==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNAL TRANSDUCTION PROTEIN 25-JUL-95 1GDD . COMPND 2 MOLECULE: GI ALPHA 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.B.MIXON,S.R.SPRANG . 324 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16494.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 254 78.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 29 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 16.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 38.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 2 2 1 1 0 1 0 2 2 1 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 2 0 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 . 1 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 9 A D > 0 0 130 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 152.4 23.3 25.5 5.2 2 10 A K H > + 0 0 124 2,-0.2 4,-3.0 1,-0.2 5,-0.1 0.880 360.0 46.2 -63.7 -42.6 20.9 23.2 7.1 3 11 A A H > S+ 0 0 4 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.862 112.2 54.5 -68.6 -32.6 21.1 25.1 10.5 4 12 A A H > S+ 0 0 45 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.958 111.5 42.3 -62.1 -55.2 20.7 28.3 8.5 5 13 A V H X S+ 0 0 84 -4,-2.9 4,-0.7 1,-0.2 -2,-0.2 0.949 113.5 55.7 -56.6 -44.0 17.5 26.9 7.0 6 14 A E H >< S+ 0 0 57 -4,-3.0 3,-0.9 1,-0.2 -2,-0.2 0.902 109.7 43.9 -56.4 -46.0 16.6 25.6 10.4 7 15 A R H >< S+ 0 0 62 -4,-3.2 3,-1.9 1,-0.2 -1,-0.2 0.929 105.0 65.1 -65.1 -42.2 16.9 29.0 12.0 8 16 A S H 3< S+ 0 0 102 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.574 90.3 65.8 -59.1 -12.1 15.0 30.6 9.2 9 17 A K T << S+ 0 0 108 -3,-0.9 -1,-0.3 -4,-0.7 2,-0.2 0.377 74.2 107.9 -95.3 6.2 11.8 28.8 9.9 10 18 A M < + 0 0 34 -3,-1.9 311,-0.0 1,-0.1 -3,-0.0 -0.543 38.8 178.8 -82.3 151.2 11.1 30.4 13.3 11 19 A I > + 0 0 122 -2,-0.2 3,-1.2 2,-0.0 4,-0.2 0.334 52.8 99.3-131.3 2.5 8.3 32.9 13.5 12 20 A D G > S+ 0 0 46 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.791 71.6 63.2 -64.4 -36.0 8.3 33.8 17.2 13 21 A R G > S+ 0 0 24 1,-0.3 3,-0.8 2,-0.2 6,-0.6 0.660 93.6 67.3 -61.1 -19.0 10.2 37.1 17.0 14 22 A N G < S+ 0 0 114 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.609 92.8 60.9 -73.5 -14.0 7.2 38.4 14.8 15 23 A L G < S+ 0 0 139 -3,-1.8 2,-0.4 -4,-0.2 -1,-0.2 0.598 93.6 75.8 -87.5 -12.0 5.2 38.1 18.0 16 24 A R S X S- 0 0 106 -3,-0.8 3,-1.7 -4,-0.3 4,-0.2 -0.872 86.3-128.5-103.6 131.0 7.5 40.6 19.7 17 25 A E T 3 S+ 0 0 199 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.826 110.7 16.1 -42.0 -50.2 7.1 44.2 18.8 18 26 A D T > S+ 0 0 99 1,-0.1 3,-1.0 -3,-0.0 -1,-0.3 -0.547 86.5 149.5-122.9 62.8 10.8 44.6 18.1 19 27 A G G X + 0 0 3 -3,-1.7 3,-2.0 -6,-0.6 -5,-0.1 0.806 60.2 67.2 -70.7 -28.5 11.6 40.9 17.8 20 28 A E G 3 S+ 0 0 138 1,-0.3 -1,-0.2 -4,-0.2 -6,-0.1 0.725 104.6 50.3 -71.4 -6.3 14.4 41.0 15.4 21 29 A K G < S+ 0 0 175 -3,-1.0 -1,-0.3 -8,-0.1 -2,-0.2 0.438 88.3 111.0-104.4 -2.2 16.2 42.8 18.2 22 30 A A S < S- 0 0 11 -3,-2.0 2,-0.6 -4,-0.1 -9,-0.0 -0.286 71.4-115.1 -73.3 159.9 15.5 40.3 20.9 23 31 A A - 0 0 19 303,-2.7 303,-2.3 163,-0.0 2,-0.5 -0.829 20.5-147.6 -96.6 118.9 18.1 38.0 22.4 24 32 A R E -aB 186 325A 8 161,-0.6 163,-2.6 -2,-0.6 2,-0.5 -0.749 25.9-140.8 -84.5 129.9 17.6 34.3 21.7 25 33 A E E -a 187 0A 48 299,-2.6 2,-0.5 -2,-0.5 299,-0.3 -0.827 23.9-173.4-112.0 136.9 18.9 32.5 24.7 26 34 A V E -a 188 0A 0 161,-2.3 163,-3.1 -2,-0.5 2,-0.7 -0.965 11.3-157.4-118.6 115.1 20.9 29.3 25.2 27 35 A K E -a 189 0A 103 -2,-0.5 169,-2.9 161,-0.2 170,-1.5 -0.837 16.5-173.7 -96.2 117.8 21.4 27.9 28.8 28 36 A L E -ac 190 197A 0 161,-2.9 163,-2.7 -2,-0.7 2,-0.4 -0.945 12.9-157.1-123.1 119.0 24.5 25.7 28.8 29 37 A L E -ac 191 198A 24 168,-2.1 170,-2.4 -2,-0.5 2,-0.5 -0.778 9.0-152.8 -94.4 127.7 25.6 23.6 31.9 30 38 A L E +ac 192 199A 0 161,-3.1 163,-1.2 -2,-0.4 2,-0.3 -0.914 26.7 166.0-103.4 126.9 29.2 22.6 31.9 31 39 A L E + c 0 200A 20 168,-3.2 170,-3.9 -2,-0.5 2,-0.2 -0.884 12.3 108.8-137.6 171.9 29.9 19.4 33.9 32 40 A G E - c 0 201A 13 168,-0.3 170,-0.2 -2,-0.3 4,-0.1 -0.694 66.0 -55.4 138.3 162.1 32.5 16.8 34.5 33 41 A A S > S- 0 0 39 168,-0.8 3,-1.3 -2,-0.2 5,-0.3 -0.121 73.8 -70.8 -61.1 172.0 34.8 15.7 37.3 34 42 A G T 3 S+ 0 0 54 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.211 118.7 14.6 -62.1 153.6 37.3 18.1 38.9 35 43 A E T 3 S+ 0 0 52 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.702 88.1 124.7 50.4 29.1 40.3 19.1 36.9 36 44 A S S < S- 0 0 1 -3,-1.3 166,-0.2 -4,-0.1 205,-0.1 0.497 89.6 -86.8 -94.8 -1.7 38.6 17.8 33.6 37 45 A G S > S+ 0 0 10 -4,-0.1 4,-2.1 164,-0.1 5,-0.2 0.439 86.1 128.7 114.7 4.5 38.8 21.1 31.7 38 46 A K H > S+ 0 0 24 -5,-0.3 4,-1.9 1,-0.2 3,-0.3 0.950 79.5 43.9 -58.6 -47.3 35.7 23.0 32.6 39 47 A S H > S+ 0 0 29 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.785 110.9 54.7 -66.6 -31.2 37.5 26.2 33.6 40 48 A T H > S+ 0 0 21 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.866 107.2 50.8 -71.4 -34.0 39.7 26.0 30.5 41 49 A I H X S+ 0 0 0 -4,-2.1 4,-1.1 -3,-0.3 -2,-0.2 0.882 109.5 51.7 -67.3 -41.6 36.5 25.8 28.3 42 50 A V H >X S+ 0 0 11 -4,-1.9 4,-1.0 -5,-0.2 3,-0.6 0.940 110.4 47.8 -61.0 -45.1 35.2 28.9 30.2 43 51 A K H 3X S+ 0 0 17 -4,-2.1 4,-2.5 1,-0.2 3,-0.5 0.882 108.4 55.5 -62.6 -41.0 38.4 30.7 29.4 44 52 A Q H 3X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.692 100.6 57.7 -64.4 -23.4 38.3 29.7 25.7 45 53 A M H S+ 0 0 0 -4,-1.1 4,-2.8 -3,-0.6 5,-0.6 0.837 110.5 45.3 -76.4 -28.5 34.8 31.2 25.3 46 54 A K H X5S+ 0 0 43 -4,-1.0 4,-1.4 -3,-0.5 -2,-0.2 0.925 114.0 46.8 -76.4 -50.6 36.3 34.5 26.4 47 55 A I H <5S+ 0 0 19 -4,-2.5 -2,-0.2 5,-0.2 -3,-0.2 0.957 124.5 33.8 -56.0 -50.7 39.3 34.1 24.3 48 56 A I H <5S+ 0 0 35 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.2 0.905 131.5 25.7 -77.3 -41.0 37.1 33.1 21.3 49 57 A H H <5S+ 0 0 43 -4,-2.8 -3,-0.2 -5,-0.2 133,-0.2 0.784 132.3 23.4 -99.8 -27.1 33.8 35.1 21.7 50 58 A E S <> - 0 0 45 -2,-0.5 4,-3.7 1,-0.1 3,-0.5 -0.563 37.7-106.5 -85.0 154.4 44.4 41.1 27.6 55 63 A E H 3> S+ 0 0 120 1,-0.3 4,-2.2 2,-0.3 5,-0.1 0.854 128.2 52.4 -51.4 -32.4 48.1 41.5 28.3 56 64 A E H 3> S+ 0 0 146 2,-0.2 4,-0.7 1,-0.2 -1,-0.3 0.939 112.5 45.6 -66.9 -40.3 46.9 43.4 31.3 57 65 A E H X4 S+ 0 0 79 -3,-0.5 3,-1.4 1,-0.2 4,-0.3 0.939 111.8 49.7 -66.5 -48.5 44.7 40.5 32.2 58 66 A C H >< S+ 0 0 4 -4,-3.7 3,-2.3 1,-0.3 -1,-0.2 0.857 99.2 67.8 -61.7 -30.9 47.4 37.9 31.6 59 67 A K H >< S+ 0 0 100 -4,-2.2 3,-1.1 -5,-0.3 -1,-0.3 0.803 92.5 62.4 -58.6 -28.4 49.8 40.0 33.8 60 68 A Q T << S+ 0 0 141 -3,-1.4 -1,-0.3 -4,-0.7 3,-0.2 0.634 94.7 60.2 -73.2 -12.7 47.5 39.0 36.7 61 69 A Y T <> S+ 0 0 52 -3,-2.3 4,-2.3 -4,-0.3 3,-0.5 0.387 74.4 101.1 -99.4 9.7 48.3 35.3 36.2 62 70 A K H <> S+ 0 0 68 -3,-1.1 4,-2.5 1,-0.2 5,-0.2 0.934 83.4 42.5 -58.1 -57.0 52.0 35.7 36.8 63 71 A A H > S+ 0 0 31 1,-0.2 4,-1.7 2,-0.2 46,-0.3 0.618 112.7 57.3 -67.0 -14.3 52.2 34.5 40.5 64 72 A V H > S+ 0 0 39 -3,-0.5 4,-3.2 2,-0.2 -1,-0.2 0.873 107.5 46.4 -81.2 -41.1 49.7 31.7 39.5 65 73 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.979 116.9 44.5 -62.9 -50.6 52.2 30.5 36.8 66 74 A Y H X S+ 0 0 19 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.934 114.3 50.2 -57.4 -48.2 55.0 30.7 39.4 67 75 A S H X S+ 0 0 53 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.928 111.8 46.4 -57.7 -46.6 52.9 29.1 41.9 68 76 A N H X S+ 0 0 8 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.831 113.6 49.2 -63.9 -39.9 51.9 26.2 39.6 69 77 A T H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.906 111.6 47.9 -65.5 -46.6 55.6 25.7 38.5 70 78 A I H X S+ 0 0 14 -4,-2.8 4,-3.0 -5,-0.2 5,-0.2 0.956 113.4 48.0 -61.6 -46.6 56.9 25.6 42.1 71 79 A Q H X S+ 0 0 98 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.872 110.0 53.5 -59.9 -43.5 54.2 23.2 43.1 72 80 A S H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.961 112.5 41.7 -59.7 -52.5 54.9 21.0 40.1 73 81 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 3,-0.4 0.960 113.2 53.0 -65.2 -43.8 58.6 20.7 40.8 74 82 A I H X S+ 0 0 26 -4,-3.0 4,-3.2 -5,-0.2 5,-0.2 0.898 106.9 54.0 -57.5 -35.3 58.1 20.2 44.5 75 83 A A H X S+ 0 0 20 -4,-2.0 4,-1.5 -5,-0.2 -1,-0.2 0.872 110.3 45.4 -66.4 -39.1 55.6 17.4 43.8 76 84 A I H X S+ 0 0 0 -4,-1.7 4,-1.6 -3,-0.4 -2,-0.2 0.919 115.8 47.1 -69.3 -38.9 58.1 15.5 41.6 77 85 A I H X S+ 0 0 13 -4,-2.5 4,-1.2 1,-0.2 3,-0.5 0.960 112.1 47.9 -69.7 -50.0 60.9 16.0 44.1 78 86 A R H X S+ 0 0 132 -4,-3.2 4,-1.5 -5,-0.3 3,-0.4 0.905 110.6 55.8 -60.1 -31.1 58.8 15.0 47.1 79 87 A A H X S+ 0 0 5 -4,-1.5 4,-4.0 -5,-0.2 5,-0.3 0.840 95.2 62.4 -67.1 -40.1 57.8 11.9 45.0 80 88 A M H X>S+ 0 0 6 -4,-1.6 5,-1.8 -3,-0.5 4,-1.4 0.886 103.9 54.1 -54.3 -34.8 61.3 10.7 44.4 81 89 A G H ><5S+ 0 0 44 -4,-1.2 3,-0.6 -3,-0.4 -2,-0.2 0.991 112.9 37.5 -63.5 -59.6 61.4 10.4 48.1 82 90 A R H 3<5S+ 0 0 207 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.868 125.1 41.9 -60.6 -37.1 58.3 8.2 48.4 83 91 A L H 3<5S- 0 0 40 -4,-4.0 -1,-0.2 -5,-0.1 -2,-0.2 0.562 107.6-125.6 -87.5 -11.3 59.2 6.3 45.2 84 92 A K T <<5 + 0 0 180 -4,-1.4 2,-0.5 -3,-0.6 -3,-0.2 0.932 48.7 159.8 69.4 45.5 62.9 6.1 46.1 85 93 A I < - 0 0 32 -5,-1.8 -1,-0.2 -6,-0.1 2,-0.1 -0.873 29.8-142.0 -99.2 130.9 64.3 7.6 42.9 86 94 A D - 0 0 134 -2,-0.5 2,-0.3 1,-0.1 4,-0.0 -0.454 26.6 -94.8 -81.2 174.0 67.9 8.9 43.3 87 95 A F - 0 0 44 1,-0.1 3,-0.1 40,-0.1 -1,-0.1 -0.648 26.3-127.4 -91.0 136.3 69.2 12.1 41.6 88 96 A G S S+ 0 0 34 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.774 105.2 17.1 -50.0 -32.9 71.0 11.5 38.4 89 97 A D S > S- 0 0 106 0, 0.0 3,-1.4 0, 0.0 4,-0.2 -0.974 81.9-136.5-140.8 128.1 73.9 13.5 39.9 90 98 A A T 3 S+ 0 0 79 -2,-0.4 3,-0.3 1,-0.3 4,-0.2 0.427 95.4 79.3 -74.1 3.0 73.9 13.9 43.7 91 99 A A T >> S+ 0 0 50 1,-0.2 3,-2.1 2,-0.2 4,-0.6 0.841 85.0 67.9 -72.9 -27.7 74.8 17.6 43.5 92 100 A R H X> S+ 0 0 55 -3,-1.4 4,-2.1 1,-0.3 3,-0.7 0.791 79.9 74.9 -61.9 -28.0 71.1 18.0 42.7 93 101 A A H 3> S+ 0 0 46 -3,-0.3 4,-1.2 1,-0.3 -1,-0.3 0.751 95.0 51.8 -57.3 -21.6 70.3 16.9 46.3 94 102 A D H <> S+ 0 0 81 -3,-2.1 4,-2.2 2,-0.2 -1,-0.3 0.786 106.0 51.5 -83.9 -32.2 71.5 20.4 47.3 95 103 A D H < S+ 0 0 26 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.931 123.8 41.6 -62.6 -48.8 63.3 29.4 48.7 103 111 A A H >< S+ 0 0 21 -4,-3.5 3,-1.6 -5,-0.3 -1,-0.2 0.901 112.4 57.6 -64.9 -39.4 59.7 28.0 48.5 104 112 A G H 3< S+ 0 0 62 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.666 99.3 58.5 -66.6 -19.9 59.7 27.7 52.4 105 113 A A T << S+ 0 0 89 -4,-1.1 2,-0.4 -3,-0.6 -1,-0.3 0.225 99.7 74.5 -97.2 22.5 60.4 31.3 52.9 106 114 A A < - 0 0 50 -3,-1.6 3,-0.1 1,-0.1 4,-0.0 -0.963 51.6-165.0-140.6 147.1 57.4 32.5 51.0 107 115 A E S S+ 0 0 214 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.906 84.9 32.1 -83.1 -46.0 53.5 32.8 51.3 108 116 A E S S- 0 0 146 1,-0.1 -1,-0.2 -42,-0.0 -44,-0.1 -0.742 97.0 -78.8-115.3 157.7 52.9 33.5 47.6 109 117 A G + 0 0 13 -46,-0.3 2,-0.3 -2,-0.3 -42,-0.2 -0.124 52.4 159.0 -56.3 146.2 54.4 32.4 44.2 110 118 A F - 0 0 49 -44,-0.2 2,-0.3 -45,-0.1 -40,-0.1 -0.957 28.4-142.2-159.3 169.7 57.6 34.0 42.9 111 119 A M + 0 0 27 -2,-0.3 2,-0.3 44,-0.1 3,-0.1 -0.984 18.7 173.2-146.3 136.0 60.4 33.5 40.5 112 120 A T > - 0 0 54 -2,-0.3 4,-4.6 1,-0.1 5,-0.2 -0.950 45.3-113.4-136.9 156.0 64.0 34.5 41.0 113 121 A A H > S+ 0 0 91 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.887 123.6 50.5 -58.5 -35.8 67.1 33.9 38.8 114 122 A E H > S+ 0 0 106 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.951 113.7 41.1 -65.6 -51.7 68.3 31.9 41.8 115 123 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.910 112.7 57.7 -61.8 -40.7 65.0 29.9 42.1 116 124 A A H X S+ 0 0 8 -4,-4.6 4,-2.3 1,-0.2 -1,-0.2 0.896 107.9 46.3 -57.7 -39.3 65.0 29.6 38.3 117 125 A G H X S+ 0 0 18 -4,-1.9 4,-2.5 -5,-0.2 5,-0.2 0.910 110.2 50.7 -70.6 -45.7 68.4 27.9 38.4 118 126 A V H X S+ 0 0 2 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.914 114.4 45.4 -55.4 -47.7 67.6 25.5 41.1 119 127 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.895 112.7 49.9 -66.0 -42.5 64.4 24.4 39.3 120 128 A K H X S+ 0 0 95 -4,-2.3 4,-2.8 -5,-0.3 5,-0.2 0.935 111.9 48.2 -60.3 -48.9 66.1 24.1 35.9 121 129 A R H X S+ 0 0 101 -4,-2.5 4,-0.7 2,-0.2 -1,-0.2 0.879 115.2 45.1 -58.2 -45.8 69.0 22.0 37.3 122 130 A L H >< S+ 0 0 0 -4,-2.0 3,-1.5 -5,-0.2 6,-0.3 0.977 112.7 50.0 -63.6 -55.1 66.5 19.7 39.1 123 131 A W H 3< S+ 0 0 21 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.864 109.3 52.4 -51.2 -43.0 64.2 19.4 36.0 124 132 A K H 3< S+ 0 0 184 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.717 86.9 110.6 -70.2 -18.3 67.1 18.5 33.8 125 133 A D S+ 0 0 74 2,-0.2 4,-2.1 1,-0.2 -1,-0.1 0.838 102.9 50.3 -65.0 -42.6 67.7 12.2 34.9 127 135 A G H > S+ 0 0 8 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.858 113.1 46.8 -67.0 -35.2 66.5 10.9 38.2 128 136 A V H > S+ 0 0 0 -6,-0.3 4,-3.2 2,-0.2 -2,-0.2 0.943 111.7 51.3 -70.0 -42.8 64.0 13.7 38.4 129 137 A Q H X S+ 0 0 50 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.858 108.3 52.9 -59.5 -34.1 63.0 13.0 34.8 130 138 A A H X S+ 0 0 39 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.900 110.4 46.0 -68.7 -44.4 62.6 9.4 35.8 131 139 A C H >< S+ 0 0 0 -4,-2.0 3,-1.4 2,-0.2 -2,-0.2 0.932 110.2 54.6 -63.5 -41.9 60.3 10.4 38.7 132 140 A F H >< S+ 0 0 40 -4,-3.2 3,-2.3 1,-0.3 -2,-0.2 0.971 102.7 57.6 -54.7 -48.1 58.5 12.7 36.3 133 141 A N H 3< S+ 0 0 99 -4,-2.8 3,-0.3 1,-0.3 -1,-0.3 0.733 101.7 55.5 -60.6 -14.4 58.0 9.8 34.1 134 142 A R T X< + 0 0 89 -3,-1.4 3,-3.0 -4,-0.8 -1,-0.3 0.094 67.4 132.0-105.5 31.2 56.2 8.0 36.9 135 143 A S G X + 0 0 34 -3,-2.3 3,-1.2 1,-0.3 5,-0.2 0.619 59.0 70.2 -55.7 -19.3 53.7 10.7 37.4 136 144 A R G 3 S+ 0 0 68 -3,-0.3 74,-1.0 1,-0.2 -1,-0.3 0.671 91.3 64.0 -76.0 -11.4 50.7 8.3 37.4 137 145 A E G < S+ 0 0 83 -3,-3.0 2,-0.3 72,-0.1 -1,-0.2 0.482 113.3 19.0 -89.0 -1.3 52.1 7.1 40.7 138 146 A Y S < S- 0 0 38 -3,-1.2 2,-0.6 -4,-0.2 72,-0.1 -0.938 92.6 -79.2-157.1 170.7 51.5 10.5 42.5 139 147 A Q + 0 0 180 -2,-0.3 2,-0.3 -64,-0.1 -3,-0.1 -0.727 56.3 158.4 -84.4 114.0 49.6 13.8 42.2 140 148 A L - 0 0 29 -2,-0.6 -68,-0.1 -5,-0.2 -2,-0.0 -1.000 44.8-102.0-140.2 136.4 51.2 16.2 39.7 141 149 A N > - 0 0 20 -2,-0.3 3,-1.4 -73,-0.2 4,-0.3 -0.250 23.1-135.2 -56.1 139.6 49.9 19.2 37.7 142 150 A D T 3 S+ 0 0 55 1,-0.3 4,-0.4 2,-0.1 3,-0.2 0.732 107.3 54.9 -67.7 -24.0 49.1 18.4 34.0 143 151 A S T 3> S+ 0 0 16 25,-0.2 4,-3.1 1,-0.2 5,-0.3 0.389 78.3 105.5 -89.8 2.4 50.8 21.6 33.1 144 152 A A H <> S+ 0 0 1 -3,-1.4 4,-3.5 1,-0.2 5,-0.2 0.931 85.3 35.1 -47.2 -64.5 54.0 20.6 34.9 145 153 A A H > S+ 0 0 22 -4,-0.3 4,-3.0 -3,-0.2 5,-0.3 0.910 115.1 59.8 -62.5 -37.6 56.1 19.8 31.8 146 154 A Y H > S+ 0 0 42 -4,-0.4 4,-0.6 1,-0.2 -1,-0.2 0.949 116.3 31.9 -51.9 -54.2 54.5 22.6 29.9 147 155 A Y H >< S+ 0 0 0 -4,-3.1 3,-0.9 2,-0.2 -2,-0.2 0.917 118.9 52.8 -71.1 -47.0 55.7 25.1 32.5 148 156 A L H >< S+ 0 0 4 -4,-3.5 3,-1.6 -5,-0.3 4,-0.2 0.924 106.1 52.2 -60.2 -44.2 58.9 23.4 33.4 149 157 A N H 3< S+ 0 0 113 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.695 113.5 46.2 -65.4 -18.5 60.2 23.1 29.9 150 158 A D T + 0 0 4 -3,-1.6 4,-4.5 1,-0.2 5,-0.3 0.937 67.0 55.2 -56.3 -56.3 61.2 28.0 32.6 152 160 A D H > S+ 0 0 89 1,-0.3 4,-1.7 2,-0.3 -1,-0.2 0.855 110.9 46.0 -47.9 -46.9 63.7 30.4 31.2 153 161 A R H >4 S+ 0 0 66 1,-0.2 3,-0.6 2,-0.2 -1,-0.3 0.957 118.6 42.2 -60.2 -47.9 61.0 32.3 29.3 154 162 A I H 3< S+ 0 0 0 -4,-2.3 -2,-0.3 1,-0.3 -1,-0.2 0.881 111.9 56.8 -66.8 -36.2 58.9 32.3 32.5 155 163 A A H 3< S+ 0 0 18 -4,-4.5 -1,-0.3 -5,-0.2 -2,-0.2 0.740 78.3 115.1 -68.0 -26.7 62.0 33.1 34.5 156 164 A Q S X< S- 0 0 76 -4,-1.7 3,-2.2 -3,-0.6 -3,-0.0 -0.228 71.9-129.2 -50.5 130.6 62.7 36.3 32.6 157 165 A P T 3 S+ 0 0 106 0, 0.0 -1,-0.2 0, 0.0 -46,-0.0 0.693 107.8 46.2 -53.9 -30.0 62.4 39.3 34.8 158 166 A N T 3 S+ 0 0 152 2,-0.1 -2,-0.1 0, 0.0 -3,-0.1 0.086 85.7 153.8-106.1 28.5 60.2 41.1 32.4 159 167 A Y < - 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0 0 1 -56,-2.5 -53,-2.5 -2,-0.7 2,-0.4 -0.751 41.5-157.9-123.9 163.6 39.2 17.8 22.8 297 325 A C > - 0 0 10 -2,-0.3 3,-1.7 3,-0.2 7,-0.3 -0.922 22.2-163.6-129.0 99.8 42.3 19.6 23.9 298 326 A A T 3 S+ 0 0 4 -2,-0.4 -254,-0.1 1,-0.3 6,-0.1 0.697 85.7 57.0 -63.2 -22.4 40.8 22.4 26.0 299 327 A T T 3 S+ 0 0 22 1,-0.1 2,-0.9 -131,-0.0 -1,-0.3 0.509 87.4 87.8 -86.8 -6.2 44.0 24.4 26.1 300 328 A D <> - 0 0 74 -3,-1.7 4,-1.9 1,-0.2 3,-0.4 -0.834 63.4-164.4 -96.6 100.6 44.0 24.5 22.2 301 329 A T H > S+ 0 0 35 -2,-0.9 4,-2.1 1,-0.2 -1,-0.2 0.810 86.0 53.1 -56.5 -34.7 41.9 27.5 21.3 302 330 A K H > S+ 0 0 167 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.888 108.8 48.2 -70.1 -40.6 41.6 26.4 17.6 303 331 A N H > S+ 0 0 22 -3,-0.4 4,-3.5 2,-0.2 5,-0.2 0.885 114.0 47.1 -66.6 -42.1 40.3 22.9 18.5 304 332 A V H X S+ 0 0 2 -4,-1.9 4,-3.5 -7,-0.3 5,-0.2 0.894 111.2 50.5 -68.0 -38.9 37.8 24.4 20.9 305 333 A Q H X S+ 0 0 103 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.982 115.2 44.9 -62.3 -55.0 36.7 27.0 18.4 306 334 A F H X S+ 0 0 144 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.949 116.7 43.6 -49.9 -61.4 36.2 24.2 15.9 307 335 A V H X S+ 0 0 3 -4,-3.5 4,-2.9 1,-0.2 3,-0.3 0.942 113.5 52.0 -54.4 -43.6 34.4 21.9 18.3 308 336 A F H X S+ 0 0 1 -4,-3.5 4,-2.5 1,-0.3 -1,-0.2 0.854 104.4 55.1 -68.2 -31.1 32.2 24.7 19.7 309 337 A D H X S+ 0 0 63 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.3 0.918 112.8 44.2 -62.8 -40.8 31.1 25.7 16.3 310 338 A A H X S+ 0 0 31 -4,-1.7 4,-1.8 -3,-0.3 -2,-0.2 0.880 111.0 51.7 -67.3 -52.2 30.0 22.1 15.8 311 339 A V H X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.893 109.4 54.9 -53.6 -40.1 28.4 21.8 19.2 312 340 A T H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.882 103.6 51.0 -62.9 -44.6 26.6 25.0 18.3 313 341 A D H X S+ 0 0 51 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.871 107.4 55.0 -64.1 -33.7 25.1 23.8 15.0 314 342 A V H X S+ 0 0 26 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.913 108.1 49.9 -62.1 -44.3 23.7 20.7 16.9 315 343 A I H X>S+ 0 0 0 -4,-1.6 4,-3.5 2,-0.2 5,-0.9 0.955 111.0 48.0 -58.8 -47.5 22.0 23.1 19.4 316 344 A I H X5S+ 0 0 8 -4,-2.3 4,-1.1 1,-0.2 5,-0.2 0.962 115.9 44.8 -59.5 -49.4 20.4 25.1 16.6 317 345 A K H <5S+ 0 0 101 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.790 127.7 26.0 -68.2 -31.6 19.2 22.0 14.8 318 346 A N H <5S+ 0 0 67 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.835 132.4 22.6-100.9 -39.3 17.9 20.2 17.9 319 347 A N H ><5S+ 0 0 7 -4,-3.5 3,-2.1 -5,-0.3 4,-0.5 0.569 77.3 104.8-111.6 -5.8 17.0 22.9 20.4 320 348 A L G ><