==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-FEB-00 1EJ0 . COMPND 2 MOLECULE: FTSJ; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.BUGL,E.B.FAUMAN,B.L.STAKER,F.ZHENG,S.R.KUSHNER,M.A.SAPER, . 181 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9094.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 131 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 8.3 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 . 11 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 57 31.5 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+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 0 0 0 0 0 1 2 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 3 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 2 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 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 30 A G 0 0 125 0, 0.0 3,-0.0 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 167.9 -8.9 53.5 13.7 2 31 A L + 0 0 160 1,-0.1 2,-0.3 2,-0.0 0, 0.0 0.808 360.0 21.6 -73.5 -27.4 -6.5 54.1 10.8 3 32 A R S S- 0 0 102 2,-0.0 -1,-0.1 3,-0.0 2,-0.0 -0.944 88.1-101.7-136.2 158.6 -4.3 51.2 11.8 4 33 A S > - 0 0 45 -2,-0.3 4,-2.1 1,-0.1 3,-0.2 -0.277 31.6-109.6 -76.9 163.8 -4.6 48.1 13.8 5 34 A R H > S+ 0 0 130 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.916 121.3 56.7 -56.0 -42.1 -3.4 47.5 17.4 6 35 A A H > S+ 0 0 11 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.888 103.6 52.6 -58.5 -40.7 -0.8 45.1 15.9 7 36 A W H > S+ 0 0 35 -3,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.939 110.0 48.7 -59.2 -47.9 0.5 47.9 13.6 8 37 A F H X S+ 0 0 84 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.875 106.6 55.7 -62.7 -35.8 0.9 50.2 16.7 9 38 A K H X S+ 0 0 15 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.931 110.4 45.5 -63.1 -41.1 2.7 47.4 18.7 10 39 A L H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.898 109.1 54.8 -70.7 -35.5 5.3 47.1 15.9 11 40 A D H X S+ 0 0 33 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.931 107.6 51.1 -60.0 -40.4 5.7 50.9 15.6 12 41 A E H X S+ 0 0 40 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.908 110.8 48.6 -62.8 -40.4 6.5 50.9 19.4 13 42 A I H X S+ 0 0 1 -4,-1.9 4,-3.1 2,-0.2 5,-0.4 0.899 109.6 51.2 -67.1 -38.1 9.1 48.2 18.8 14 43 A Q H X S+ 0 0 5 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.920 110.2 51.0 -65.6 -36.6 10.7 50.1 15.9 15 44 A Q H < S+ 0 0 123 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.889 118.6 36.4 -66.8 -38.8 10.8 53.2 18.1 16 45 A S H < S+ 0 0 58 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.814 133.5 22.0 -84.1 -29.9 12.5 51.3 21.0 17 46 A D H < S- 0 0 18 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.526 82.7-139.4-122.3 -6.8 14.8 49.0 19.0 18 47 A K < + 0 0 112 -4,-2.2 -4,-0.1 -5,-0.4 -3,-0.1 0.896 42.6 154.6 47.4 60.9 15.3 50.5 15.5 19 48 A L + 0 0 5 -6,-0.1 2,-0.5 1,-0.1 112,-0.1 0.796 45.6 69.5 -86.1 -34.2 15.0 47.2 13.6 20 49 A F + 0 0 4 -6,-0.0 -1,-0.1 4,-0.0 3,-0.0 -0.809 56.1 171.8-102.1 126.0 13.9 48.2 10.2 21 50 A K > - 0 0 110 -2,-0.5 3,-1.7 1,-0.1 22,-0.1 -0.861 44.0 -71.1-126.1 159.9 16.1 50.1 7.8 22 51 A P T 3 S+ 0 0 111 0, 0.0 23,-0.2 0, 0.0 22,-0.2 -0.185 112.7 8.8 -51.6 134.4 15.8 51.1 4.1 23 52 A G T 3 S+ 0 0 37 21,-3.1 21,-0.1 1,-0.2 22,-0.1 0.393 87.1 147.1 80.7 -2.4 16.1 48.3 1.6 24 53 A M < - 0 0 31 -3,-1.7 25,-1.7 24,-0.1 2,-0.5 -0.234 46.0-131.3 -64.0 157.6 16.0 45.3 4.0 25 54 A T E -a 49 0A 17 63,-0.4 65,-2.0 23,-0.2 66,-1.1 -0.946 32.2-173.0-107.1 129.8 14.4 42.0 3.1 26 55 A V E -ab 50 91A 0 23,-2.3 25,-2.3 -2,-0.5 2,-0.4 -0.937 22.3-144.0-130.8 146.4 12.1 40.8 5.9 27 56 A V E -ab 51 92A 1 64,-2.0 66,-3.1 -2,-0.3 2,-0.5 -0.951 16.6-164.6-109.7 130.1 10.2 37.6 6.7 28 57 A D E -ab 52 93A 0 23,-2.6 25,-2.2 -2,-0.4 3,-0.5 -0.956 3.5-165.8-121.6 109.5 6.7 38.2 8.3 29 58 A L E S+ab 53 94A 0 64,-3.0 66,-2.4 -2,-0.5 67,-0.2 -0.805 74.9 15.0-100.8 135.4 5.1 35.1 9.9 30 59 A G S S+ 0 0 1 23,-1.6 24,-0.2 -2,-0.4 -1,-0.2 0.916 82.6 164.6 68.2 48.2 1.4 35.2 10.9 31 60 A A > + 0 0 0 22,-2.6 3,-1.4 -3,-0.5 6,-0.3 0.643 12.4 149.6 -73.8 -25.4 1.0 38.3 8.8 32 61 A A T 3 + 0 0 3 1,-0.3 26,-0.1 21,-0.2 23,-0.1 -0.397 65.6 14.5 -68.5 143.3 -2.7 38.6 8.3 33 62 A P T 3 S- 0 0 103 0, 0.0 26,-0.5 0, 0.0 -1,-0.3 -0.981 107.2-113.6 -81.7 4.0 -4.5 41.0 8.0 34 63 A G <> + 0 0 5 -3,-1.4 4,-2.7 -4,-0.2 5,-0.2 0.569 68.6 130.4 121.1 10.2 -1.3 42.9 7.2 35 64 A G H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.900 80.0 45.8 -60.7 -48.1 -0.4 45.5 9.9 36 65 A W H > S+ 0 0 0 146,-1.5 4,-3.0 -5,-0.3 -1,-0.2 0.935 116.2 45.5 -64.1 -44.2 3.1 44.5 10.4 37 66 A S H > S+ 0 0 0 -6,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.928 112.7 51.2 -64.3 -43.2 3.9 44.2 6.7 38 67 A Q H X S+ 0 0 72 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.929 113.9 45.7 -57.2 -45.0 2.1 47.5 6.0 39 68 A Y H >X S+ 0 0 10 -4,-2.7 4,-0.8 -5,-0.2 3,-0.7 0.956 111.6 50.4 -63.7 -49.6 4.3 49.1 8.8 40 69 A V H >X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.3 3,-1.2 0.872 102.8 59.6 -59.1 -38.7 7.5 47.6 7.7 41 70 A V H 3X S+ 0 0 38 -4,-2.6 4,-1.7 1,-0.3 -1,-0.3 0.878 100.7 56.9 -57.9 -34.7 7.0 48.7 4.1 42 71 A T H << S+ 0 0 86 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.767 115.9 37.0 -67.2 -22.3 6.9 52.4 5.4 43 72 A Q H << S+ 0 0 60 -3,-1.2 -2,-0.2 -4,-0.8 -1,-0.2 0.818 120.3 42.0 -96.2 -38.4 10.4 51.8 7.0 44 73 A I H < S- 0 0 3 -4,-3.0 -21,-3.1 -22,-0.2 3,-0.4 0.644 100.4-150.2 -86.3 -14.6 12.2 49.6 4.4 45 74 A G >< - 0 0 32 -4,-1.7 3,-1.5 -5,-0.4 -1,-0.1 -0.009 38.2 -50.4 74.9 179.3 10.8 51.6 1.5 46 75 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.2 -4,-0.1 -4,-0.1 0.655 132.5 56.4 -68.5 -14.6 10.0 50.6 -2.0 47 76 A K T 3 S+ 0 0 199 -3,-0.4 -1,-0.3 2,-0.0 2,-0.2 0.445 96.2 73.9 -97.2 -3.6 13.3 48.9 -2.6 48 77 A G < - 0 0 7 -3,-1.5 2,-0.3 -4,-0.2 -23,-0.2 -0.478 69.2-157.6 -93.7 176.1 13.0 46.5 0.3 49 78 A R E -a 25 0A 58 -25,-1.7 -23,-2.3 -2,-0.2 2,-0.4 -0.993 9.6-143.1-152.2 160.0 10.7 43.6 0.3 50 79 A I E -ac 26 64A 0 13,-2.5 15,-3.1 -2,-0.3 2,-0.6 -0.964 4.4-154.0-124.6 142.3 8.8 41.2 2.6 51 80 A I E -ac 27 65A 1 -25,-2.3 -23,-2.6 -2,-0.4 2,-0.3 -0.988 33.0-174.8-112.6 113.9 8.1 37.5 2.3 52 81 A A E -ac 28 66A 1 13,-3.0 15,-2.6 -2,-0.6 2,-0.3 -0.829 14.8-171.2-119.6 156.9 4.9 36.9 4.4 53 82 A C E +ac 29 67A 3 -25,-2.2 -22,-2.6 -2,-0.3 -23,-1.6 -1.000 12.8 152.4-148.8 138.3 2.8 34.0 5.5 54 83 A D E - c 0 68A 2 13,-1.3 15,-1.8 -2,-0.3 4,-0.1 -0.952 46.1-126.5-157.3 154.1 -0.5 33.3 7.2 55 84 A L S S+ 0 0 72 -2,-0.3 15,-0.1 13,-0.2 -1,-0.1 0.756 98.8 66.3 -63.9 -33.4 -3.2 30.6 7.3 56 85 A L S S- 0 0 92 13,-0.1 13,-0.1 1,-0.1 -24,-0.1 -0.575 91.6-111.6 -91.0 153.5 -5.7 33.4 6.4 57 86 A P - 0 0 83 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.401 36.7-174.1 -78.5 162.4 -5.9 35.3 3.2 58 87 A M - 0 0 25 -26,-0.1 -24,-0.1 -4,-0.1 3,-0.1 -0.983 33.6 -81.2-150.0 165.2 -5.0 39.0 3.3 59 88 A D - 0 0 133 -26,-0.5 2,-0.0 -2,-0.3 0, 0.0 -0.302 54.4-106.5 -63.7 140.6 -5.0 42.0 1.0 60 89 A P - 0 0 127 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.375 32.3-160.5 -68.4 153.8 -2.0 42.2 -1.4 61 90 A I > - 0 0 44 3,-0.4 3,-2.3 -3,-0.1 2,-0.2 -0.998 25.6-111.7-134.4 128.4 0.7 44.8 -0.6 62 91 A V T 3 S+ 0 0 143 -2,-0.4 3,-0.1 1,-0.3 -21,-0.0 -0.470 107.9 26.2 -62.4 127.5 3.2 46.0 -3.1 63 92 A G T 3 S+ 0 0 33 -2,-0.2 -13,-2.5 1,-0.2 2,-0.5 0.374 102.2 103.3 100.4 -4.9 6.6 44.8 -2.0 64 93 A V E < -c 50 0A 14 -3,-2.3 2,-0.9 -15,-0.2 -3,-0.4 -0.969 56.0-157.3-117.6 123.9 5.2 41.8 -0.1 65 94 A D E -c 51 0A 63 -15,-3.1 -13,-3.0 -2,-0.5 2,-0.5 -0.875 24.6-164.8 -96.5 107.3 5.3 38.3 -1.4 66 95 A F E -c 52 0A 50 -2,-0.9 2,-0.5 -15,-0.2 -13,-0.2 -0.861 12.7-172.1-104.3 127.3 2.4 36.7 0.5 67 96 A L E -c 53 0A 23 -15,-2.6 -13,-1.3 -2,-0.5 2,-0.7 -0.967 12.8-149.3-118.4 124.3 1.9 32.9 0.8 68 97 A Q E +c 54 0A 112 -2,-0.5 2,-0.3 -15,-0.2 -13,-0.2 -0.821 48.2 98.6 -98.1 114.2 -1.2 31.5 2.4 69 98 A G S S- 0 0 17 -15,-1.8 2,-0.7 -2,-0.7 -13,-0.1 -0.972 77.2 -69.8-176.2 173.7 -0.7 28.2 4.1 70 99 A D > - 0 0 49 -2,-0.3 3,-2.0 1,-0.1 6,-0.4 -0.708 34.1-153.1 -82.7 115.7 -0.2 26.4 7.4 71 100 A F T 3 S+ 0 0 14 -2,-0.7 -1,-0.1 1,-0.3 6,-0.1 0.723 91.3 70.9 -65.8 -16.0 3.4 27.3 8.6 72 101 A R T 3 S+ 0 0 127 4,-0.1 2,-0.5 5,-0.0 -1,-0.3 0.669 81.2 93.5 -72.2 -15.2 3.4 24.0 10.5 73 102 A D S X> S- 0 0 70 -3,-2.0 4,-1.5 1,-0.1 3,-0.7 -0.692 72.3-145.6 -86.3 123.5 3.6 22.2 7.1 74 103 A E H 3> S+ 0 0 102 -2,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.829 100.4 60.2 -51.9 -34.6 7.1 21.4 5.8 75 104 A L H 3> S+ 0 0 127 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.898 99.9 52.2 -62.5 -43.6 5.8 22.0 2.3 76 105 A V H <> S+ 0 0 23 -3,-0.7 4,-2.3 -6,-0.4 -1,-0.2 0.872 105.8 56.8 -62.7 -35.8 4.8 25.6 3.1 77 106 A M H X S+ 0 0 36 -4,-1.5 4,-2.8 1,-0.2 3,-0.3 0.978 105.0 51.6 -57.8 -54.6 8.4 26.2 4.4 78 107 A K H X S+ 0 0 50 -4,-1.9 4,-1.3 1,-0.3 -1,-0.2 0.884 110.5 47.8 -47.5 -47.3 9.8 25.0 1.0 79 108 A A H X S+ 0 0 25 -4,-1.9 4,-0.7 1,-0.2 -1,-0.3 0.855 110.2 51.8 -68.2 -35.7 7.6 27.5 -0.8 80 109 A L H >X S+ 0 0 1 -4,-2.3 4,-1.7 -3,-0.3 3,-1.3 0.928 107.4 52.8 -66.1 -41.7 8.5 30.4 1.5 81 110 A L H 3X S+ 0 0 67 -4,-2.8 4,-2.6 1,-0.3 -1,-0.2 0.825 101.4 62.1 -62.3 -29.5 12.2 29.6 0.9 82 111 A E H 3< S+ 0 0 146 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.739 105.1 46.1 -66.1 -26.3 11.5 29.8 -2.8 83 112 A R H << S+ 0 0 96 -3,-1.3 -2,-0.2 -4,-0.7 -1,-0.2 0.791 111.6 50.9 -87.4 -30.2 10.5 33.4 -2.4 84 113 A V H >< S+ 0 0 8 -4,-1.7 3,-1.9 1,-0.1 -2,-0.2 0.949 80.4 159.2 -69.8 -46.2 13.5 34.3 -0.3 85 114 A G T 3< S- 0 0 51 -4,-2.6 -1,-0.1 1,-0.3 -2,-0.1 -0.360 72.8 -27.2 60.5-140.8 15.9 32.8 -2.7 86 115 A D T 3 S+ 0 0 172 2,-0.1 -1,-0.3 -2,-0.0 2,-0.2 0.298 101.6 125.3 -89.8 7.9 19.5 34.2 -2.3 87 116 A S < - 0 0 48 -3,-1.9 2,-0.3 -4,-0.1 -4,-0.0 -0.461 67.0-122.2 -64.4 133.0 18.2 37.5 -0.9 88 117 A K - 0 0 138 -2,-0.2 2,-0.6 38,-0.0 -63,-0.4 -0.644 23.8-140.3 -74.7 139.3 19.9 38.0 2.5 89 118 A V E - d 0 126A 0 36,-0.7 38,-2.8 -2,-0.3 -63,-0.2 -0.874 20.1-177.0-104.3 118.9 17.2 38.4 5.2 90 119 A Q E + 0 0 57 -65,-2.0 41,-2.4 -2,-0.6 2,-0.3 0.677 69.4 25.2 -89.0 -22.9 17.9 41.1 7.8 91 120 A V E -bd 26 131A 0 -66,-1.1 -64,-2.0 39,-0.2 2,-0.5 -0.984 54.8-165.5-143.2 135.6 14.9 40.6 10.0 92 121 A V E -bd 27 132A 0 39,-2.2 41,-2.2 -2,-0.3 2,-0.4 -0.994 20.3-174.1-113.6 122.2 12.6 37.7 10.7 93 122 A M E -bd 28 133A 0 -66,-3.1 -64,-3.0 -2,-0.5 2,-0.4 -0.976 6.3-172.5-120.6 136.4 9.4 38.8 12.5 94 123 A S E +bd 29 134A 0 39,-2.5 41,-2.0 -2,-0.4 -64,-0.2 -0.987 22.5 163.7-133.3 125.6 6.7 36.6 13.9 95 124 A D + 0 0 0 -66,-2.4 -65,-0.2 -2,-0.4 -1,-0.1 0.017 36.4 143.6-118.5 23.3 3.3 37.6 15.4 96 125 A M + 0 0 5 -67,-0.2 39,-0.1 18,-0.1 -66,-0.1 -0.347 18.2 166.6 -67.2 144.2 1.8 34.1 15.1 97 126 A A - 0 0 19 17,-0.1 3,-0.1 -2,-0.1 14,-0.1 -0.969 29.6-117.8-154.5 144.2 -0.5 32.9 17.8 98 127 A P - 0 0 18 0, 0.0 2,-0.4 0, 0.0 13,-0.1 -0.281 39.1 -84.8 -80.9 168.3 -2.8 29.9 17.8 99 128 A N - 0 0 121 -2,-0.1 2,-0.5 1,-0.0 11,-0.1 -0.626 57.6-134.4 -68.5 125.5 -6.5 29.6 18.1 100 129 A M - 0 0 86 -2,-0.4 -1,-0.0 1,-0.1 -3,-0.0 -0.802 22.0-164.9-101.0 131.1 -6.8 29.7 21.9 101 130 A S - 0 0 61 -2,-0.5 -1,-0.1 2,-0.2 -2,-0.0 0.667 46.4-113.9 -78.6 -25.2 -9.1 27.3 23.8 102 131 A G S S+ 0 0 63 1,-0.2 -2,-0.1 2,-0.0 0, 0.0 0.215 87.7 105.7 105.7 -10.7 -8.9 29.3 27.0 103 132 A T >> - 0 0 75 1,-0.1 4,-2.9 2,-0.0 3,-2.2 -0.889 60.2-152.7-103.8 112.7 -7.0 26.7 29.0 104 133 A P H 3> S+ 0 0 93 0, 0.0 4,-2.6 0, 0.0 -1,-0.1 0.841 92.0 61.6 -54.3 -38.1 -3.4 27.6 29.4 105 134 A A H 34 S+ 0 0 80 1,-0.2 -2,-0.0 2,-0.2 0, 0.0 0.586 118.6 32.2 -67.3 -7.0 -2.1 24.1 29.7 106 135 A V H <> S+ 0 0 59 -3,-2.2 4,-1.7 3,-0.1 -1,-0.2 0.732 120.1 47.4-109.5 -49.6 -3.4 23.6 26.2 107 136 A D H X S+ 0 0 10 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.847 107.6 55.8 -66.0 -36.5 -2.9 27.1 24.6 108 137 A I H X S+ 0 0 22 -4,-2.6 4,-3.0 -5,-0.3 5,-0.2 0.941 107.7 47.4 -65.4 -45.5 0.6 27.6 25.8 109 138 A P H > S+ 0 0 61 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.926 112.5 51.4 -61.4 -37.1 1.9 24.4 24.2 110 139 A R H X S+ 0 0 94 -4,-1.7 4,-1.3 1,-0.2 -2,-0.2 0.938 113.7 43.8 -63.5 -44.2 0.1 25.3 21.0 111 140 A A H X S+ 0 0 7 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.903 110.8 53.6 -67.0 -43.5 1.7 28.8 21.0 112 141 A M H X S+ 0 0 24 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.847 102.7 58.6 -62.2 -33.0 5.2 27.5 21.9 113 142 A Y H X S+ 0 0 123 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.947 107.1 47.9 -62.1 -43.3 5.2 25.1 19.0 114 143 A L H X S+ 0 0 10 -4,-1.3 4,-2.4 1,-0.2 -2,-0.2 0.915 111.7 47.6 -66.4 -40.2 4.6 28.0 16.6 115 144 A V H X S+ 0 0 4 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.845 109.7 54.2 -73.5 -24.8 7.4 30.1 18.1 116 145 A E H X S+ 0 0 74 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.932 109.5 47.9 -68.3 -40.3 9.7 27.1 18.0 117 146 A L H X S+ 0 0 37 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.900 110.3 52.5 -62.1 -41.3 8.9 26.8 14.2 118 147 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.900 110.0 48.4 -61.9 -40.0 9.6 30.6 13.8 119 148 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.870 108.4 53.8 -69.9 -35.2 13.0 30.2 15.5 120 149 A E H X S+ 0 0 86 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.932 110.3 46.2 -66.7 -41.0 13.9 27.2 13.3 121 150 A M H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 5,-0.4 0.916 110.4 54.8 -65.1 -38.1 13.1 29.3 10.2 122 151 A C H X S+ 0 0 2 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.950 106.3 50.9 -56.9 -48.1 15.2 32.1 11.7 123 152 A R H < S+ 0 0 71 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.904 114.9 45.4 -55.8 -41.7 18.2 29.8 12.2 124 153 A D H < S+ 0 0 99 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.808 129.0 16.8 -75.1 -30.9 17.8 28.8 8.5 125 154 A V H < S+ 0 0 24 -4,-2.4 -36,-0.7 -5,-0.1 2,-0.3 0.637 88.7 105.0-120.2 -20.6 17.3 32.2 6.8 126 155 A L E < -d 89 0A 6 -4,-2.7 -36,-0.2 -5,-0.4 3,-0.1 -0.504 66.1-126.9 -69.7 128.0 18.4 35.1 9.0 127 156 A A E > - 0 0 11 -38,-2.8 3,-2.5 -2,-0.3 51,-0.3 -0.270 35.6 -84.7 -70.6 156.5 21.7 36.7 8.0 128 157 A P E 3 S+ 0 0 83 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 -0.343 121.3 26.0 -56.0 140.8 24.6 37.1 10.5 129 158 A G E 3 S+ 0 0 54 49,-2.8 48,-0.7 1,-0.2 50,-0.1 0.357 99.6 131.8 84.1 -5.6 24.0 40.4 12.3 130 159 A G E < - 0 0 6 -3,-2.5 48,-1.9 47,-0.2 2,-0.3 -0.028 50.9-118.5 -76.8 179.4 20.2 40.2 11.7 131 160 A S E -d 91 0A 13 -41,-2.4 -39,-2.2 45,-0.2 2,-0.4 -0.874 14.6-162.8-122.1 155.5 17.2 40.6 14.0 132 161 A F E -dE 92 175A 0 43,-2.6 43,-3.2 -2,-0.3 2,-0.4 -0.999 5.4-175.5-134.8 130.0 14.4 38.4 15.2 133 162 A V E +dE 93 174A 0 -41,-2.2 -39,-2.5 -2,-0.4 2,-0.4 -0.998 12.2 175.7-127.6 129.2 11.2 39.7 16.9 134 163 A V E -dE 94 173A 0 39,-2.2 39,-2.5 -2,-0.4 2,-0.5 -0.994 31.4-128.8-141.4 136.1 8.7 37.2 18.2 135 164 A K E + E 0 172A 6 -41,-2.0 2,-0.3 -2,-0.4 37,-0.2 -0.673 39.7 169.9 -77.5 127.3 5.4 37.3 20.1 136 165 A V E - E 0 171A 1 35,-2.6 35,-2.5 -2,-0.5 2,-0.4 -0.953 27.4-124.3-138.2 153.4 5.6 34.9 23.0 137 166 A F E - E 0 170A 25 -2,-0.3 33,-0.2 33,-0.2 5,-0.1 -0.797 26.1-109.4-104.5 146.8 3.4 34.3 26.0 138 167 A Q S S+ 0 0 86 31,-2.3 2,-0.3 -2,-0.4 31,-0.1 -0.375 80.9 44.8 -62.0 145.0 4.3 34.4 29.7 139 168 A G S >> S+ 0 0 48 -2,-0.1 3,-1.9 -31,-0.0 4,-0.5 -0.871 91.7 21.4 124.4-157.2 4.4 31.0 31.3 140 169 A E T 34 S+ 0 0 140 -2,-0.3 -3,-0.1 1,-0.3 -28,-0.1 -0.222 124.4 13.8 -55.2 133.0 5.6 27.5 30.6 141 170 A G T 3> S+ 0 0 30 1,-0.1 4,-1.9 -29,-0.0 -1,-0.3 0.140 95.0 104.9 90.2 -21.7 8.3 27.4 28.0 142 171 A F H <> S+ 0 0 43 -3,-1.9 4,-2.6 1,-0.2 5,-0.3 0.922 77.3 52.5 -60.3 -46.2 9.1 31.1 28.1 143 172 A D H X S+ 0 0 102 -4,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.930 111.9 43.5 -60.3 -46.4 12.4 30.8 30.1 144 173 A E H > S+ 0 0 149 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.879 114.1 50.2 -68.4 -34.8 13.9 28.1 27.9 145 174 A Y H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.910 111.4 48.2 -70.0 -43.1 13.0 29.9 24.6 146 175 A L H X S+ 0 0 11 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.925 110.8 52.2 -63.0 -43.4 14.4 33.2 25.8 147 176 A R H X S+ 0 0 164 -4,-2.3 4,-1.8 -5,-0.3 -2,-0.2 0.888 109.0 50.3 -60.6 -37.5 17.6 31.4 26.9 148 177 A E H X S+ 0 0 72 -4,-1.8 4,-0.7 2,-0.2 -1,-0.2 0.942 111.3 47.6 -68.9 -43.9 18.0 29.9 23.5 149 178 A I H >X S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 4,-1.2 0.913 108.6 55.0 -63.3 -41.5 17.5 33.2 21.8 150 179 A R H 3< S+ 0 0 134 -4,-2.8 3,-0.4 1,-0.3 -1,-0.2 0.872 104.8 54.4 -59.1 -32.6 20.0 34.8 24.1 151 180 A S H 3< S+ 0 0 66 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.695 112.4 43.6 -75.5 -13.0 22.5 32.2 23.1 152 181 A L H << S+ 0 0 40 -3,-1.2 27,-2.7 -4,-0.7 2,-0.3 0.543 111.4 53.3-106.2 -11.4 22.1 33.1 19.3 153 182 A F E < -F 178 0A 5 -4,-1.2 25,-0.2 -3,-0.4 24,-0.2 -0.923 70.0-134.1-129.9 152.7 22.0 36.8 19.4 154 183 A T E S+ 0 0 100 23,-1.6 2,-0.4 22,-0.7 23,-0.2 0.883 94.5 22.1 -75.1 -33.3 24.3 39.5 20.8 155 184 A K E -F 176 0A 101 21,-2.0 21,-2.9 2,-0.0 2,-0.4 -0.997 65.6-179.0-135.3 136.4 21.5 41.6 22.4 156 185 A V E -F 175 0A 25 -2,-0.4 2,-0.3 19,-0.2 19,-0.2 -0.997 0.9-178.9-138.9 132.2 18.0 40.5 23.5 157 186 A K E -F 174 0A 87 17,-2.5 17,-3.1 -2,-0.4 2,-0.6 -0.934 22.4-139.1-126.0 150.4 15.2 42.5 25.1 158 187 A V E -F 173 0A 60 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.955 29.5-166.4-111.0 115.6 11.7 41.5 26.3 159 188 A R E -F 172 0A 66 13,-3.4 13,-2.7 -2,-0.6 -146,-0.1 -0.795 22.4-168.4-108.9 142.1 9.3 44.3 25.3 160 189 A K - 0 0 77 -2,-0.4 11,-0.1 11,-0.2 -2,-0.0 -0.849 26.7-143.6-125.1 89.7 5.7 44.9 26.4 161 190 A P > - 0 0 10 0, 0.0 3,-1.5 0, 0.0 -152,-0.1 -0.215 14.8-126.9 -52.4 144.8 4.4 47.5 23.9 162 191 A D T 3 S+ 0 0 158 1,-0.3 4,-0.1 -154,-0.1 -153,-0.1 0.782 112.8 58.9 -64.1 -25.9 2.0 50.0 25.5 163 192 A S T 3 S+ 0 0 24 -155,-0.2 2,-0.4 2,-0.1 -1,-0.3 0.534 84.5 95.8 -80.1 -6.8 -0.4 49.1 22.7 164 193 A S S < S- 0 0 6 -3,-1.5 -4,-0.0 -156,-0.1 2,-0.0 -0.709 94.0-102.5 -81.6 133.7 -0.3 45.5 23.9 165 194 A R > - 0 0 89 -2,-0.4 3,-1.0 1,-0.1 5,-0.2 -0.358 19.9-135.3 -60.6 136.0 -3.3 45.0 26.2 166 195 A A T 3 S+ 0 0 103 1,-0.3 -1,-0.1 -4,-0.1 -3,-0.0 0.838 107.4 54.7 -61.1 -34.0 -2.3 45.0 29.9 167 196 A R T 3 S+ 0 0 209 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 0.634 88.8 97.8 -75.0 -16.9 -4.5 42.0 30.4 168 197 A S < - 0 0 11 -3,-1.0 -4,-0.0 1,-0.1 -31,-0.0 -0.545 67.8-146.5 -76.5 140.7 -2.7 40.1 27.6 169 198 A R + 0 0 160 -2,-0.2 -31,-2.3 -31,-0.1 -1,-0.1 0.368 62.9 117.6 -84.4 6.0 0.0 37.6 28.7 170 199 A E E +E 137 0A 5 -33,-0.2 2,-0.3 -5,-0.2 -33,-0.2 -0.348 35.8 172.3 -78.3 153.0 1.9 38.4 25.5 171 200 A V E -E 136 0A 12 -35,-2.5 -35,-2.6 -11,-0.1 2,-0.5 -0.908 27.9-126.1-141.0 167.3 5.4 39.9 25.3 172 201 A Y E -EF 135 159A 0 -13,-2.7 -13,-3.4 -2,-0.3 2,-0.6 -0.986 12.8-148.0-121.9 121.0 7.7 40.5 22.3 173 202 A I E -EF 134 158A 0 -39,-2.5 -39,-2.2 -2,-0.5 2,-0.6 -0.788 16.0-164.4 -85.8 124.1 11.3 39.1 22.4 174 203 A V E -EF 133 157A 1 -17,-3.1 -17,-2.5 -2,-0.6 2,-0.5 -0.945 9.2-178.1-118.3 106.8 13.4 41.5 20.4 175 204 A A E -EF 132 156A 0 -43,-3.2 -43,-2.6 -2,-0.6 2,-0.3 -0.908 1.5-175.9-112.7 133.6 16.8 40.0 19.4 176 205 A T E + F 0 155A 31 -21,-2.9 -21,-2.0 -2,-0.5 -22,-0.7 -0.877 53.7 35.8-125.9 157.1 19.5 41.8 17.5 177 206 A G E S- 0 0 15 -48,-0.7 -23,-1.6 -2,-0.3 -47,-0.2 0.971 70.7-141.6 73.1 57.1 22.9 40.9 16.2 178 207 A R E - F 0 153A 55 -48,-1.9 -49,-2.8 -51,-0.3 -25,-0.3 -0.249 27.2-120.5 -52.2 124.6 22.5 37.3 15.1 179 208 A K 0 0 75 -27,-2.7 -1,-0.1 -51,-0.2 -49,-0.1 -0.253 360.0 360.0 -71.1 153.7 25.8 35.7 16.0 180 209 A P 0 0 182 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.871 360.0 360.0 -56.2 360.0 28.1 34.0 13.5 181 ! 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 0.0 182 301 A X 0 0 88 0, 0.0 -146,-1.5 0, 0.0 -150,-0.2 0.000 360.0 360.0 360.0 360.0 -0.4 40.7 12.1