-0.4 0.795 78.4 65.0 -37.3 -43.1 20.2 53.0 1.1 68 73 A Y G < S+ 0 0 37 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.644 105.2 43.2 -68.0 -13.5 17.5 53.8 3.7 69 74 A F G < S+ 0 0 30 -3,-2.5 8,-2.6 -4,-0.2 -1,-0.3 0.199 94.5 116.9-107.6 7.3 19.8 52.9 6.6 70 75 A T B < -A 76 0A 11 -3,-1.9 59,-0.5 6,-0.3 -3,-0.0 -0.477 62.4-126.3 -86.4 150.3 22.9 54.7 5.2 71 76 A S > - 0 0 28 4,-3.0 3,-2.5 -2,-0.2 57,-0.2 -0.409 45.2 -93.1 -72.8 165.0 24.9 57.6 6.5 72 77 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 56,-0.1 0.833 125.6 63.9 -52.7 -32.3 25.3 60.6 4.1 73 78 A D T 3 S- 0 0 118 2,-0.1 -3,-0.0 1,-0.1 0, 0.0 0.444 119.4-108.5 -75.1 -0.2 28.6 59.1 2.9 74 79 A G S < S+ 0 0 50 -3,-2.5 -1,-0.1 1,-0.3 -4,-0.1 0.355 81.1 120.6 93.9 -4.4 26.7 56.1 1.5 75 80 A T S S- 0 0 72 1,-0.1 -4,-3.0 -5,-0.0 -1,-0.3 -0.658 73.5 -96.3 -93.1 149.5 27.9 53.6 4.1 76 81 A P B -A 70 0A 42 0, 0.0 2,-0.9 0, 0.0 -6,-0.3 -0.366 31.3-127.4 -62.9 137.9 25.4 51.7 6.3 77 82 A N > - 0 0 27 -8,-2.6 4,-2.5 1,-0.2 5,-0.2 -0.792 22.4-166.7 -85.6 105.4 24.9 53.3 9.7 78 83 A E H > S+ 0 0 127 -2,-0.9 4,-2.3 1,-0.2 5,-0.2 0.851 84.6 54.0 -66.9 -33.2 25.6 50.3 12.0 79 84 A K H > S+ 0 0 158 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.921 110.8 47.5 -63.9 -44.7 24.2 52.0 15.1 80 85 A Y H > S+ 0 0 15 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.955 111.7 49.5 -62.4 -51.8 20.9 52.7 13.2 81 86 A L H X S+ 0 0 19 -4,-2.5 4,-2.2 -12,-0.2 -1,-0.2 0.908 113.2 46.7 -53.8 -45.4 20.7 49.2 11.9 82 87 A A H X S+ 0 0 55 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.898 112.9 47.3 -69.6 -40.1 21.2 47.6 15.3 83 88 A A H X S+ 0 0 22 -4,-2.3 4,-1.1 1,-0.2 3,-0.2 0.905 114.4 46.8 -68.3 -42.0 18.7 49.9 17.2 84 89 A V H X S+ 0 0 28 -4,-2.6 4,-2.8 -5,-0.2 3,-0.4 0.904 104.4 62.9 -65.8 -39.0 16.0 49.4 14.5 85 90 A R H X S+ 0 0 55 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.864 100.3 52.4 -55.2 -40.2 16.6 45.6 14.6 86 91 A K H X S+ 0 0 128 -4,-1.3 4,-1.5 1,-0.2 -1,-0.3 0.876 113.4 43.3 -65.0 -39.0 15.6 45.4 18.3 87 92 A R H X S+ 0 0 30 -4,-1.1 4,-1.9 -3,-0.4 -2,-0.2 0.849 113.2 51.3 -73.8 -34.3 12.3 47.2 17.5 88 93 A F H X S+ 0 0 52 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.913 108.8 52.2 -69.0 -40.8 11.6 45.2 14.3 89 94 A S H >X S+ 0 0 22 -4,-2.5 4,-1.1 -5,-0.3 3,-0.5 0.933 110.0 48.8 -56.3 -48.0 12.2 42.0 16.3 90 95 A R H 3X S+ 0 0 82 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.856 102.5 62.4 -64.4 -36.8 9.7 43.1 18.9 91 96 A W H 3X S+ 0 0 22 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.847 97.3 58.1 -58.3 -35.7 7.2 44.0 16.2 92 97 A I H S- 0 0 66 -2,-1.8 4,-2.4 -81,-0.0 5,-0.2 -0.346 75.9 -70.6-115.9-166.0 -7.0 48.0 20.2 102 107 A Q H > S+ 0 0 34 1,-0.2 4,-2.6 2,-0.2 -89,-0.3 0.889 130.9 53.9 -65.1 -37.6 -6.5 51.8 20.4 103 108 A A H > S+ 0 0 32 2,-0.2 4,-1.8 1,-0.2 -96,-0.5 0.921 109.4 50.4 -59.7 -41.2 -3.0 51.5 21.9 104 109 A W H > S+ 0 0 3 -5,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.934 110.3 48.8 -61.7 -46.2 -2.1 49.3 19.0 105 110 A L H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.886 107.3 55.7 -60.8 -38.9 -3.5 51.8 16.5 106 111 A D H X S+ 0 0 22 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.875 109.5 46.2 -64.4 -33.8 -1.6 54.6 18.3 107 112 A Y H X S+ 0 0 11 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.845 107.1 58.2 -77.0 -29.9 1.7 52.7 17.7 108 113 A Q H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.909 106.4 49.4 -59.8 -44.8 0.7 52.0 14.1 109 114 A Y H X S+ 0 0 48 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.943 110.8 50.1 -58.9 -47.1 0.6 55.7 13.6 110 115 A E H X S+ 0 0 12 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.895 109.0 50.9 -57.9 -45.3 4.0 56.1 15.2 111 116 A I H X S+ 0 0 21 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.923 110.3 49.6 -62.9 -43.0 5.6 53.4 13.0 112 117 A G H >X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 3,-0.6 0.936 109.4 52.1 -58.4 -46.1 4.2 55.1 9.9 113 118 A L H 3< S+ 0 0 15 -4,-2.5 6,-2.2 1,-0.2 7,-0.6 0.838 106.2 55.0 -57.0 -35.3 5.6 58.4 11.1 114 119 A R H 3< S+ 0 0 33 -4,-1.7 7,-0.3 5,-0.2 -1,-0.2 0.744 109.2 45.3 -76.2 -24.7 9.0 56.8 11.6 115 120 A H H << S+ 0 0 54 -4,-1.4 17,-2.0 -3,-0.6 -1,-0.2 0.805 108.3 71.6 -78.6 -34.9 9.2 55.6 8.0 116 121 A H S >X S- 0 0 29 -4,-2.0 4,-2.4 -5,-0.2 3,-1.0 -0.344 100.5-105.2 -76.8 159.7 8.0 58.9 6.7 117 122 A R T 34 S+ 0 0 145 1,-0.2 -1,-0.1 2,-0.2 -4,-0.1 0.748 109.9 79.8 -59.2 -20.0 10.1 62.1 6.8 118 123 A T T 34 S- 0 0 69 1,-0.2 -1,-0.2 65,-0.1 -4,-0.1 0.911 120.6 -2.9 -54.7 -46.8 8.0 63.3 9.7 119 124 A K T X> S+ 0 0 60 -6,-2.2 3,-2.0 -3,-1.0 4,-0.6 0.445 91.1 133.4-128.2 -1.1 9.9 61.2 12.2 120 125 A K T 3< S+ 0 0 8 -4,-2.4 -5,-0.1 -7,-0.6 8,-0.1 -0.239 80.9 10.9 -54.9 140.6 12.5 59.1 10.4 121 126 A N T 34>S+ 0 0 25 -7,-0.3 5,-1.8 1,-0.1 -1,-0.2 0.347 104.9 94.6 75.3 -2.7 16.0 59.3 12.0 122 127 A Q T <45S+ 0 0 123 -3,-2.0 3,-0.3 3,-0.2 -2,-0.1 0.841 72.6 60.5 -85.2 -34.6 14.7 61.0 15.2 123 128 A T T <5S+ 0 0 41 -4,-0.6 -1,-0.1 1,-0.2 -3,-0.1 0.914 119.7 27.8 -63.0 -40.3 14.2 57.9 17.3 124 129 A D T 5S- 0 0 30 2,-0.1 -1,-0.2 -121,-0.0 -2,-0.2 0.394 105.7-124.1-101.9 2.3 17.8 56.9 17.2 125 130 A N T 5 + 0 0 148 -3,-0.3 2,-0.3 -4,-0.2 -3,-0.2 0.937 59.8 147.6 53.5 53.6 19.2 60.4 16.6 126 131 A V < - 0 0 17 -5,-1.8 2,-0.6 -47,-0.0 -1,-0.2 -0.749 53.0-123.6-114.7 160.5 21.0 59.5 13.4 127 132 A E + 0 0 156 -2,-0.3 2,-0.2 -5,-0.0 -6,-0.1 -0.934 57.5 124.0-102.4 114.9 21.8 61.2 10.2 128 133 A S - 0 0 21 -2,-0.6 -57,-0.2 -57,-0.2 -59,-0.1 -0.805 65.2 -40.2-152.3-169.0 20.4 59.2 7.3 129 134 A V - 0 0 15 -59,-0.5 -1,-0.1 -62,-0.4 3,-0.1 -0.307 53.9-127.5 -69.5 148.5 18.2 59.6 4.3 130 135 A P S S+ 0 0 75 0, 0.0 2,-0.3 0, 0.0 -10,-0.2 0.780 77.4 14.8 -72.3 -26.9 15.1 61.8 5.0 131 136 A N - 0 0 30 -14,-0.1 2,-0.7 -12,-0.1 -15,-0.2 -0.998 58.0-133.3-149.7 145.9 12.2 59.5 3.8 132 137 A I - 0 0 27 -17,-2.0 5,-0.1 -2,-0.3 -15,-0.1 -0.904 42.9-117.5-100.6 113.5 11.4 55.9 2.9 133 138 A G >> - 0 0 16 -2,-0.7 3,-1.7 1,-0.2 4,-0.7 -0.240 17.1-131.0 -52.8 133.0 9.4 56.2 -0.4 134 139 A Y H >> S+ 0 0 58 1,-0.3 4,-1.7 2,-0.2 3,-0.7 0.804 100.3 72.6 -61.1 -31.7 6.0 54.7 0.2 135 140 A R H 3> S+ 0 0 186 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.843 96.9 51.9 -50.1 -34.8 6.1 52.5 -2.9 136 141 A Y H <> S+ 0 0 73 -3,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.797 101.0 58.6 -79.0 -28.5 8.6 50.3 -1.0 137 142 A L H << S+ 0 0 14 -3,-0.7 4,-0.4 -4,-0.7 -1,-0.2 0.923 111.2 42.8 -61.9 -44.6 6.5 49.8 2.0 138 143 A V H >< S+ 0 0 67 -4,-1.7 3,-1.9 1,-0.2 4,-0.4 0.939 112.3 53.3 -64.6 -49.0 3.7 48.4 -0.1 139 144 A A H >< S+ 0 0 56 -4,-2.1 3,-1.6 1,-0.3 -2,-0.2 0.896 100.7 62.8 -53.0 -39.5 6.2 46.3 -2.1 140 145 A F T 3X S+ 0 0 59 -4,-2.2 4,-2.6 1,-0.3 5,-0.3 0.627 78.6 83.9 -67.8 -12.3 7.6 44.8 1.1 141 146 A I H <> S+ 0 0 27 -3,-1.9 4,-1.7 -4,-0.4 -1,-0.3 0.907 91.6 51.9 -52.6 -40.8 4.3 43.2 1.9 142 147 A Y H <> S+ 0 0 170 -3,-1.6 4,-3.1 -4,-0.4 5,-0.4 0.992 113.4 37.4 -64.0 -60.5 5.4 40.4 -0.3 143 148 A P H > S+ 0 0 19 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.913 117.3 51.8 -61.2 -38.3 8.8 39.6 1.2 144 149 A I H < S+ 0 0 16 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.850 118.8 38.1 -64.5 -32.5 7.7 40.2 4.8 145 150 A T H >X S+ 0 0 4 -4,-1.7 3,-1.1 -5,-0.3 4,-0.7 0.962 119.4 43.1 -78.8 -57.1 4.8 37.8 4.2 146 151 A A H >< S+ 0 0 20 -4,-3.1 3,-0.9 -5,-0.3 -2,-0.2 0.853 109.3 54.1 -66.5 -39.1 6.3 35.1 2.1 147 152 A T T 3< S+ 0 0 45 -4,-2.1 4,-0.4 -5,-0.4 -1,-0.3 0.613 99.6 65.5 -72.2 -11.8 9.7 34.7 3.9 148 153 A M T X> S+ 0 0 0 -3,-1.1 4,-1.6 -4,-0.2 3,-0.9 0.806 83.0 77.9 -74.8 -29.7 7.8 34.1 7.2 149 154 A K H - 0 0 71 -2,-0.2 4,-2.5 1,-0.1 5,-0.1 -0.271 33.3-122.5 -64.4 148.4 0.1 20.6 11.4 159 164 A P H > S+ 0 0 94 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.835 114.5 57.9 -57.0 -32.8 0.5 22.0 7.9 160 165 A E H > S+ 0 0 124 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.919 108.1 44.5 -63.5 -44.8 -3.2 23.0 8.1 161 166 A E H > S+ 0 0 31 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.906 111.3 54.8 -65.1 -40.8 -2.4 25.1 11.2 162 167 A V H X S+ 0 0 8 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.920 107.1 50.2 -57.9 -44.9 0.7 26.5 9.5 163 168 A E H X S+ 0 0 78 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.902 111.1 48.4 -62.5 -39.0 -1.4 27.6 6.5 164 169 A K H X S+ 0 0 103 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.894 112.0 49.0 -67.8 -40.9 -3.9 29.4 8.8 165 170 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.918 111.9 50.3 -61.3 -42.6 -1.0 31.1 10.7 166 171 A Y H X S+ 0 0 37 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.911 109.5 48.3 -64.7 -45.6 0.5 32.2 7.4 167 172 A Q H X S+ 0 0 70 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.897 111.1 52.3 -62.9 -37.6 -2.8 33.6 6.0 168 173 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.904 109.1 49.5 -62.9 -41.3 -3.2 35.5 9.2 169 174 A W H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.903 109.7 51.4 -63.9 -42.8 0.3 36.9 8.9 170 175 A F H X S+ 0 0 90 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.961 113.0 45.6 -58.1 -50.8 -0.4 38.0 5.3 171 176 A K H X S+ 0 0 43 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.909 113.4 49.1 -60.0 -43.9 -3.6 39.8 6.4 172 177 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.869 110.9 49.3 -66.4 -36.6 -1.9 41.4 9.4 173 178 A T H X S+ 0 0 5 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.932 113.4 47.0 -66.5 -45.5 1.1 42.7 7.4 174 179 A T H X S+ 0 0 39 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.927 110.2 53.2 -60.3 -46.0 -1.3 44.2 4.8 175 180 A L H X S+ 0 0 2 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.912 110.8 46.9 -54.8 -46.6 -3.5 45.8 7.4 176 181 A Q H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.938 109.5 50.7 -67.7 -46.0 -0.5 47.5 9.0 177 182 A V H X S+ 0 0 10 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.879 107.3 56.7 -60.3 -36.1 1.1 48.8 5.8 178 183 A A H >< S+ 0 0 34 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.934 109.4 45.5 -58.3 -46.8 -2.4 50.2 4.9 179 184 A L H >< S+ 0 0 4 -4,-1.8 3,-1.9 1,-0.2 -2,-0.2 0.879 104.6 61.8 -62.4 -37.5 -2.4 52.2 8.2 180 185 A W H 3< S+ 0 0 26 -4,-2.3 4,-0.3 1,-0.3 -1,-0.2 0.642 87.2 74.7 -70.4 -10.9 1.2 53.4 7.7 181 186 A S T XX S+ 0 0 16 -3,-0.9 4,-1.8 -4,-0.7 3,-1.3 0.725 71.5 92.1 -67.6 -19.2 0.2 55.2 4.6 182 187 A Y G X4 S+ 0 0 57 -3,-1.9 3,-0.5 1,-0.3 -1,-0.2 0.870 86.9 41.1 -49.8 -53.1 -1.5 57.9 6.7 183 188 A P G 34 S+ 0 0 24 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.719 117.3 51.0 -70.7 -16.7 1.5 60.3 7.0 184 189 A Y G <4 S+ 0 0 44 -3,-1.3 2,-0.3 -4,-0.3 -2,-0.2 0.729 94.6 85.2 -82.3 -29.2 2.3 59.8 3.3 185 190 A V S << S- 0 0 49 -4,-1.8 5,-0.2 -3,-0.5 3,-0.1 -0.594 89.6-100.7 -88.1 139.0 -1.1 60.4 1.9 186 191 A K > - 0 0 164 -2,-0.3 3,-2.5 1,-0.1 4,-0.3 -0.218 57.1 -85.7 -51.1 138.6 -2.5 63.8 1.0 187 192 A Y T 3 S+ 0 0 216 1,-0.3 -1,-0.1 2,-0.1 -5,-0.0 -0.256 115.7 15.7 -56.9 128.1 -4.8 65.0 3.8 188 193 A G T 3 S+ 0 0 66 -3,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.341 105.8 87.9 90.6 -2.8 -8.3 63.7 3.2 189 194 A D < 0 0 114 -3,-2.5 -2,-0.1 -7,-0.1 -3,-0.1 0.411 360.0 360.0-106.3 0.2 -7.3 61.0 0.6 190 195 A F 0 0 116 -4,-0.3 -1,-0.1 -5,-0.2 -3,-0.1 0.844 360.0 360.0 -85.0 360.0 -6.6 58.2 3.1