==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-NOV-07 3BIL . COMPND 2 MOLECULE: PROBABLE LACI-FAMILY TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM ATCC 13032; . AUTHOR J.B.BONANNO,J.FREEMAN,K.T.BAIN,M.MENDOZA,S.OZYURT,D.SMITH, . 514 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20115.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 381 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 79 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 1.9 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 . 2 0.4 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 . 39 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.5 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 2 0 0 0 10 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 9 3 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 0 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 2 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 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 67 A T 0 0 43 0, 0.0 56,-2.5 0, 0.0 57,-0.4 0.000 360.0 360.0 360.0 114.4 1.6 11.5 12.4 2 68 A I E -a 32 0A 2 29,-2.8 31,-2.0 54,-0.2 2,-0.4 -0.740 360.0-127.1-113.6 165.9 3.7 9.1 10.2 3 69 A G E -ab 33 59A 0 55,-3.2 57,-2.4 -2,-0.2 2,-0.4 -0.921 17.8-168.2-113.6 138.2 5.1 5.5 10.8 4 70 A V E -ab 34 60A 2 29,-3.0 31,-3.0 -2,-0.4 2,-0.4 -0.995 2.0-166.8-128.5 137.1 8.7 4.3 10.4 5 71 A I E +ab 35 61A 1 55,-1.7 57,-1.6 -2,-0.4 31,-0.2 -0.977 11.5 173.7-121.9 131.6 10.0 0.8 10.4 6 72 A V E -a 36 0A 1 29,-2.8 31,-2.6 -2,-0.4 32,-0.4 -0.938 35.8-128.0-140.4 147.9 13.7 -0.1 10.7 7 73 A P S S+ 0 0 1 0, 0.0 31,-0.4 0, 0.0 2,-0.3 0.721 88.4 3.8 -73.5 -18.3 15.6 -3.4 11.0 8 74 A S - 0 0 21 30,-0.1 29,-0.1 27,-0.1 27,-0.1 -0.986 42.1-164.8-163.9 151.7 17.6 -2.4 14.0 9 75 A L S S+ 0 0 2 -2,-0.3 6,-0.1 267,-0.1 268,-0.1 0.572 92.3 64.4-117.9 -25.4 18.1 0.4 16.5 10 76 A I S S+ 0 0 76 266,-0.2 2,-0.6 267,-0.1 267,-0.1 0.694 83.0 94.1 -70.3 -19.3 21.4 -0.7 18.0 11 77 A N S > S- 0 0 16 1,-0.2 4,-1.8 265,-0.1 5,-0.2 -0.670 74.8-151.7 -65.9 118.4 22.6 -0.0 14.5 12 78 A H H > S+ 0 0 37 -2,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.828 92.0 57.8 -68.0 -28.2 23.8 3.5 14.9 13 79 A Y H > S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.932 108.4 42.7 -66.7 -47.5 23.1 4.1 11.2 14 80 A F H > S+ 0 0 8 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.745 114.2 51.9 -71.3 -24.5 19.5 3.2 11.5 15 81 A A H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 256,-0.2 0.856 110.8 49.2 -77.1 -35.9 19.1 5.1 14.8 16 82 A A H X S+ 0 0 14 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.948 108.9 53.2 -61.3 -47.7 20.7 8.2 13.0 17 83 A M H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.888 111.7 44.0 -56.9 -43.0 18.3 7.7 10.1 18 84 A V H X S+ 0 0 1 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.879 109.4 55.2 -75.8 -35.3 15.2 7.8 12.4 19 85 A T H X S+ 0 0 16 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.962 115.4 41.1 -56.6 -49.0 16.4 10.7 14.4 20 86 A E H X S+ 0 0 53 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.782 113.2 51.9 -71.0 -29.0 16.7 12.6 11.1 21 87 A I H X S+ 0 0 1 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.836 112.0 48.8 -71.3 -35.4 13.5 11.3 9.7 22 88 A Q H X S+ 0 0 12 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.895 111.3 48.3 -70.3 -40.7 11.7 12.4 12.9 23 89 A S H X S+ 0 0 40 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.916 113.3 46.3 -68.2 -47.0 13.2 15.9 12.9 24 90 A T H X S+ 0 0 26 -4,-1.8 4,-0.9 1,-0.2 -1,-0.2 0.902 110.9 54.1 -58.8 -45.3 12.4 16.6 9.2 25 91 A A H ><>S+ 0 0 0 -4,-1.8 5,-1.2 1,-0.2 3,-0.5 0.867 106.4 51.1 -57.0 -39.2 8.8 15.3 9.7 26 92 A S H ><5S+ 0 0 75 -4,-1.6 3,-1.7 3,-0.2 -1,-0.2 0.862 102.8 59.2 -74.1 -33.2 8.2 17.6 12.6 27 93 A K H 3<5S+ 0 0 171 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.754 108.3 46.1 -60.6 -26.2 9.4 20.6 10.5 28 94 A A T <<5S- 0 0 61 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 -0.132 130.6 -99.9-103.0 31.3 6.6 19.7 8.1 29 95 A G T < 5S+ 0 0 68 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.904 79.1 129.4 52.2 57.3 4.2 19.3 11.0 30 96 A L < - 0 0 36 -5,-1.2 -1,-0.2 -8,-0.2 -2,-0.1 -0.999 47.4-137.6-142.3 141.7 4.2 15.5 11.5 31 97 A A - 0 0 47 -2,-0.3 -29,-2.8 -5,-0.1 2,-0.4 -0.328 19.3-135.3 -89.9 177.3 4.6 13.1 14.4 32 98 A T E -a 2 0A 8 -31,-0.2 2,-0.5 265,-0.1 265,-0.4 -0.961 16.5-173.9-147.2 119.9 6.6 9.8 14.3 33 99 A I E -a 3 0A 4 -31,-2.0 -29,-3.0 -2,-0.4 2,-0.4 -0.954 23.0-153.6-107.9 126.1 6.0 6.3 15.6 34 100 A I E -aC 4 295A 1 261,-3.3 261,-3.0 -2,-0.5 2,-0.3 -0.788 10.7-170.0-105.0 143.1 9.0 4.0 15.2 35 101 A T E -a 5 0A 0 -31,-3.0 -29,-2.8 -2,-0.4 2,-0.5 -0.977 11.6-149.8-131.3 160.1 9.2 0.2 14.8 36 102 A N E -a 6 0A 2 257,-0.3 257,-0.1 -2,-0.3 -27,-0.1 -0.970 7.3-173.8-129.3 115.8 12.0 -2.3 14.9 37 103 A S > - 0 0 0 -31,-2.6 3,-1.8 -2,-0.5 6,-0.3 0.521 28.1-139.2 -89.8 -6.1 11.8 -5.5 12.9 38 104 A N T 3 - 0 0 72 -31,-0.4 -30,-0.1 -32,-0.4 3,-0.1 0.730 67.7 -67.9 46.9 29.7 15.0 -7.3 14.1 39 105 A E T 3 S+ 0 0 53 1,-0.2 2,-0.5 -33,-0.1 -1,-0.3 0.826 106.5 135.4 63.0 32.5 15.6 -8.4 10.5 40 106 A D <> - 0 0 70 -3,-1.8 4,-1.9 1,-0.2 -1,-0.2 -0.964 48.7-158.8-122.4 114.2 12.4 -10.6 11.0 41 107 A A H > S+ 0 0 19 -2,-0.5 4,-2.9 1,-0.2 5,-0.2 0.908 94.1 53.9 -57.3 -48.6 9.8 -10.7 8.3 42 108 A T H > S+ 0 0 112 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.891 107.9 51.3 -54.6 -42.8 7.0 -11.9 10.7 43 109 A T H > S+ 0 0 49 -6,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.944 112.7 44.2 -61.8 -46.9 7.7 -8.9 13.0 44 110 A M H X S+ 0 0 1 -4,-1.9 4,-2.7 -7,-0.3 5,-0.3 0.850 109.4 56.9 -66.4 -39.1 7.5 -6.4 10.1 45 111 A S H X S+ 0 0 38 -4,-2.9 4,-2.0 1,-0.2 5,-0.3 0.978 108.0 48.5 -49.9 -57.2 4.4 -8.2 8.9 46 112 A G H X S+ 0 0 32 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.859 112.7 49.1 -48.5 -44.5 3.0 -7.5 12.4 47 113 A S H X S+ 0 0 12 -4,-1.9 4,-4.0 2,-0.2 -1,-0.2 0.912 109.3 46.9 -66.7 -51.5 4.0 -3.8 12.2 48 114 A L H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 5,-0.4 0.957 112.2 51.5 -58.1 -55.2 2.6 -2.8 8.8 49 115 A E H X S+ 0 0 129 -4,-2.0 4,-1.4 -5,-0.3 -1,-0.2 0.925 117.3 41.2 -42.3 -51.7 -0.7 -4.5 9.6 50 116 A F H X S+ 0 0 29 -4,-1.8 4,-0.7 -5,-0.3 -2,-0.2 0.923 110.8 54.8 -69.3 -45.7 -0.7 -2.5 12.8 51 117 A L H ><>S+ 0 0 3 -4,-4.0 5,-1.0 1,-0.2 3,-0.7 0.886 113.1 40.7 -59.4 -42.6 0.6 0.8 11.5 52 118 A T H ><5S+ 0 0 37 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.793 107.3 64.7 -78.2 -27.5 -2.1 1.2 8.8 53 119 A S H 3<5S+ 0 0 87 -4,-1.4 -1,-0.2 -5,-0.4 -2,-0.2 0.670 103.7 48.8 -60.0 -20.4 -4.7 -0.1 11.1 54 120 A H T <<5S- 0 0 56 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.143 116.5-103.0-118.9 18.5 -4.2 3.0 13.3 55 121 A G T < 5 + 0 0 54 -3,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.865 50.4 169.7 69.0 43.9 -4.4 5.8 10.8 56 122 A V < - 0 0 7 -5,-1.0 -54,-0.2 1,-0.1 -1,-0.2 -0.699 34.3-136.8 -78.4 137.9 -0.8 6.9 10.2 57 123 A D S S+ 0 0 106 -56,-2.5 2,-0.3 -2,-0.3 -55,-0.2 0.859 79.0 2.1 -62.8 -38.1 -0.7 9.4 7.2 58 124 A G - 0 0 2 -57,-0.4 -55,-3.2 21,-0.1 2,-0.5 -0.983 58.9-138.8-150.6 159.7 2.5 7.7 5.7 59 125 A I E -bd 3 81A 0 21,-2.6 23,-1.8 -2,-0.3 2,-0.5 -0.980 9.0-171.9-125.1 121.5 5.0 4.9 6.1 60 126 A I E +bd 4 82A 0 -57,-2.4 -55,-1.7 -2,-0.5 2,-0.3 -0.965 29.6 171.6-107.4 131.2 8.8 5.2 5.6 61 127 A C E -bd 5 83A 1 21,-2.9 23,-2.3 -2,-0.5 -55,-0.2 -0.979 45.7-135.9-151.8 146.3 10.3 1.8 5.7 62 128 A V - 0 0 2 -57,-1.6 25,-0.1 -2,-0.3 23,-0.1 -0.868 45.0-136.5-102.9 98.1 13.3 -0.5 5.2 63 129 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 5,-0.1 -0.275 9.5-146.8 -66.7 130.8 11.8 -3.5 3.5 64 130 A N > - 0 0 24 1,-0.1 3,-1.2 -23,-0.1 65,-0.1 -0.761 24.3-130.4 -76.2 139.0 12.6 -7.1 4.3 65 131 A E G > S+ 0 0 53 -2,-0.4 3,-1.9 63,-0.3 4,-0.2 0.857 104.8 67.7 -63.9 -33.9 12.4 -9.0 1.0 66 132 A E G 3 S+ 0 0 164 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.231 98.4 55.4 -68.8 16.5 10.2 -11.6 2.5 67 133 A C G <> + 0 0 1 -3,-1.2 4,-1.9 2,-0.1 -1,-0.3 0.125 67.4 116.2-132.2 11.7 7.5 -8.8 2.8 68 134 A A H <> S+ 0 0 26 -3,-1.9 4,-0.9 1,-0.2 -2,-0.1 0.862 76.4 50.8 -53.6 -40.0 7.4 -7.8 -0.9 69 135 A N H >> S+ 0 0 139 2,-0.2 4,-1.9 1,-0.2 3,-1.1 0.967 110.4 43.4 -66.0 -56.6 3.8 -8.9 -1.3 70 136 A Q H 3> S+ 0 0 61 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.814 111.4 58.1 -59.2 -32.9 2.2 -7.1 1.7 71 137 A L H 3X S+ 0 0 0 -4,-1.9 4,-0.7 2,-0.2 -1,-0.3 0.729 105.6 48.6 -71.2 -26.2 4.2 -4.0 0.9 72 138 A E H XX S+ 0 0 41 -3,-1.1 4,-1.8 -4,-0.9 3,-0.5 0.921 107.6 54.9 -77.6 -48.0 2.7 -3.9 -2.6 73 139 A D H 3X S+ 0 0 87 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.856 103.0 55.4 -48.3 -46.5 -0.9 -4.3 -1.3 74 140 A L H 3< S+ 0 0 17 -4,-1.7 3,-0.5 1,-0.2 -1,-0.2 0.851 106.9 51.1 -61.5 -35.3 -0.6 -1.3 1.0 75 141 A Q H << S+ 0 0 63 -4,-0.7 -1,-0.2 -3,-0.5 -2,-0.2 0.906 104.2 59.6 -61.3 -41.6 0.4 0.8 -2.0 76 142 A K H < 0 0 167 -4,-1.8 -2,-0.2 1,-0.0 -1,-0.2 0.645 360.0 360.0 -67.7 -16.6 -2.7 -0.6 -3.7 77 143 A Q < 0 0 145 -4,-0.9 -1,-0.0 -3,-0.5 -4,-0.0 -0.756 360.0 360.0 -84.6 360.0 -5.0 0.9 -1.0 78 ! 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 79 145 A M 0 0 34 0, 0.0 2,-0.7 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 117.1 -1.2 3.9 2.1 80 146 A P - 0 0 40 0, 0.0 -21,-2.6 0, 0.0 2,-0.3 -0.648 360.0-177.2 -62.0 109.7 1.6 6.3 1.0 81 147 A V E -d 59 0A 2 -2,-0.7 2,-0.3 -23,-0.2 -21,-0.2 -0.860 15.1-175.4-110.7 146.4 4.7 4.0 1.4 82 148 A V E -d 60 0A 0 -23,-1.8 -21,-2.9 -2,-0.3 2,-0.4 -0.988 13.7-148.0-139.1 131.8 8.4 4.9 0.8 83 149 A L E -de 61 96A 1 12,-2.1 14,-2.4 -2,-0.3 2,-0.3 -0.819 16.4-165.2-101.1 143.3 11.3 2.4 1.0 84 150 A V E - e 0 97A 2 -23,-2.3 2,-2.6 -2,-0.4 14,-0.2 -0.975 57.9 -8.8-131.0 147.7 14.7 3.5 2.3 85 151 A D S S+ 0 0 10 12,-1.7 2,-0.3 -2,-0.3 14,-0.3 -0.253 120.0 61.8 68.7 -51.6 18.2 2.2 2.2 86 152 A R S S- 0 0 17 -2,-2.6 2,-0.3 -25,-0.2 11,-0.1 -0.859 73.6-143.9-110.7 145.8 17.1 -1.3 0.8 87 153 A E - 0 0 92 -2,-0.3 43,-0.3 -25,-0.1 44,-0.1 -0.819 21.9-110.9-110.5 141.0 15.4 -2.0 -2.5 88 154 A L - 0 0 25 -2,-0.3 -23,-0.1 6,-0.2 41,-0.0 -0.542 34.0-125.6 -65.0 134.3 12.7 -4.5 -3.3 89 155 A P S S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -24,-0.0 0.544 78.6 0.9 -67.5 -7.3 14.3 -7.1 -5.6 90 156 A G 0 0 57 -22,-0.0 -2,-0.1 0, 0.0 0, 0.0 0.199 360.0 360.0-137.8-114.1 11.8 -6.8 -8.5 91 157 A D 0 0 173 2,-0.0 -3,-0.0 0, 0.0 0, 0.0 0.907 360.0 360.0 -37.9 360.0 8.7 -5.0 -9.8 92 ! 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 93 159 A T 0 0 126 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 -31.6 6.8 0.9 -8.4 94 160 A I - 0 0 10 1,-0.1 -6,-0.2 -12,-0.0 -12,-0.1 -0.408 360.0-108.3 -63.2 124.5 7.1 2.0 -4.7 95 161 A P - 0 0 41 0, 0.0 -12,-2.1 0, 0.0 2,-0.4 -0.282 43.1-170.0 -58.4 131.3 9.2 5.1 -4.5 96 162 A T E -e 83 0A 24 -14,-0.2 2,-0.5 -3,-0.1 -12,-0.2 -0.979 19.1-162.6-125.0 140.7 12.6 4.3 -3.0 97 163 A A E +e 84 0A 0 -14,-2.4 -12,-1.7 -2,-0.4 2,-0.3 -0.984 28.9 158.9-119.2 115.9 15.4 6.5 -1.8 98 164 A T E -j 246 0B 7 147,-2.1 149,-2.1 -2,-0.5 2,-0.3 -0.836 41.0-104.4-132.7 163.9 18.7 4.6 -1.4 99 165 A S E -j 247 0B 6 -14,-0.3 150,-0.1 -2,-0.3 129,-0.1 -0.743 27.2-130.8 -90.5 140.3 22.4 5.4 -1.3 100 166 A N E -j 248 0B 47 147,-3.6 149,-0.9 -2,-0.3 4,-0.4 -0.837 21.7-171.6 -89.3 112.6 24.5 4.8 -4.4 101 167 A P > + 0 0 3 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.626 63.3 84.4 -83.2 -11.2 27.5 2.8 -3.1 102 168 A Q H > S+ 0 0 88 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.886 85.8 51.9 -63.8 -46.2 29.7 2.8 -6.2 103 169 A P H > S+ 0 0 48 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.920 115.5 40.7 -58.7 -45.2 31.4 6.3 -5.9 104 170 A G H > S+ 0 0 0 -4,-0.4 4,-2.8 2,-0.2 5,-0.2 0.925 117.4 48.0 -65.8 -45.5 32.6 5.6 -2.3 105 171 A I H X S+ 0 0 0 -4,-2.3 4,-3.4 2,-0.2 5,-0.2 0.957 111.3 50.7 -62.2 -47.8 33.6 2.0 -3.0 106 172 A A H X S+ 0 0 25 -4,-3.1 4,-2.7 -5,-0.2 -1,-0.2 0.906 112.8 46.5 -57.0 -42.2 35.5 3.0 -6.2 107 173 A A H X S+ 0 0 41 -4,-1.8 4,-2.7 -5,-0.3 -1,-0.2 0.900 111.4 49.9 -71.0 -38.5 37.4 5.7 -4.3 108 174 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.949 113.8 46.1 -60.8 -45.9 38.3 3.5 -1.4 109 175 A V H X S+ 0 0 0 -4,-3.4 4,-3.0 2,-0.2 -2,-0.2 0.959 111.8 51.6 -60.8 -48.7 39.5 0.8 -3.8 110 176 A E H X S+ 0 0 66 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.916 111.4 48.2 -47.5 -52.0 41.5 3.4 -5.8 111 177 A L H X S+ 0 0 27 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.848 110.2 50.2 -60.8 -41.4 43.1 4.6 -2.6 112 178 A L H <>S+ 0 0 0 -4,-2.3 5,-2.5 2,-0.2 -1,-0.2 0.932 111.5 50.7 -62.0 -42.2 44.0 1.1 -1.5 113 179 A A H ><5S+ 0 0 22 -4,-3.0 3,-1.8 1,-0.2 -2,-0.2 0.931 108.6 48.8 -63.7 -48.5 45.5 0.5 -4.9 114 180 A H H 3<5S+ 0 0 139 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.804 113.0 49.7 -60.3 -30.2 47.7 3.6 -4.9 115 181 A N T 3<5S- 0 0 30 -4,-1.5 145,-2.0 -5,-0.2 -1,-0.3 0.380 105.4-128.5 -87.1 5.6 48.9 2.7 -1.4 116 182 A N T < 5 + 0 0 97 -3,-1.8 2,-1.2 -4,-0.2 -3,-0.2 0.870 54.9 154.1 44.4 43.6 49.8 -0.9 -2.4 117 183 A A < - 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