==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-DEC-09 2KR9 . COMPND 2 MOLECULE: KALIRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR V.Y.GORBATYUK,M.R.SCHILLER,J.C.HOCH . 190 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11087.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 77.9 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 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 18.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 48.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 4.2 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 1 2 1 0 3 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 1 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 . 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 1 A G 0 0 114 0, 0.0 2,-2.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-143.1 -19.2 20.2 23.6 2 2 A P + 0 0 149 0, 0.0 2,-0.2 0, 0.0 0, 0.0 -0.141 360.0 100.8 -77.3 46.3 -16.5 18.1 21.7 3 3 A L - 0 0 150 -2,-2.1 0, 0.0 0, 0.0 0, 0.0 -0.492 63.5-144.4-115.6-172.0 -18.5 14.9 22.0 4 4 A G > + 0 0 53 -2,-0.2 3,-0.5 2,-0.0 4,-0.3 -0.018 60.6 112.5-150.0 36.6 -20.7 13.0 19.6 5 5 A S T 3 + 0 0 95 1,-0.2 3,-0.0 2,-0.1 -1,-0.0 0.884 68.1 64.5 -85.7 -42.3 -23.5 11.5 21.6 6 6 A P T 3 S- 0 0 116 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.338 117.1-107.7 -60.4 11.1 -26.5 13.5 20.2 7 7 A E < - 0 0 165 -3,-0.5 -2,-0.1 1,-0.1 -3,-0.0 0.705 35.2-159.3 66.7 128.0 -25.6 11.7 16.9 8 8 A F + 0 0 162 -4,-0.3 2,-1.5 -3,-0.0 -1,-0.1 -0.636 12.3 179.9-143.0 80.4 -24.0 13.7 14.0 9 9 A P - 0 0 72 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.162 56.8 -93.2 -76.0 45.1 -24.4 12.1 10.5 10 10 A G - 0 0 32 -2,-1.5 2,-0.5 1,-0.1 5,-0.1 0.037 48.6 -72.1 73.6 174.8 -22.5 14.9 8.8 11 11 A R S S+ 0 0 223 4,-0.2 2,-0.2 3,-0.1 -1,-0.1 -0.938 84.2 44.5-122.1 110.6 -23.8 18.0 7.1 12 12 A K S > S- 0 0 157 -2,-0.5 3,-0.6 1,-0.1 6,-0.1 -0.614 91.1 -75.9 153.1 171.9 -25.7 18.2 3.8 13 13 A K T 3 S+ 0 0 160 1,-0.3 2,-1.3 -2,-0.2 3,-0.2 0.930 130.6 47.8 -49.2 -49.2 -28.6 16.5 2.0 14 14 A E T 3> S+ 0 0 32 1,-0.2 4,-1.5 -3,-0.1 -1,-0.3 -0.568 79.2 171.4 -97.8 70.4 -26.2 13.6 1.2 15 15 A F T <4 S+ 0 0 109 -2,-1.3 4,-0.5 -3,-0.6 -4,-0.2 0.897 74.4 8.6 -33.9 -72.1 -24.9 13.2 4.7 16 16 A I T > S+ 0 0 32 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.635 117.7 69.8-108.4 -21.0 -22.9 10.1 4.4 17 17 A M H > S+ 0 0 5 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.838 102.8 52.0 -57.0 -29.9 -22.9 9.5 0.7 18 18 A A H X S+ 0 0 25 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.854 101.5 59.0 -75.1 -34.3 -20.7 12.6 0.8 19 19 A E H > S+ 0 0 71 -4,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.771 113.0 38.8 -61.0 -26.5 -18.6 10.7 3.3 20 20 A L H X S+ 0 0 2 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.899 113.9 52.4 -92.0 -44.3 -18.1 8.0 0.7 21 21 A L H X S+ 0 0 19 -4,-3.0 4,-1.4 1,-0.2 -2,-0.2 0.861 112.7 48.5 -50.4 -39.1 -17.8 10.4 -2.3 22 22 A Q H X S+ 0 0 126 -4,-2.5 4,-3.2 2,-0.2 -1,-0.2 0.852 106.0 55.2 -75.3 -32.8 -15.1 12.3 -0.3 23 23 A T H X S+ 0 0 5 -4,-0.7 4,-2.1 2,-0.2 -2,-0.2 0.796 102.6 57.5 -78.6 -30.1 -13.1 9.1 0.6 24 24 A E H X S+ 0 0 0 -4,-2.1 4,-3.5 2,-0.2 5,-0.4 0.994 113.6 38.6 -42.9 -68.2 -12.8 8.2 -3.0 25 25 A K H X S+ 0 0 94 -4,-1.4 4,-2.0 1,-0.3 5,-0.3 0.918 118.5 48.8 -61.3 -45.7 -11.1 11.5 -3.7 26 26 A A H X S+ 0 0 44 -4,-3.2 4,-1.9 2,-0.2 -1,-0.3 0.863 117.0 44.1 -51.3 -39.2 -9.2 11.3 -0.4 27 27 A Y H X S+ 0 0 0 -4,-2.1 4,-1.5 -3,-0.2 -2,-0.2 0.941 115.3 43.1 -81.7 -47.2 -8.2 7.7 -1.3 28 28 A V H X S+ 0 0 11 -4,-3.5 4,-1.9 2,-0.2 -3,-0.2 0.835 119.9 46.0 -66.6 -27.8 -7.2 8.2 -5.0 29 29 A R H X S+ 0 0 153 -4,-2.0 4,-2.5 -5,-0.4 -2,-0.2 0.902 112.0 48.9 -79.9 -41.6 -5.4 11.4 -4.0 30 30 A D H < S+ 0 0 11 -4,-1.9 4,-0.4 -5,-0.3 -2,-0.2 0.705 113.6 48.7 -71.9 -15.5 -3.6 9.9 -1.0 31 31 A L H X S+ 0 0 2 -4,-1.5 4,-2.3 2,-0.2 3,-0.5 0.892 109.1 53.7 -82.6 -43.8 -2.6 7.0 -3.2 32 32 A H H X S+ 0 0 50 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.925 109.1 46.8 -47.6 -54.3 -1.4 9.5 -5.9 33 33 A E H < S+ 0 0 74 -4,-2.5 4,-0.5 1,-0.2 5,-0.3 0.693 110.2 56.0 -73.1 -16.4 0.9 11.3 -3.4 34 34 A C H >>>S+ 0 0 0 -3,-0.5 5,-1.6 -4,-0.4 3,-1.2 0.966 107.8 43.8 -75.4 -58.4 2.2 8.0 -2.2 35 35 A L H 3<>S+ 0 0 18 -4,-2.3 5,-1.9 1,-0.3 -2,-0.2 0.882 114.8 52.1 -51.4 -40.1 3.5 6.6 -5.5 36 36 A E T 3<5S+ 0 0 116 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.664 122.6 25.6 -75.4 -18.2 5.0 10.0 -6.4 37 37 A T T <>5S+ 0 0 5 -3,-1.2 4,-2.1 -4,-0.5 5,-0.2 0.752 129.7 17.8-107.6 -82.2 6.9 10.3 -3.1 38 38 A Y H X5S+ 0 0 4 -4,-0.5 4,-0.7 -5,-0.3 -3,-0.2 0.821 131.4 41.5 -71.2 -32.0 8.0 7.2 -1.1 39 39 A L H >S+ 0 0 7 -4,-2.1 5,-1.0 1,-0.2 6,-0.7 0.766 112.2 48.9 -72.7 -19.5 12.3 7.5 -4.7 42 42 A M H <5S+ 0 0 12 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.800 116.3 42.0 -87.6 -27.3 12.8 3.8 -3.8 43 43 A T H <5S+ 0 0 83 -4,-1.9 -2,-0.2 -3,-0.3 -1,-0.2 0.604 111.7 55.6 -90.8 -15.4 12.3 2.6 -7.4 44 44 A S T <5S- 0 0 46 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.428 96.5-139.5 -99.5 1.2 14.3 5.5 -8.9 45 45 A G T 5 + 0 0 62 -4,-0.3 -3,-0.1 -5,-0.1 -4,-0.1 0.859 60.3 129.4 49.3 49.3 17.4 4.6 -6.9 46 46 A V < + 0 0 82 -5,-1.0 2,-0.3 2,-0.0 -1,-0.1 0.582 64.2 46.0-111.0 -17.1 18.3 8.3 -6.1 47 47 A E S S- 0 0 81 -6,-0.7 2,-0.9 0, 0.0 77,-0.0 -0.815 97.3 -94.2-119.3 162.9 18.7 7.9 -2.4 48 48 A E - 0 0 163 -2,-0.3 76,-0.0 -3,-0.1 -6,-0.0 -0.698 42.6-165.2 -79.6 108.0 20.5 5.4 -0.3 49 49 A I - 0 0 24 -2,-0.9 5,-0.1 -7,-0.1 72,-0.1 -0.851 27.9-106.1 -97.4 125.2 17.9 2.8 0.7 50 50 A P >> - 0 0 35 0, 0.0 3,-1.9 0, 0.0 4,-1.5 -0.176 32.9-109.0 -50.4 140.9 18.8 0.4 3.5 51 51 A P T 34 S+ 0 0 118 0, 0.0 4,-0.2 0, 0.0 70,-0.1 0.491 114.4 59.4 -53.5 -5.7 19.6 -3.2 2.3 52 52 A G T 34 S+ 0 0 20 68,-0.5 69,-0.1 64,-0.1 68,-0.1 0.782 113.4 26.9 -95.4 -29.7 16.4 -4.4 3.8 53 53 A I T X4 S+ 0 0 0 -3,-1.9 3,-2.0 67,-0.4 7,-0.2 0.569 88.9 96.5-115.6 -11.6 13.8 -2.3 2.0 54 54 A L T 3< S+ 0 0 56 -4,-1.5 3,-0.5 1,-0.3 -9,-0.1 0.891 104.2 24.2 -45.1 -52.6 15.3 -1.5 -1.5 55 55 A N T 3 S+ 0 0 107 1,-0.2 -1,-0.3 -4,-0.2 3,-0.2 0.056 111.5 80.3-104.4 22.8 13.6 -4.3 -3.3 56 56 A K X> + 0 0 82 -3,-2.0 4,-3.0 1,-0.1 3,-2.0 0.002 48.2 115.9-115.9 20.5 11.0 -4.4 -0.7 57 57 A E H 3> S+ 0 0 47 -3,-0.5 4,-2.1 1,-0.3 5,-0.2 0.866 77.3 57.8 -50.6 -36.9 9.0 -1.4 -2.1 58 58 A H H 34 S+ 0 0 107 -3,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.449 110.9 42.1 -78.7 -2.2 6.3 -4.0 -2.6 59 59 A I H <4 S+ 0 0 17 -3,-2.0 -2,-0.2 -6,-0.2 -1,-0.2 0.759 109.7 54.5-103.2 -51.1 6.4 -4.7 1.2 60 60 A I H < S+ 0 0 3 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.899 135.5 7.8 -49.1 -48.4 6.7 -1.1 2.4 61 61 A F S >< S- 0 0 6 -4,-2.1 3,-1.2 1,-0.3 -1,-0.2 0.294 94.2-150.5-121.6 10.6 3.6 -0.1 0.5 62 62 A G T 3 - 0 0 18 -6,-0.2 -1,-0.3 1,-0.2 3,-0.2 -0.349 66.1 -28.3 62.3-127.8 2.3 -3.5 -0.8 63 63 A N T > S+ 0 0 57 1,-0.1 3,-0.9 39,-0.1 4,-0.5 -0.286 88.5 135.0-116.1 44.1 0.5 -3.2 -4.0 64 64 A I T X> + 0 0 6 -3,-1.2 4,-1.7 1,-0.2 3,-0.9 0.760 60.7 71.2 -67.1 -23.5 -0.8 0.3 -3.6 65 65 A Q H 3> S+ 0 0 104 1,-0.3 4,-1.3 -3,-0.2 -1,-0.2 0.886 96.6 50.9 -60.5 -37.3 0.1 1.2 -7.2 66 66 A E H <> S+ 0 0 80 -3,-0.9 4,-1.0 1,-0.2 -1,-0.3 0.664 105.3 58.7 -76.1 -17.4 -2.7 -0.9 -8.5 67 67 A I H <> S+ 0 0 1 -3,-0.9 4,-1.9 -4,-0.5 5,-0.2 0.937 103.3 48.5 -78.1 -51.1 -5.1 0.8 -6.1 68 68 A Y H >X S+ 0 0 64 -4,-1.7 4,-3.1 2,-0.2 3,-0.6 0.969 113.3 45.2 -49.7 -62.5 -4.6 4.4 -7.4 69 69 A D H 3X S+ 0 0 67 -4,-1.3 4,-1.5 1,-0.3 -1,-0.2 0.871 115.2 46.9 -55.3 -44.1 -5.0 3.7 -11.1 70 70 A F H 3X>S+ 0 0 69 -4,-1.0 5,-1.0 -5,-0.2 4,-0.5 0.785 117.3 42.3 -74.3 -29.1 -8.0 1.4 -10.7 71 71 A H H <<>S+ 0 0 13 -4,-1.9 5,-1.7 -3,-0.6 6,-0.6 0.931 111.7 51.8 -80.7 -48.5 -9.8 3.9 -8.4 72 72 A N H <5S+ 0 0 27 -4,-3.1 -2,-0.2 1,-0.2 5,-0.2 0.797 121.2 34.8 -61.0 -28.7 -9.1 7.1 -10.2 73 73 A N H <5S+ 0 0 103 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.582 139.2 7.5-100.9 -10.8 -10.3 5.6 -13.5 74 74 A I T X5S+ 0 0 44 -4,-0.5 4,-1.4 -3,-0.4 5,-0.3 0.484 120.3 42.7-128.5 -83.3 -13.1 3.5 -12.0 75 75 A F H >>>< S+ 0 0 31 -4,-2.1 3,-0.8 1,-0.3 -1,-0.2 0.673 93.6 65.5 -60.2 -13.4 -20.0 10.2 -8.4 81 81 A K G 3 S+ 0 0 138 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.466 98.3 53.7 -84.0 -1.3 -22.8 8.8 -10.5 82 82 A Y G X S+ 0 0 27 -3,-2.9 3,-2.1 1,-0.1 -1,-0.2 0.206 73.0 106.9-114.2 7.3 -24.5 7.8 -7.3 83 83 A E T < S+ 0 0 94 -3,-0.8 -2,-0.1 1,-0.3 -1,-0.1 0.809 86.9 42.8 -57.6 -30.4 -24.3 11.2 -5.8 84 84 A Q T 3 S+ 0 0 148 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.329 122.7 40.9 -95.9 8.4 -28.1 11.5 -6.3 85 85 A L X + 0 0 60 -3,-2.1 3,-1.7 1,-0.1 -1,-0.2 -0.563 45.6 170.9-163.2 85.1 -28.7 7.9 -5.1 86 86 A P G > S+ 0 0 23 0, 0.0 3,-0.8 0, 0.0 4,-0.2 0.574 82.4 76.3 -70.7 -8.3 -26.9 6.3 -2.1 87 87 A E G 3 S+ 0 0 57 1,-0.2 81,-0.3 2,-0.1 3,-0.2 0.650 92.3 52.2 -71.9 -14.5 -29.4 3.5 -2.7 88 88 A D G < S+ 0 0 54 -3,-1.7 4,-0.3 -6,-0.2 -1,-0.2 0.370 84.8 82.3-106.3 7.2 -27.3 2.4 -5.6 89 89 A V S <> S+ 0 0 0 -3,-0.8 4,-1.8 1,-0.2 5,-0.2 0.636 79.4 67.3 -91.2 -9.5 -23.9 2.1 -4.0 90 90 A G H > S+ 0 0 0 -3,-0.2 4,-1.4 -4,-0.2 -1,-0.2 0.869 98.7 54.3 -66.5 -34.2 -24.7 -1.3 -2.6 91 91 A H H > S+ 0 0 76 1,-0.2 4,-1.4 -4,-0.2 -1,-0.2 0.704 106.1 54.9 -67.3 -19.7 -24.6 -2.3 -6.2 92 92 A C H > S+ 0 0 2 -4,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.867 103.0 49.6 -90.2 -40.1 -21.1 -0.8 -6.4 93 93 A F H < S+ 0 0 0 -4,-1.8 -2,-0.2 1,-0.2 7,-0.2 0.874 120.7 40.7 -63.6 -33.6 -19.4 -2.7 -3.6 94 94 A V H >< S+ 0 0 50 -4,-1.4 3,-2.1 2,-0.2 4,-0.4 0.821 102.6 66.7 -79.2 -34.6 -20.8 -5.8 -5.3 95 95 A T H 3< S+ 0 0 65 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.859 120.5 24.8 -54.4 -31.9 -20.1 -4.7 -8.9 96 96 A W T 3X S+ 0 0 68 -4,-1.1 4,-0.8 1,-0.1 -1,-0.3 -0.015 87.9 123.6-120.2 19.4 -16.5 -5.0 -7.9 97 97 A A T X4 S+ 0 0 22 -3,-2.1 3,-1.3 1,-0.3 -2,-0.1 0.904 76.8 47.8 -55.7 -48.1 -16.9 -7.5 -5.1 98 98 A D G >4 S+ 0 0 140 -4,-0.4 3,-1.7 1,-0.3 -1,-0.3 0.847 105.0 60.5 -63.8 -31.5 -14.5 -10.0 -6.6 99 99 A K G >4 S+ 0 0 85 1,-0.3 3,-1.5 -3,-0.3 -1,-0.3 0.688 88.5 74.6 -69.0 -14.5 -12.0 -7.2 -7.2 100 100 A F G X< S+ 0 0 9 -3,-1.3 3,-1.0 -4,-0.8 4,-0.4 0.522 71.5 83.9 -77.7 -1.4 -12.0 -6.8 -3.4 101 101 A Q G X> S+ 0 0 84 -3,-1.7 4,-1.2 1,-0.2 3,-0.7 0.725 77.0 70.0 -68.3 -20.1 -9.9 -9.9 -3.2 102 102 A M H <> S+ 0 0 37 -3,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.808 91.3 58.8 -64.9 -27.9 -7.1 -7.5 -3.8 103 103 A Y H <> S+ 0 0 19 -3,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.706 98.4 57.9 -75.1 -19.7 -7.7 -6.2 -0.3 104 104 A V H <> S+ 0 0 17 -3,-0.7 4,-1.2 -4,-0.4 -1,-0.2 0.880 109.2 45.7 -75.7 -35.2 -7.1 -9.7 1.2 105 105 A T H X S+ 0 0 71 -4,-1.2 4,-1.2 2,-0.2 3,-0.4 0.955 110.0 54.5 -65.2 -51.2 -3.6 -9.6 -0.4 106 106 A Y H >< S+ 0 0 12 -4,-2.2 3,-0.6 1,-0.2 4,-0.5 0.899 109.3 46.1 -51.2 -50.2 -3.0 -6.1 0.8 107 107 A C H >< S+ 0 0 40 -4,-1.6 3,-0.8 1,-0.2 -1,-0.2 0.827 104.1 61.1 -68.7 -31.1 -3.7 -6.9 4.5 108 108 A K H 3< S+ 0 0 30 -4,-1.2 4,-0.3 -3,-0.4 -1,-0.2 0.805 109.7 43.0 -67.7 -27.1 -1.6 -10.1 4.5 109 109 A N T S+ 0 0 14 -3,-0.8 4,-2.3 -4,-0.5 -2,-0.2 0.932 85.2 42.4 -57.1 -57.2 0.6 -5.3 6.1 111 111 A P H > S+ 0 0 76 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.904 115.7 48.5 -62.2 -42.6 2.4 -6.5 9.4 112 112 A D H > S+ 0 0 39 -4,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.836 109.2 55.6 -67.2 -30.7 5.6 -7.6 7.6 113 113 A S H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.944 107.1 50.2 -55.4 -51.3 5.3 -4.1 5.9 114 114 A N H X S+ 0 0 57 -4,-2.3 4,-1.6 1,-0.2 3,-0.4 0.953 107.7 52.6 -52.2 -58.3 5.3 -2.7 9.4 115 115 A Q H >X S+ 0 0 109 -4,-2.7 4,-2.0 1,-0.2 3,-0.6 0.899 110.0 48.3 -44.5 -49.9 8.3 -4.7 10.5 116 116 A L H 3<>S+ 0 0 24 -4,-2.0 5,-1.0 1,-0.3 4,-0.4 0.841 109.8 50.2 -70.2 -34.1 10.4 -3.4 7.6 117 117 A I H 3<>S+ 0 0 10 -4,-2.0 5,-0.5 -3,-0.4 -1,-0.3 0.722 116.0 45.5 -76.3 -18.6 9.5 0.3 8.0 118 118 A L H <<5S+ 0 0 107 -4,-1.6 4,-0.5 -3,-0.6 -2,-0.2 0.953 125.2 18.6 -83.0 -69.8 10.4 0.0 11.7 119 119 A E T <5S+ 0 0 84 -4,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.942 137.6 19.9 -74.6 -50.3 13.7 -1.8 11.9 120 120 A H T 5S+ 0 0 104 -5,-0.5 -68,-0.5 -4,-0.4 -67,-0.4 0.436 116.4 59.8-109.9 -0.1 15.3 -1.7 8.5 121 121 A A T > > S+ 0 0 93 -2,-0.2 3,-2.6 1,-0.2 4,-0.7 0.412 97.6 110.9 -93.6 1.1 14.4 7.5 9.1 124 124 A F H <> S+ 0 0 13 -3,-0.7 4,-1.1 1,-0.3 3,-0.5 0.759 73.9 53.7 -57.0 -32.1 14.9 7.8 5.4 125 125 A F H 3> S+ 0 0 9 -3,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.627 94.5 72.0 -78.5 -12.1 11.3 8.9 4.7 126 126 A D H <> S+ 0 0 81 -3,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.861 99.2 45.8 -71.4 -35.7 11.6 11.8 7.1 127 127 A E H X S+ 0 0 86 -4,-0.7 4,-1.6 -3,-0.5 -2,-0.2 0.917 112.5 49.2 -72.5 -43.1 13.9 13.7 4.8 128 128 A I H X S+ 0 0 0 -4,-1.1 4,-2.0 1,-0.2 5,-0.3 0.892 105.0 62.4 -61.8 -39.9 11.7 13.0 1.7 129 129 A Q H X>S+ 0 0 31 -4,-2.1 5,-2.6 1,-0.2 4,-1.4 0.932 106.3 42.5 -42.0 -57.5 8.8 14.2 3.9 130 130 A Q H <5S+ 0 0 134 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.786 108.6 58.5 -70.5 -31.1 10.3 17.7 4.2 131 131 A R H <5S+ 0 0 117 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.918 119.5 28.2 -66.0 -42.6 11.4 18.0 0.6 132 132 A H H <5S- 0 0 93 -4,-2.0 -2,-0.2 -3,-0.1 -1,-0.2 0.528 109.1-114.2 -98.1 -7.8 7.9 17.6 -0.7 133 133 A G T <5 + 0 0 60 -4,-1.4 -3,-0.2 -5,-0.3 -4,-0.1 0.871 56.4 158.3 76.9 36.9 5.9 18.9 2.2 134 134 A L < - 0 0 15 -5,-2.6 2,-1.7 -6,-0.2 -4,-0.1 0.834 20.1-172.7 -62.6 -35.7 4.3 15.6 3.1 135 135 A A + 0 0 84 -6,-0.3 2,-0.3 1,-0.0 -1,-0.2 -0.103 55.3 79.3 69.3 -37.7 3.6 16.6 6.7 136 136 A N S S- 0 0 55 -2,-1.7 5,-0.1 1,-0.1 -2,-0.0 -0.765 85.3-102.9-111.0 147.4 2.5 13.1 7.7 137 137 A S > - 0 0 66 -2,-0.3 4,-0.9 1,-0.1 3,-0.4 -0.148 27.2-118.3 -60.3 156.5 4.5 10.0 8.6 138 138 A I H >> S+ 0 0 16 1,-0.2 4,-1.4 2,-0.2 3,-1.0 0.954 111.2 60.6 -58.9 -55.2 4.9 7.1 6.1 139 139 A S H 3> S+ 0 0 45 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.791 97.0 64.2 -41.1 -38.2 3.1 4.5 8.4 140 140 A S H 3> S+ 0 0 56 -3,-0.4 4,-1.3 2,-0.2 -1,-0.3 0.933 103.9 42.3 -57.1 -52.7 0.0 6.7 8.2 141 141 A Y H X< S+ 0 0 30 -3,-1.0 3,-0.6 -4,-0.9 -2,-0.2 0.955 113.7 49.4 -63.8 -50.8 -0.5 6.3 4.4 142 142 A L H 3< S+ 0 0 0 -4,-1.4 -1,-0.2 1,-0.3 4,-0.2 0.770 114.7 44.7 -64.3 -28.3 0.2 2.5 4.2 143 143 A I H >X S+ 0 0 51 -4,-1.7 3,-1.7 -5,-0.3 4,-1.1 0.713 92.1 85.1 -83.8 -20.4 -2.2 1.7 7.1 144 144 A K H XX S+ 0 0 45 -4,-1.3 4,-2.8 -3,-0.6 3,-0.6 0.834 75.6 68.3 -52.8 -43.3 -4.9 4.1 5.8 145 145 A P H 3> S+ 0 0 1 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.868 103.4 46.2 -39.4 -40.2 -6.3 1.3 3.5 146 146 A V H <> S+ 0 0 52 -3,-1.7 4,-0.8 2,-0.2 -2,-0.2 0.787 110.8 51.2 -83.0 -25.4 -7.4 -0.5 6.7 147 147 A Q H X S+ 0 0 16 -4,-2.1 4,-3.0 1,-0.2 3,-0.8 0.967 111.5 51.3 -63.6 -54.1 -27.5 2.7 4.2 160 160 A L H 3< S+ 0 0 53 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.662 117.3 40.4 -64.7 -16.7 -28.6 -1.0 4.5 161 161 A T H 3< S+ 0 0 102 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.660 125.6 32.7-100.3 -18.6 -30.3 -0.3 7.9 162 162 A C H << S+ 0 0 83 -4,-1.5 2,-1.0 -3,-0.8 -2,-0.2 0.550 80.2 112.1-117.7 -12.2 -31.8 3.2 7.1 163 163 A C < - 0 0 33 -4,-3.0 3,-0.4 -5,-0.2 -4,-0.0 -0.553 52.4-157.8 -66.4 101.1 -32.7 3.1 3.3 164 164 A E S S+ 0 0 196 -2,-1.0 2,-0.5 1,-0.3 -1,-0.2 0.828 95.9 36.8 -43.0 -36.3 -36.5 3.3 3.4 165 165 A E S S+ 0 0 92 -3,-0.1 2,-0.9 3,-0.0 -1,-0.3 -0.867 72.3 174.1-122.0 91.7 -36.1 1.8 -0.1 166 166 A G - 0 0 32 -2,-0.5 4,-0.2 -3,-0.4 -2,-0.0 -0.455 11.6-170.9-100.3 55.7 -33.2 -0.6 0.1 167 167 A K - 0 0 123 -2,-0.9 2,-0.3 2,-0.1 -1,-0.2 0.621 47.4 -84.6 -15.9 -52.1 -33.7 -1.8 -3.5 168 168 A G S S+ 0 0 19 -81,-0.3 -78,-0.2 -3,-0.2 -77,-0.1 -0.978 96.9 78.2 165.3-172.1 -31.1 -4.6 -3.0 169 169 A E S > S+ 0 0 85 -2,-0.3 4,-2.6 1,-0.1 5,-0.1 0.260 71.3 107.7 72.0 -14.2 -27.3 -5.6 -3.2 170 170 A L H > S+ 0 0 13 -4,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.930 77.3 40.4 -70.7 -48.2 -26.7 -3.9 0.2 171 171 A K H > S+ 0 0 131 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.861 117.2 51.0 -71.6 -32.2 -26.2 -6.9 2.5 172 172 A D H > S+ 0 0 96 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.918 106.6 54.2 -65.7 -43.3 -24.2 -8.7 -0.2 173 173 A G H X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.800 111.8 47.2 -58.3 -30.8 -22.1 -5.5 -0.5 174 174 A L H X S+ 0 0 26 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.944 107.5 52.4 -71.7 -52.5 -21.6 -5.9 3.3 175 175 A E H X S+ 0 0 107 -4,-2.8 4,-1.7 1,-0.3 -2,-0.2 0.851 108.8 51.6 -59.3 -38.4 -20.7 -9.7 3.3 176 176 A V H X S+ 0 0 19 -4,-2.3 4,-1.1 1,-0.2 -1,-0.3 0.922 108.7 51.6 -59.3 -45.1 -18.0 -9.1 0.6 177 177 A M H < S+ 0 0 0 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.861 114.8 42.9 -60.3 -35.5 -16.5 -6.3 2.8 178 178 A L H X S+ 0 0 69 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.737 106.8 59.0 -87.0 -23.3 -16.4 -8.6 5.8 179 179 A S H X S+ 0 0 47 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.741 95.6 66.4 -81.2 -20.9 -15.1 -11.7 4.1 180 180 A V H X S+ 0 0 4 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.990 107.0 33.8 -65.8 -64.7 -12.0 -10.0 2.9 181 181 A P H > S+ 0 0 50 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.788 118.8 56.7 -64.5 -23.2 -10.2 -9.3 6.2 182 182 A K H >X S+ 0 0 117 -4,-0.9 4,-1.9 1,-0.2 3,-0.5 0.917 105.8 49.4 -68.4 -45.0 -11.7 -12.6 7.5 183 183 A K H 3X S+ 0 0 73 -4,-2.3 4,-3.7 1,-0.2 -1,-0.2 0.872 103.4 60.7 -58.9 -38.9 -10.1 -14.4 4.6 184 184 A A H 3< S+ 0 0 2 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.800 108.2 44.0 -63.8 -30.2 -6.7 -12.8 5.3 185 185 A N H X< S+ 0 0 116 -4,-0.9 3,-1.0 -3,-0.5 -1,-0.2 0.887 117.9 42.9 -79.2 -44.2 -6.6 -14.4 8.7 186 186 A D H 3< S+ 0 0 104 -4,-1.9 -2,-0.2 1,-0.3 3,-0.2 0.926 119.8 42.8 -68.1 -46.5 -7.8 -17.8 7.6 187 187 A A T 3< S+ 0 0 42 -4,-3.7 -1,-0.3 1,-0.2 -2,-0.1 -0.109 79.9 156.1 -86.9 29.7 -5.5 -17.8 4.5 188 188 A M < + 0 0 106 -3,-1.0 2,-0.6 2,-0.1 -1,-0.2 0.584 30.1 112.1 -33.5 -24.1 -2.8 -16.4 6.8 189 189 A H 0 0 164 -3,-0.2 -81,-0.1 1,-0.1 -1,-0.0 -0.396 360.0 360.0 -72.8 107.0 0.0 -17.6 4.6 190 190 A V 0 0 106 -2,-0.6 -1,-0.1 -82,-0.1 -2,-0.1 -0.901 360.0 360.0-100.1 360.0 1.8 -14.7 3.0