==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 27-FEB-08 2ZIY . COMPND 2 MOLECULE: RHODOPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: TODARODES PACIFICUS; . AUTHOR M.MIYANO,T.SHIMAMURA . 370 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19883.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 283 76.5 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 . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 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 . 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 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 17.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 52.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.2 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 2 2 0 0 1 0 0 2 0 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 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 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 ANTIPARALLEL 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 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 4 A D 0 0 178 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 104.7 77.3 9.2 32.4 2 5 A L + 0 0 151 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.943 360.0 2.3 78.1 61.2 76.8 10.8 35.8 3 6 A R S S- 0 0 231 1,-0.0 0, 0.0 2,-0.0 0, 0.0 0.834 95.7-141.2 95.1 60.6 73.9 13.3 35.0 4 7 A D + 0 0 88 1,-0.0 2,-0.3 2,-0.0 -2,-0.0 -0.075 26.8 172.4 -49.9 138.8 73.3 12.4 31.3 5 8 A N + 0 0 129 1,-0.1 3,-0.1 -4,-0.0 -1,-0.0 -0.953 24.1 143.1-145.9 160.3 72.5 15.2 28.8 6 9 A E S S- 0 0 133 1,-0.3 2,-0.2 -2,-0.3 3,-0.1 -0.010 71.2 -48.5-159.0 -67.9 72.0 15.4 25.1 7 10 A T > - 0 0 60 1,-0.2 3,-0.6 0, 0.0 -1,-0.3 -0.820 62.3 -74.4-158.6-164.4 69.2 17.9 24.4 8 11 A W T 3 S+ 0 0 41 -2,-0.2 -1,-0.2 1,-0.2 0, 0.0 0.991 121.2 61.0 -67.5 -59.8 65.7 18.9 25.3 9 12 A W T 3 S+ 0 0 36 12,-0.1 -1,-0.2 -3,-0.1 2,-0.1 0.500 75.4 119.5 -45.3 -14.8 64.1 16.0 23.4 10 13 A Y < - 0 0 78 -3,-0.6 5,-0.1 1,-0.1 -4,-0.1 -0.401 39.6-176.8 -61.7 127.8 65.9 13.4 25.6 11 14 A N > - 0 0 12 3,-0.4 3,-0.7 -2,-0.1 5,-0.2 -0.863 17.6-149.7-133.9 99.6 63.4 11.2 27.4 12 15 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.622 92.7 34.2 -38.2 -39.0 65.0 8.5 29.8 13 16 A S T 3 S+ 0 0 81 1,-0.1 2,-0.5 87,-0.1 89,-0.1 0.783 111.3 67.1 -96.4 -25.5 62.4 5.8 29.5 14 17 A I S < S- 0 0 6 -3,-0.7 2,-1.3 84,-0.1 -3,-0.4 -0.838 73.2-134.2-109.9 130.8 61.4 6.2 25.9 15 18 A I - 0 0 135 -2,-0.5 161,-0.2 -5,-0.1 -5,-0.0 -0.558 31.5-151.5 -69.5 92.0 63.3 5.6 22.7 16 19 A V - 0 0 6 -2,-1.3 3,-0.1 -5,-0.2 -6,-0.0 -0.023 21.6-107.9 -56.4 175.0 62.4 8.8 20.8 17 20 A H >> - 0 0 57 1,-0.2 3,-1.4 172,-0.0 4,-0.7 -0.947 22.2-122.2-108.2 137.4 62.5 8.4 17.0 18 21 A P H >> S+ 0 0 61 0, 0.0 3,-2.6 0, 0.0 4,-1.8 0.881 109.4 63.5 -38.6 -49.7 65.4 10.1 15.3 19 22 A H H 34 S+ 0 0 3 1,-0.3 4,-0.2 2,-0.2 3,-0.1 0.848 99.2 51.0 -45.4 -46.1 62.9 12.1 13.2 20 23 A W H <4 S+ 0 0 6 -3,-1.4 -1,-0.3 1,-0.2 3,-0.2 0.611 111.6 51.8 -70.7 -10.5 61.4 13.9 16.2 21 24 A R H << S+ 0 0 79 -3,-2.6 -2,-0.2 -4,-0.7 -1,-0.2 0.796 88.1 75.3 -94.3 -36.2 65.0 14.8 17.3 22 25 A E S < S+ 0 0 139 -4,-1.8 2,-0.2 -3,-0.1 -1,-0.1 0.472 88.5 78.5 -60.9 2.3 66.3 16.3 14.0 23 26 A F S S- 0 0 43 -3,-0.2 2,-0.3 -4,-0.2 3,-0.0 -0.514 85.7-107.2-104.1 175.9 64.3 19.5 14.8 24 27 A D - 0 0 145 -2,-0.2 -1,-0.0 1,-0.1 -2,-0.0 -0.708 51.3 -83.2 -99.1 155.2 64.8 22.4 17.0 25 28 A Q - 0 0 67 -2,-0.3 -1,-0.1 1,-0.1 154,-0.0 -0.225 38.3-118.5 -62.5 142.5 62.8 22.7 20.2 26 29 A V - 0 0 5 1,-0.1 -1,-0.1 2,-0.1 -3,-0.0 -0.468 44.5 -90.5 -75.9 152.6 59.3 24.2 20.2 27 30 A P >> - 0 0 77 0, 0.0 4,-1.3 0, 0.0 3,-0.8 -0.196 31.2-107.5 -65.3 154.8 58.9 27.4 22.3 28 31 A D H 3> S+ 0 0 86 1,-0.2 4,-1.5 2,-0.2 68,-0.1 0.751 115.2 56.8 -51.5 -31.9 57.9 27.5 26.0 29 32 A A H 3> S+ 0 0 65 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.839 99.4 53.6 -74.2 -37.9 54.4 28.9 25.1 30 33 A V H <> S+ 0 0 40 -3,-0.8 4,-4.4 2,-0.2 5,-0.3 0.941 108.4 52.3 -64.5 -43.0 53.2 26.2 22.6 31 34 A Y H X S+ 0 0 0 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.963 111.9 45.0 -55.4 -53.7 53.9 23.5 25.3 32 35 A Y H X S+ 0 0 108 -4,-1.5 4,-2.2 2,-0.2 5,-0.3 0.939 115.7 47.2 -57.3 -47.2 51.8 25.4 27.8 33 36 A S H X S+ 0 0 70 -4,-3.1 4,-4.3 1,-0.3 5,-0.5 0.995 109.3 53.0 -54.5 -63.6 49.1 26.0 25.2 34 37 A L H X S+ 0 0 18 -4,-4.4 4,-1.2 2,-0.2 -1,-0.3 0.776 116.0 44.4 -42.8 -26.3 49.3 22.4 24.3 35 38 A G H >X S+ 0 0 0 -4,-1.6 4,-1.0 -5,-0.3 3,-0.9 0.904 117.6 38.2 -78.6 -84.1 48.8 22.0 28.0 36 39 A I H >X S+ 0 0 108 -4,-2.2 4,-2.4 1,-0.3 3,-1.1 0.789 117.2 55.9 -28.7 -52.0 46.0 24.5 28.7 37 40 A F H 3X S+ 0 0 79 -4,-4.3 4,-1.2 -5,-0.3 -1,-0.3 0.948 111.2 39.3 -54.5 -55.8 44.5 23.5 25.4 38 41 A I H << S+ 0 0 7 -4,-1.2 48,-0.3 -3,-0.9 -1,-0.3 0.443 109.6 63.0 -79.2 6.0 44.2 19.8 26.1 39 42 A G H XX S+ 0 0 16 -3,-1.1 3,-2.5 -4,-1.0 4,-1.9 0.884 97.2 56.4 -86.7 -50.1 43.2 20.5 29.7 40 43 A I H 3X S+ 0 0 95 -4,-2.4 4,-2.2 1,-0.3 5,-0.3 0.888 106.5 51.4 -44.0 -46.7 40.1 22.3 28.4 41 44 A C H 3X S+ 0 0 18 -4,-1.2 4,-0.7 1,-0.2 -1,-0.3 0.631 102.9 57.6 -70.8 -14.6 39.2 19.0 26.6 42 45 A G H <> S+ 0 0 9 -3,-2.5 4,-2.7 3,-0.2 5,-0.3 0.966 115.1 38.4 -74.8 -55.9 39.6 17.0 29.7 43 46 A I H X S+ 0 0 124 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.974 119.4 42.3 -51.4 -79.3 37.0 19.1 31.4 44 47 A I H X S+ 0 0 57 -4,-2.2 4,-2.3 1,-0.2 3,-0.4 0.872 120.4 43.3 -36.6 -61.1 34.6 19.7 28.6 45 48 A G H X S+ 0 0 0 -4,-0.7 4,-1.6 1,-0.3 5,-0.4 0.884 113.8 45.9 -59.6 -45.7 34.7 16.1 27.4 46 49 A C H X S+ 0 0 32 -4,-2.7 4,-0.6 -5,-0.3 -1,-0.3 0.688 115.6 56.1 -73.7 -9.3 34.6 14.3 30.7 47 50 A G H X S+ 0 0 32 -4,-1.7 4,-2.4 -3,-0.4 3,-0.5 0.930 110.8 35.6 -78.0 -81.4 31.8 16.8 31.4 48 51 A G H X S+ 0 0 17 -4,-2.3 4,-2.9 1,-0.3 5,-0.3 0.871 119.4 48.3 -34.5 -68.3 29.5 16.1 28.5 49 52 A N H X S+ 0 0 0 -4,-1.6 4,-4.1 1,-0.2 -1,-0.3 0.892 112.0 51.1 -44.7 -47.1 30.0 12.4 28.3 50 53 A G H X S+ 0 0 24 -4,-0.6 4,-3.5 -3,-0.5 -1,-0.2 0.951 115.1 41.7 -54.8 -55.3 29.5 12.1 32.0 51 54 A I H X S+ 0 0 53 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.994 114.0 52.7 -52.0 -71.3 26.3 14.1 31.9 52 55 A V H X S+ 0 0 0 -4,-2.9 4,-1.0 1,-0.3 5,-0.3 0.836 111.6 45.4 -33.8 -53.4 25.3 12.2 28.8 53 56 A I H X S+ 0 0 49 -4,-4.1 4,-1.6 -5,-0.3 5,-0.3 0.993 114.7 50.4 -55.2 -56.6 25.9 9.0 30.5 54 57 A Y H X S+ 0 0 120 -4,-3.5 4,-1.0 -5,-0.2 5,-0.3 0.808 115.6 40.4 -49.2 -41.9 24.0 10.3 33.6 55 58 A L H >X S+ 0 0 4 -4,-2.6 3,-2.5 1,-0.2 4,-1.3 0.955 116.8 44.9 -72.4 -76.7 21.0 11.5 31.6 56 59 A F H 3< S+ 0 0 8 -4,-1.0 -2,-0.2 1,-0.3 -1,-0.2 0.575 115.1 51.0 -41.3 -16.3 20.5 8.7 29.2 57 60 A T H 3< S+ 0 0 52 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.751 123.8 25.2 -96.3 -25.2 21.0 6.2 32.0 58 61 A K H << S+ 0 0 134 -3,-2.5 -2,-0.2 -4,-1.0 -3,-0.2 0.886 92.7 94.3-100.0 -59.6 18.5 7.6 34.3 59 62 A T >< - 0 0 34 -4,-1.3 3,-1.7 -5,-0.3 4,-0.0 -0.100 63.1-149.6 -42.0 110.3 15.8 9.6 32.3 60 63 A K G > S+ 0 0 189 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.771 90.4 69.1 -54.4 -34.7 13.0 7.1 31.8 61 64 A S G 3 S+ 0 0 45 1,-0.2 -1,-0.3 257,-0.1 3,-0.1 0.466 102.9 49.9 -68.7 4.4 11.9 8.7 28.4 62 65 A L G < + 0 0 2 -3,-1.7 -1,-0.2 -4,-0.1 -2,-0.2 0.310 62.3 113.4-127.9 12.6 15.2 7.3 27.1 63 66 A Q < + 0 0 119 -3,-1.4 -1,-0.1 -5,-0.1 -2,-0.1 0.304 43.1 141.6 -71.2 16.1 15.5 3.6 28.0 64 67 A T >> - 0 0 61 1,-0.2 3,-1.8 -3,-0.1 4,-0.6 -0.407 59.1-130.6 -59.9 124.4 15.2 2.9 24.2 65 68 A P G >4 S+ 0 0 30 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.788 105.6 65.3 -46.6 -34.3 17.7 0.0 23.4 66 69 A A G >4 S+ 0 0 10 78,-0.3 3,-1.4 1,-0.2 4,-0.4 0.891 95.9 57.5 -58.8 -38.6 19.0 2.0 20.5 67 70 A N G <> S+ 0 0 17 -3,-1.8 4,-2.3 1,-0.3 3,-0.3 0.716 78.7 83.9 -68.7 -21.4 20.3 4.6 22.9 68 71 A M H S+ 0 0 4 -3,-1.4 4,-3.2 2,-0.2 -1,-0.3 0.920 98.1 53.2 -81.7 -48.7 24.7 3.1 22.0 70 73 A I H > S+ 0 0 22 -4,-0.4 4,-3.5 -3,-0.3 5,-0.3 0.921 110.6 51.3 -47.4 -46.6 24.7 6.7 22.8 71 74 A I H X S+ 0 0 41 -4,-2.3 4,-3.3 2,-0.2 -1,-0.2 0.979 107.7 50.3 -53.3 -62.6 25.8 5.6 26.2 72 75 A N H X S+ 0 0 15 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.905 114.6 44.4 -44.4 -53.6 28.6 3.5 24.8 73 76 A L H X S+ 0 0 2 -4,-3.2 4,-2.1 2,-0.2 5,-0.3 0.946 110.5 52.1 -59.0 -51.3 29.8 6.4 22.8 74 77 A A H X S+ 0 0 0 -4,-3.5 4,-0.6 -5,-0.3 -1,-0.2 0.917 114.3 49.3 -51.0 -38.3 29.5 8.9 25.6 75 78 A F H >X S+ 0 0 74 -4,-3.3 4,-2.2 -5,-0.3 3,-0.7 0.949 110.1 45.8 -65.4 -54.4 31.5 6.3 27.5 76 79 A S H 3X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.3 -2,-0.2 0.972 112.9 48.7 -53.4 -62.0 34.3 5.7 25.0 77 80 A D H 3X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.657 110.8 55.1 -56.8 -15.6 35.0 9.4 24.2 78 81 A F H S+ 0 0 4 -4,-2.5 4,-2.7 1,-0.3 5,-0.7 0.905 112.3 39.8 -34.5 -72.0 39.6 8.7 25.9 81 84 A S H X5S+ 0 0 6 -4,-1.5 4,-1.2 3,-0.2 -1,-0.3 0.840 113.7 55.9 -50.5 -43.0 39.5 12.3 27.1 82 85 A L H <5S+ 0 0 84 -4,-3.5 -2,-0.2 2,-0.2 -1,-0.2 0.992 123.3 24.5 -51.6 -70.1 40.1 11.3 30.7 83 86 A V H <5S+ 0 0 29 -4,-2.5 6,-0.4 1,-0.2 5,-0.3 0.972 124.9 47.1 -56.9 -69.6 43.3 9.4 29.9 84 87 A N H <5S+ 0 0 6 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.731 122.6 42.5 -48.2 -26.9 44.4 11.1 26.6 85 88 A G S X S+ 0 0 53 0, 0.0 4,-1.5 0, 0.0 5,-0.3 -0.967 124.2 41.5 -87.1 -21.6 46.9 14.1 33.9 88 91 A L H >> S+ 0 0 35 -5,-0.3 4,-2.2 1,-0.2 3,-1.3 0.944 119.2 31.8 -50.2 -82.2 49.4 12.6 31.4 89 92 A M H 3X S+ 0 0 0 -4,-0.9 4,-2.4 -6,-0.4 -1,-0.2 0.816 115.7 56.5 -50.2 -39.4 49.6 14.9 28.4 90 93 A T H 3> S+ 0 0 13 -5,-0.3 4,-2.3 1,-0.2 -1,-0.3 0.828 112.7 41.3 -66.2 -28.6 48.9 18.1 30.2 91 94 A I H <>S+ 0 0 0 -4,-2.2 5,-1.3 -5,-0.3 3,-0.6 0.959 114.2 46.3 -46.0 -48.2 54.2 16.3 30.0 93 96 A C H ><5S+ 0 0 0 -4,-2.4 3,-2.2 -5,-0.3 -2,-0.2 0.941 106.4 52.9 -60.8 -55.7 53.4 19.6 28.4 94 97 A F H 3<5S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.721 120.1 39.1 -56.2 -17.1 53.7 21.9 31.4 95 98 A L T <<5S- 0 0 93 -4,-2.0 -1,-0.3 -3,-0.6 2,-0.2 -0.096 102.1-127.5-122.9 33.1 57.2 20.3 31.8 96 99 A K T < 5S+ 0 0 45 -3,-2.2 2,-0.3 -68,-0.1 -3,-0.2 0.528 86.8 77.4 34.3 7.4 58.3 20.0 28.1 97 100 A K S - 0 0 41 3,-0.1 4,-1.6 2,-0.1 -1,-0.1 0.456 34.1-115.3 -30.4 169.9 56.4 5.5 32.6 102 105 A F H >> S+ 0 0 79 2,-0.2 4,-1.6 1,-0.2 3,-0.6 0.955 125.7 46.3 -76.2 -53.8 57.3 3.8 29.3 103 106 A A H 3> S+ 0 0 62 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.780 104.0 64.7 -54.3 -26.1 54.2 1.7 29.7 104 107 A A H 3> S+ 0 0 23 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.983 105.6 43.3 -59.9 -51.4 52.5 4.9 30.6 105 108 A a H X S+ 0 0 16 -4,-4.9 4,-1.9 -6,-0.3 3,-1.4 0.957 110.6 34.9 -49.6 -63.2 43.3 3.4 20.3 114 117 A I H 3X S+ 0 0 15 -4,-3.6 4,-3.0 1,-0.3 -2,-0.2 0.988 120.5 50.5 -53.5 -61.3 40.3 1.4 21.6 115 118 A F H 3< S+ 0 0 15 -4,-2.5 4,-0.3 2,-0.2 -1,-0.3 0.251 106.3 52.8 -66.9 11.4 38.3 4.5 22.2 116 119 A G H <> S+ 0 0 11 -3,-1.4 4,-2.3 -4,-0.3 -1,-0.2 0.712 115.6 40.9-105.2 -56.4 38.9 6.0 18.8 117 120 A F H X S+ 0 0 27 -4,-1.9 4,-2.9 -5,-0.3 5,-0.4 0.823 113.0 57.8 -57.6 -35.2 37.7 2.9 17.1 118 121 A M H X S+ 0 0 0 -4,-3.0 4,-3.5 -5,-0.2 5,-0.3 0.996 107.7 43.3 -60.2 -63.8 35.0 2.5 19.6 119 122 A S H > S+ 0 0 1 -4,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.944 121.8 40.5 -46.1 -61.6 33.4 5.9 18.9 120 123 A I H X S+ 0 0 4 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.965 116.1 47.1 -54.5 -61.2 33.7 5.4 15.2 121 124 A M H X S+ 0 0 5 -4,-2.9 4,-1.5 1,-0.2 3,-0.3 0.887 111.2 55.9 -48.9 -40.8 32.8 1.8 15.0 122 125 A T H X S+ 0 0 3 -4,-3.5 4,-2.2 -5,-0.4 -1,-0.2 0.955 97.3 59.2 -57.3 -53.6 29.8 2.5 17.3 123 126 A M H X S+ 0 0 6 -4,-2.2 4,-3.5 1,-0.3 -1,-0.2 0.867 102.2 58.4 -42.5 -39.9 28.4 5.2 15.0 124 127 A A H X S+ 0 0 0 -4,-1.5 4,-2.3 -3,-0.3 -1,-0.3 0.989 103.4 49.7 -53.5 -64.4 28.2 2.5 12.5 125 128 A M H X S+ 0 0 14 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.857 112.9 47.2 -40.6 -49.3 26.0 0.5 14.9 126 129 A I H >X S+ 0 0 19 -4,-2.2 4,-1.6 1,-0.2 3,-1.1 0.997 109.8 52.3 -56.2 -63.5 23.8 3.5 15.4 127 130 A S H 3X S+ 0 0 0 -4,-3.5 4,-1.7 1,-0.3 -1,-0.2 0.761 104.7 57.6 -43.5 -30.4 23.7 4.0 11.6 128 131 A I H 3X S+ 0 0 42 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.3 0.968 106.5 49.8 -66.3 -47.6 22.6 0.4 11.3 129 132 A D H XX S+ 0 0 5 -4,-2.1 3,-0.7 -3,-1.1 4,-0.6 0.949 106.7 52.4 -53.2 -57.7 19.7 1.2 13.6 130 133 A R H >X>S+ 0 0 8 -4,-1.6 4,-2.4 1,-0.3 3,-1.4 0.874 106.7 54.6 -48.6 -41.1 18.6 4.2 11.6 131 134 A Y H 3<>S+ 0 0 53 -4,-1.7 5,-2.0 -5,-0.3 4,-0.5 0.924 106.3 51.3 -59.6 -42.0 18.5 2.1 8.5 132 135 A N H <<5S+ 0 0 22 -4,-1.8 10,-2.5 -3,-0.7 -1,-0.3 0.497 119.7 37.2 -72.5 -4.2 16.2 -0.4 10.3 133 136 A V H <<5S+ 0 0 29 -3,-1.4 -2,-0.2 -4,-0.6 -1,-0.2 0.536 136.3 10.4-120.7 -16.3 13.9 2.6 11.1 134 137 A I T <5S+ 0 0 43 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.1 0.668 118.4 52.3-133.3 -41.8 14.2 4.7 8.0 135 138 A G T > - 0 0 63 0, 0.0 3,-1.8 0, 0.0 4,-0.8 -0.232 42.2-107.9 -53.0 139.6 10.3 0.5 3.5 138 141 A M G >4 S+ 0 0 95 1,-0.3 3,-1.1 2,-0.2 -2,-0.1 0.845 118.2 60.7 -35.7 -49.9 7.8 1.5 6.3 139 142 A A G 34 S+ 0 0 96 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.814 108.0 40.9 -50.2 -42.0 6.3 -2.0 6.2 140 143 A A G <4 S+ 0 0 34 -3,-1.8 -1,-0.2 2,-0.0 -2,-0.2 0.478 82.2 136.2 -91.1 -5.6 9.6 -3.8 7.1 141 144 A S << - 0 0 38 -3,-1.1 2,-0.4 -4,-0.8 -8,-0.2 -0.026 31.9-168.1 -47.9 143.3 11.0 -1.6 9.9 142 145 A K - 0 0 59 -10,-2.5 3,-0.1 -13,-0.2 223,-0.1 -0.964 11.4-146.7-136.8 114.0 12.4 -3.0 13.1 143 146 A K - 0 0 113 -2,-0.4 2,-0.0 1,-0.1 -13,-0.0 -0.397 40.8 -80.7 -76.4 161.1 13.2 -0.7 16.0 144 147 A M - 0 0 12 -2,-0.1 2,-0.4 4,-0.1 -78,-0.3 -0.310 42.8-149.2 -66.3 144.4 16.2 -1.6 18.2 145 148 A S > - 0 0 23 -80,-0.2 4,-2.1 -81,-0.1 5,-0.2 -0.944 25.2-119.7-120.1 134.7 15.9 -4.3 20.9 146 149 A H H > S+ 0 0 132 -2,-0.4 4,-1.7 1,-0.2 5,-0.1 0.784 114.3 51.7 -35.4 -35.8 17.8 -4.6 24.2 147 150 A R H > S+ 0 0 198 2,-0.2 4,-1.6 3,-0.1 5,-0.2 0.984 110.0 40.0 -69.0 -80.2 19.1 -7.9 22.9 148 151 A R H >> S+ 0 0 93 1,-0.2 4,-2.5 2,-0.2 3,-1.2 0.865 115.5 57.0 -32.0 -58.9 20.5 -7.1 19.4 149 152 A A H 3X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.3 -1,-0.2 0.905 105.6 46.3 -38.5 -70.3 21.9 -3.9 20.9 150 153 A F H 3X S+ 0 0 112 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.3 0.735 111.8 53.1 -50.9 -27.7 24.0 -5.5 23.7 151 154 A I H X S+ 0 0 0 -4,-4.3 4,-2.2 2,-0.2 3,-0.5 0.962 111.5 47.4 -48.8 -74.5 32.0 -3.4 18.9 157 160 A W H 3X S+ 0 0 76 -4,-2.7 4,-2.2 1,-0.2 5,-0.3 0.836 109.9 49.2 -32.9 -79.2 34.2 -3.8 22.0 158 161 A L H 3X S+ 0 0 125 -4,-1.5 4,-3.3 1,-0.2 -1,-0.2 0.839 119.8 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88.7 122.6 69.2 -7.5 55.1 -5.6 19.0 171 174 A W S + 0 0 1 5,-0.6 3,-5.8 -2,-0.1 4,-0.4 -0.875 41.7 13.0-158.0-167.1 55.4 12.0 18.9 178 181 A G T 3 S- 0 0 3 1,-0.3 114,-0.1 -2,-0.3 -2,-0.0 0.126 136.7 -3.2 27.3-113.4 55.0 15.6 17.9 179 182 A V T 3 S- 0 0 2 112,-0.1 -1,-0.3 1,-0.1 -153,-0.0 0.122 102.4-112.5 -90.9 23.2 56.4 17.6 20.7 180 183 A L S < S+ 0 0 7 -3,-5.8 -82,-0.3 1,-0.1 -2,-0.2 0.709 93.4 103.5 55.2 24.4 57.0 14.4 22.6 181 184 A C S S+ 0 0 0 -4,-0.4 -89,-0.2 -84,-0.1 -88,-0.1 0.793 78.1 39.1-102.0 -37.8 54.4 15.3 25.2 182 185 A N S S- 0 0 0 -5,-0.2 -5,-0.6 -90,-0.1 2,-0.3 -0.181 83.6-132.2 -91.6-164.2 51.6 13.1 24.2 183 186 A a E +A 176 0A 0 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.783 29.9 163.5-139.8 174.5 52.2 9.6 22.9 184 187 A S E -A 175 0A 13 -9,-2.2 -9,-1.5 -2,-0.3 -75,-0.2 -0.957 40.2 -59.4-175.3-174.6 50.7 7.9 19.8 185 188 A F E -A 174 0A 37 -2,-0.3 2,-0.8 -11,-0.2 -11,-0.3 -0.456 57.5 -99.9 -83.6 161.2 51.0 5.0 17.3 186 189 A D + 0 0 26 -13,-2.7 12,-0.2 1,-0.2 -13,-0.1 -0.732 54.5 150.0 -90.1 112.2 54.2 4.5 15.3 187 190 A Y + 0 0 2 -2,-0.8 -1,-0.2 -15,-0.1 -2,-0.0 0.278 62.7 67.9-116.9 2.7 53.7 5.8 11.8 188 191 A I S S+ 0 0 7 -3,-0.1 -2,-0.1 94,-0.0 98,-0.0 0.909 77.9 73.8 -85.9 -81.1 57.3 6.7 11.2 189 192 A S - 0 0 34 1,-0.2 6,-0.1 5,-0.0 -1,-0.0 -0.010 64.3-159.7 -35.7 121.1 59.3 3.4 11.0 190 193 A R + 0 0 104 4,-0.1 -1,-0.2 5,-0.1 2,-0.1 -0.151 38.6 137.5-103.2 40.5 58.5 1.8 7.6 191 194 A D > - 0 0 65 1,-0.1 4,-1.9 4,-0.0 5,-0.4 -0.360 69.1-103.2 -80.5 166.2 59.5 -1.8 8.4 192 195 A S H > S+ 0 0 102 1,-0.2 4,-1.5 3,-0.2 5,-0.1 0.872 118.2 47.8 -55.0 -41.7 57.4 -4.8 7.3 193 196 A T H > S+ 0 0 65 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.980 116.6 37.6 -68.0 -59.0 56.0 -5.3 10.8 194 197 A T H >> S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 3,-0.6 0.986 117.8 49.7 -57.5 -59.9 55.0 -1.8 11.7 195 198 A R H 3X S+ 0 0 83 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.872 106.6 58.0 -47.8 -41.4 53.7 -0.8 8.3 196 199 A S H 3X S+ 0 0 49 -4,-1.5 4,-1.4 -5,-0.4 -1,-0.2 0.934 109.7 42.6 -57.2 -47.2 51.7 -4.0 8.2 197 200 A N H XX S+ 0 0 1 -4,-1.7 4,-2.7 -3,-0.6 3,-0.7 0.978 107.7 61.2 -61.2 -55.1 49.8 -3.1 11.3 198 201 A I H 3X S+ 0 0 1 -4,-2.4 4,-2.0 1,-0.3 -1,-0.2 0.844 104.7 48.0 -39.6 -50.9 49.3 0.5 10.3 199 202 A L H 3X S+ 0 0 78 -4,-2.0 4,-2.8 2,-0.2 5,-0.4 0.895 109.5 50.5 -64.4 -40.0 47.4 -0.5 7.2 200 203 A C H S+ 0 0 34 -4,-1.4 4,-4.5 -3,-0.7 5,-0.8 0.987 107.2 57.2 -58.3 -52.1 45.1 -2.9 9.0 201 204 A M H X5S+ 0 0 17 -4,-2.7 4,-1.5 1,-0.2 5,-0.4 0.879 111.9 41.2 -40.9 -54.5 44.5 -0.0 11.4 202 205 A F H <>S+ 0 0 23 -4,-2.0 5,-3.1 -5,-0.2 4,-0.5 0.922 124.3 34.9 -62.6 -49.9 43.3 2.2 8.5 203 206 A I H <>S+ 0 0 84 -4,-2.8 5,-3.3 3,-0.2 -2,-0.2 0.910 130.1 31.5 -73.3 -44.5 41.2 -0.4 6.7 204 207 A L H <5S+ 0 0 42 -4,-4.5 -3,-0.2 -5,-0.4 -2,-0.2 0.924 125.6 35.6 -85.1 -46.5 40.0 -2.3 9.6 205 208 A G T <5S+ 0 0 38 -4,-0.5 4,-1.9 -5,-0.4 -3,-0.2 0.661 126.3 38.1-135.0 -57.1 38.5 3.0 10.2 207 210 A F H >> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 3,-0.7 0.988 110.9 57.6 -67.2 -57.5 33.2 1.3 9.5 210 213 A I H 3X S+ 0 0 41 -4,-1.9 4,-3.1 1,-0.3 5,-0.4 0.838 101.1 57.2 -39.3 -48.6 33.0 4.2 7.1 211 214 A L H 3X S+ 0 0 124 -4,-2.5 4,-3.2 1,-0.2 -1,-0.3 0.965 111.8 43.0 -50.0 -53.9 31.9 1.8 4.3 212 215 A I H X S+ 0 0 11 -4,-2.4 4,-1.8 1,-0.2 3,-1.0 0.972 116.0 40.7 -51.5 -59.7 28.2 4.2 7.7 214 217 A F H 3< S+ 0 0 127 -4,-3.1 5,-0.3 1,-0.3 -2,-0.2 0.907 107.1 63.0 -54.6 -48.5 28.0 5.5 4.1 215 218 A F H 3X S+ 0 0 116 -4,-3.2 4,-1.3 -5,-0.4 3,-0.3 0.821 111.1 40.4 -47.6 -34.1 26.2 2.4 3.0 216 219 A C H S+ 0 0 98 -2,-2.0 4,-2.4 -3,-0.3 5,-0.5 0.468 108.8 51.1-122.3 -67.5 22.6 6.5 1.2 219 222 A N H X S+ 0 0 49 -4,-1.3 4,-0.8 -5,-0.3 -2,-0.2 0.769 118.2 45.0 -41.8 -27.1 20.2 3.6 1.4 220 223 A I H >< S+ 0 0 18 -4,-2.7 3,-0.7 2,-0.2 -1,-0.2 0.965 110.8 49.0 -81.1 -60.8 18.3 5.9 3.6 221 224 A V H >> S+ 0 0 78 1,-0.3 3,-1.7 -5,-0.2 4,-0.6 0.909 114.4 47.2 -40.8 -56.5 18.6 9.1 1.6 222 225 A M H >X S+ 0 0 114 -4,-2.4 3,-0.6 1,-0.3 4,-0.6 0.830 106.8 57.3 -59.4 -34.2 17.5 7.2 -1.6 223 226 A S H << S+ 0 0 26 -4,-0.8 4,-0.4 -3,-0.7 -1,-0.3 0.262 90.8 72.7 -84.1 15.2 14.5 5.5 0.2 224 227 A V H <> S+ 0 0 55 -3,-1.7 4,-1.2 -4,-0.2 3,-0.3 0.799 85.0 65.3 -91.0 -35.0 13.1 8.9 1.2 225 228 A S H X< S+ 0 0 98 -4,-0.6 3,-0.8 -3,-0.6 4,-0.4 0.954 106.9 44.1 -45.1 -55.2 12.0 9.5 -2.4 226 229 A N T >X S+ 0 0 61 -4,-0.6 4,-1.3 1,-0.2 3,-0.9 0.751 101.0 71.6 -60.9 -31.7 9.7 6.5 -1.8 227 230 A H H 3> S+ 0 0 48 -4,-0.4 4,-2.3 -3,-0.3 -1,-0.2 0.831 87.0 60.2 -59.2 -37.4 8.6 7.8 1.7 228 231 A E H << S+ 0 0 95 -4,-1.2 -1,-0.2 -3,-0.8 4,-0.2 0.774 107.0 47.6 -64.7 -25.1 6.4 10.7 0.5 229 232 A K H <> S+ 0 0 161 -3,-0.9 4,-2.9 -4,-0.4 -1,-0.2 0.811 114.7 47.1 -82.0 -34.3 4.2 8.3 -1.5 230 233 A E H X S+ 0 0 48 -4,-1.3 4,-0.6 1,-0.2 -2,-0.2 0.750 113.4 47.0 -79.0 -24.5 4.0 6.1 1.6 231 234 A M H < S+ 0 0 13 -4,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.473 123.1 35.6 -93.8 -4.2 3.3 9.0 4.0 232 235 A A H >4 S+ 0 0 63 -5,-0.2 3,-0.8 -3,-0.2 -2,-0.2 0.675 119.0 49.0-112.5 -37.4 0.6 10.3 1.6 233 236 A A H 3< S+ 0 0 71 -4,-2.9 4,-0.3 1,-0.3 -3,-0.2 0.607 119.5 37.3 -79.3 -20.2 -0.7 6.8 0.4 234 237 A M T 3< S+ 0 0 92 -4,-0.6 -1,-0.3 -5,-0.2 -4,-0.1 -0.060 105.3 74.6-116.0 26.3 -1.1 5.5 3.9 235 238 A A S < S+ 0 0 26 -3,-0.8 -2,-0.2 -6,-0.2 -1,-0.1 0.236 91.9 55.4-113.4 0.4 -2.2 9.0 4.7 236 239 A K S S+ 0 0 180 -3,-0.1 -2,-0.1 1,-0.1 -3,-0.1 0.802 98.5 58.1 -97.8 -44.4 -5.5 8.2 3.0 237 240 A R S S+ 0 0 142 -4,-0.3 2,-0.2 118,-0.0 -2,-0.1 0.424 101.8 78.4 -68.2 -1.4 -6.4 5.1 5.0 238 241 A L S S- 0 0 35 1,-0.1 -3,-0.0 117,-0.1 5,-0.0 -0.700 73.6-110.2-121.3 167.2 -6.3 7.0 8.4 239 242 A N > - 0 0 56 -2,-0.2 4,-0.6 1,-0.1 -1,-0.1 -0.022 46.8 -96.5 -73.3-178.2 -8.0 9.4 10.9 240 243 A A T 4 S+ 0 0 93 1,-0.2 4,-0.2 2,-0.1 -1,-0.1 0.545 121.9 38.3 -81.4 -7.8 -6.8 13.1 11.6 241 244 A K T > S+ 0 0 128 2,-0.1 4,-0.6 3,-0.1 -1,-0.2 0.431 109.2 56.9-120.0 -6.4 -4.8 12.0 14.7 242 245 A E H > S+ 0 0 60 2,-0.2 4,-0.8 3,-0.1 -2,-0.1 0.600 103.3 57.0 -98.7 -13.4 -3.3 8.7 13.6 243 246 A L H X S+ 0 0 39 -4,-0.6 4,-2.8 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