==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 09-JUN-04 1TKV . COMPND 2 MOLECULE: 10 KDA ANTI-SIGMA FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.J.LAMBERT,V.SCHIRF,B.DEMELER,M.CADENE,M.H.WERNER . 176 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9932.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 78.4 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 . 2 1.1 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 . 6 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 58.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.4 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 2 0 0 0 0 2 2 2 0 2 0 0 1 1 0 0 0 0 0 0 0 0 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 2 A N 0 0 141 0, 0.0 2,-0.1 0, 0.0 43,-0.1 0.000 360.0 360.0 360.0 -56.7 38.9 15.3 31.3 2 3 A K - 0 0 104 41,-0.1 4,-0.5 54,-0.0 54,-0.0 -0.216 360.0 -67.4-124.3-144.5 42.5 15.8 30.4 3 4 A N S >> S+ 0 0 40 2,-0.1 4,-1.9 1,-0.1 3,-0.6 0.898 122.1 55.1 -86.3 -40.1 44.7 18.8 29.6 4 5 A I H 3> S+ 0 0 8 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.913 98.3 62.8 -61.6 -47.4 43.2 20.1 26.3 5 6 A D H 3> S+ 0 0 12 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.781 109.6 41.0 -41.0 -39.9 39.6 20.3 27.7 6 7 A T H <> S+ 0 0 2 -3,-0.6 4,-1.3 -4,-0.5 -1,-0.2 0.911 114.4 49.1 -86.1 -45.6 40.7 23.0 30.1 7 8 A V H X S+ 0 0 6 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.884 107.3 61.2 -56.2 -39.9 43.1 24.9 27.8 8 9 A R H >X S+ 0 0 30 -4,-3.3 4,-1.7 1,-0.2 3,-0.5 0.930 107.0 40.6 -49.5 -60.2 40.2 24.8 25.3 9 10 A E H 3X S+ 0 0 3 -4,-1.3 4,-1.6 1,-0.2 -1,-0.2 0.708 114.4 52.9 -72.5 -12.6 37.8 26.8 27.5 10 11 A I H 3X S+ 0 0 4 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.639 104.5 58.2 -90.6 -15.3 40.6 29.1 28.6 11 12 A I H X S+ 0 0 0 -4,-1.7 4,-0.8 1,-0.2 3,-0.7 0.965 116.2 50.7 -57.1 -57.0 37.8 30.9 24.3 13 14 A V H >X S+ 0 0 0 -4,-1.6 4,-1.3 1,-0.3 3,-1.2 0.869 110.0 46.7 -46.1 -53.1 37.8 32.9 27.6 14 15 A A H 3X S+ 0 0 0 -4,-2.0 4,-1.2 1,-0.3 -1,-0.3 0.787 105.8 60.1 -77.0 -13.5 41.0 34.7 27.0 15 16 A S H S+ 0 0 0 -4,-1.3 5,-3.8 2,-0.2 -2,-0.2 0.825 113.8 48.8 -64.4 -28.5 39.5 39.6 26.7 18 19 A I H ><5S+ 0 0 54 -4,-1.2 3,-1.2 3,-0.2 -2,-0.2 0.940 108.2 53.2 -74.6 -44.1 41.2 39.9 23.3 19 20 A K H 3<5S+ 0 0 89 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.856 114.4 42.0 -51.6 -40.1 37.8 40.6 21.7 20 21 A F T 3<5S- 0 0 77 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.484 118.6-116.3 -88.5 -2.5 37.4 43.4 24.3 21 22 A S T < 5S+ 0 0 85 -3,-1.2 -3,-0.2 -4,-0.2 3,-0.1 0.914 74.6 130.3 64.8 50.6 41.0 44.5 23.8 22 23 A R >>< + 0 0 143 -5,-3.8 3,-1.5 1,-0.1 4,-0.6 -0.395 12.9 149.4-124.8 44.9 42.1 43.7 27.3 23 24 A E H >> + 0 0 73 1,-0.3 4,-1.6 -5,-0.2 3,-0.5 0.758 56.3 82.9 -53.1 -28.1 45.2 41.6 26.5 24 25 A D H 34 S+ 0 0 112 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.813 88.8 51.1 -43.8 -39.2 46.8 42.9 29.7 25 26 A I H X4 S+ 0 0 51 -3,-1.5 3,-0.8 1,-0.2 -1,-0.2 0.899 111.5 47.9 -65.6 -38.0 45.0 40.2 31.7 26 27 A V H << S+ 0 0 5 -4,-0.6 -2,-0.2 -3,-0.5 -1,-0.2 0.781 94.5 79.4 -70.1 -27.2 46.2 37.6 29.3 27 28 A E T 3< S+ 0 0 106 -4,-1.6 2,-0.4 1,-0.1 -1,-0.2 0.473 93.5 46.1 -73.1 -4.2 49.8 38.9 29.5 28 29 A N <> - 0 0 60 -3,-0.8 4,-1.5 -4,-0.2 59,-0.1 -0.956 68.1-148.5-140.3 130.1 50.6 37.3 32.8 29 30 A R H > S+ 0 0 85 57,-1.0 4,-2.7 -2,-0.4 5,-0.2 0.875 96.3 48.6 -59.4 -43.2 49.9 33.7 33.8 30 31 A A H > S+ 0 0 24 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.964 111.4 47.2 -70.3 -51.6 49.3 34.3 37.6 31 32 A N H > S+ 0 0 104 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.806 115.2 50.4 -44.2 -36.2 47.0 37.2 37.2 32 33 A F H X S+ 0 0 5 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.893 106.4 52.6 -75.3 -42.8 45.2 35.0 34.7 33 34 A I H X S+ 0 0 8 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.877 110.4 49.1 -55.5 -43.3 45.1 32.0 37.0 34 35 A A H X S+ 0 0 60 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.967 110.6 49.9 -60.5 -51.8 43.5 34.2 39.6 35 36 A F H X S+ 0 0 14 -4,-1.8 4,-2.3 1,-0.2 5,-0.3 0.859 107.3 57.2 -46.2 -44.6 41.1 35.4 36.9 36 37 A L H X>S+ 0 0 0 -4,-2.6 5,-2.3 2,-0.2 4,-1.5 0.936 108.5 43.0 -56.6 -52.5 40.4 31.7 36.2 37 38 A N H <5S+ 0 0 43 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.886 113.4 55.5 -63.6 -37.5 39.3 30.8 39.7 38 39 A E H <5S+ 0 0 111 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.898 114.6 34.5 -59.6 -49.5 37.3 34.0 39.9 39 40 A I H <5S- 0 0 10 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.645 120.4-109.4 -87.2 -11.8 35.1 33.5 36.8 40 41 A G T <5 + 0 0 11 -4,-1.5 2,-0.6 -5,-0.3 -3,-0.2 0.750 54.5 162.3 95.7 33.0 35.1 29.7 37.5 41 42 A V < - 0 0 1 -5,-2.3 7,-0.4 -6,-0.2 -1,-0.2 -0.710 22.2-165.9 -80.0 120.5 37.3 27.9 35.0 42 43 A T - 0 0 8 -2,-0.6 5,-0.2 1,-0.2 119,-0.0 -0.616 19.6-148.6-100.7 158.5 38.1 24.5 36.4 43 44 A H S S- 0 0 25 3,-2.3 2,-1.3 -2,-0.2 -1,-0.2 0.689 90.5 -5.5 -82.8-101.1 40.6 21.8 35.4 44 45 A E S S- 0 0 127 3,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.323 127.0 -65.1 -89.9 53.6 39.3 18.3 36.2 45 46 A G S S+ 0 0 17 -2,-1.3 2,-0.2 1,-0.3 -1,-0.1 0.451 118.3 101.2 74.1 0.3 36.3 19.8 37.9 46 47 A R S S- 0 0 186 1,-0.1 -3,-2.3 115,-0.1 -1,-0.3 -0.684 84.0 -80.5-112.0 168.4 38.5 21.3 40.5 47 48 A K - 0 0 104 -2,-0.2 2,-0.7 -5,-0.2 -3,-0.2 -0.260 52.5-105.9 -70.1 153.8 39.8 24.8 41.2 48 49 A L - 0 0 2 -7,-0.4 -11,-0.2 -15,-0.2 2,-0.1 -0.726 33.7-156.0-105.0 113.8 42.8 25.8 39.1 49 50 A N > - 0 0 87 -2,-0.7 4,-2.1 1,-0.1 5,-0.2 -0.421 23.5-116.8 -90.1 157.7 46.2 25.9 40.9 50 51 A Q H > S+ 0 0 119 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.899 113.1 33.6 -63.3 -46.3 49.3 27.9 40.0 51 52 A N H > S+ 0 0 119 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.905 118.6 52.2 -70.8 -43.1 51.6 25.0 39.3 52 53 A S H > S+ 0 0 41 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.717 105.9 58.0 -73.2 -19.3 48.9 22.7 37.9 53 54 A F H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 3,-0.3 0.923 103.0 51.3 -61.9 -53.1 48.0 25.5 35.6 54 55 A R H X>S+ 0 0 139 -4,-1.2 4,-2.4 1,-0.3 5,-0.5 0.909 108.3 51.7 -64.2 -37.1 51.5 25.7 34.1 55 56 A K H X5S+ 0 0 98 -4,-1.7 4,-0.5 3,-0.2 -1,-0.3 0.831 108.2 52.9 -62.6 -34.3 51.5 21.9 33.4 56 57 A I H <5S+ 0 0 0 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.946 118.1 33.2 -65.3 -49.2 48.2 22.1 31.6 57 58 A V H <5S+ 0 0 13 -4,-2.1 3,-0.3 2,-0.1 -2,-0.2 0.883 127.9 33.1 -76.2 -40.9 49.1 24.9 29.2 58 59 A S H <5S+ 0 0 58 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.942 110.2 55.2 -83.3 -55.7 52.8 24.2 28.6 59 60 A E S < - 0 0 56 1,-0.1 4,-1.1 4,-0.0 5,-0.1 -0.401 26.3-106.3 -87.9 173.6 51.7 17.0 23.5 62 63 A Q H > S+ 0 0 124 2,-0.2 4,-3.2 1,-0.2 3,-0.5 0.934 120.4 59.6 -63.1 -41.5 51.9 17.9 19.8 63 64 A E H > S+ 0 0 128 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.908 103.1 48.3 -46.1 -56.6 48.7 15.8 19.4 64 65 A D H > S+ 0 0 15 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.815 114.4 48.2 -51.8 -33.8 46.7 18.0 21.8 65 66 A K H X S+ 0 0 34 -4,-1.1 4,-3.1 -3,-0.5 3,-0.4 0.949 109.3 50.4 -81.8 -48.7 48.0 21.1 20.0 66 67 A K H X S+ 0 0 123 -4,-3.2 4,-2.5 1,-0.2 -2,-0.2 0.869 108.0 56.1 -49.0 -39.7 47.1 19.7 16.5 67 68 A T H X S+ 0 0 59 -4,-2.5 4,-1.2 -5,-0.2 -1,-0.2 0.877 110.6 43.1 -63.4 -34.9 43.7 19.0 17.9 68 69 A L H X S+ 0 0 0 -4,-1.2 4,-3.0 -3,-0.4 3,-0.2 0.941 112.0 54.5 -70.8 -45.0 43.4 22.6 18.9 69 70 A I H < S+ 0 0 61 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.853 109.7 47.9 -56.5 -39.6 44.8 23.7 15.5 70 71 A D H < S+ 0 0 126 -4,-2.5 3,-0.3 -5,-0.2 -1,-0.2 0.847 121.7 31.9 -69.3 -37.2 42.3 21.7 13.6 71 72 A E H < S+ 0 0 64 -4,-1.2 2,-0.3 -3,-0.2 -2,-0.2 0.782 126.4 38.4 -94.6 -26.3 39.2 22.9 15.5 72 73 A F S X>S+ 0 0 11 -4,-3.0 4,-2.7 1,-0.2 5,-0.6 -0.554 75.6 164.7-126.3 60.0 40.2 26.4 16.4 73 74 A N H >5S+ 0 0 107 -3,-0.3 4,-1.3 -2,-0.3 -1,-0.2 0.924 75.8 11.9 -54.0 -70.9 42.0 27.4 13.3 74 75 A E H >5S+ 0 0 177 2,-0.2 4,-1.5 3,-0.1 5,-0.3 0.806 127.9 60.2 -73.8 -31.3 42.3 31.1 13.3 75 76 A G H >5S+ 0 0 38 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.944 109.6 36.6 -70.6 -50.4 41.3 31.4 16.9 76 77 A F H X5S+ 0 0 10 -4,-2.7 4,-3.4 -8,-0.2 5,-0.4 0.941 108.2 66.5 -70.6 -46.1 44.0 29.3 18.5 77 78 A E H XX S+ 0 0 35 -4,-1.5 4,-1.3 1,-0.2 3,-1.2 0.982 124.3 42.5 -63.5 -59.1 46.7 34.0 17.4 79 80 A V H 3X S+ 0 0 15 -4,-1.7 4,-3.3 1,-0.3 -2,-0.2 0.757 108.6 60.1 -71.8 -19.8 45.7 33.5 21.1 80 81 A Y H 3X S+ 0 0 23 -4,-3.4 4,-1.5 2,-0.2 -1,-0.3 0.708 100.2 54.9 -81.2 -18.5 48.1 30.5 21.5 81 82 A R H < S+ 0 0 89 -4,-1.5 3,-2.1 1,-0.2 -2,-0.2 0.997 112.3 44.3 -68.3 -65.0 52.2 30.3 25.2 85 86 A M H >< S+ 0 0 86 -4,-2.1 3,-1.4 1,-0.3 -2,-0.2 0.734 105.4 60.3 -47.9 -33.8 54.6 33.2 25.5 86 87 A Y T 3< S+ 0 0 49 -4,-1.9 -57,-1.0 1,-0.3 -1,-0.3 0.583 109.0 45.9 -82.0 -4.4 53.1 34.6 28.7 87 88 A T T < 0 0 10 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 -0.184 360.0 360.0-129.1 41.0 53.9 31.4 30.5 88 89 A N < 0 0 157 -3,-1.4 -3,-0.1 -30,-0.0 -4,-0.0 -0.845 360.0 360.0 -89.3 360.0 57.4 31.0 29.2 89 !* 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 90 2 B N 0 0 136 0, 0.0 2,-0.2 0, 0.0 43,-0.1 0.000 360.0 360.0 360.0 -60.8 31.8 15.4 23.0 91 3 B K > - 0 0 123 41,-0.1 4,-0.8 1,-0.0 54,-0.0 -0.668 360.0 -84.8-136.1-172.0 28.3 15.5 24.6 92 4 B N H >> S+ 0 0 26 -2,-0.2 4,-1.8 1,-0.2 3,-0.8 0.918 120.9 57.5 -69.4 -38.8 26.0 18.3 25.6 93 5 B I H 3> S+ 0 0 11 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.876 99.9 56.8 -56.9 -49.2 27.6 19.0 28.9 94 6 B D H 3> S+ 0 0 11 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.785 108.4 49.8 -48.0 -37.2 31.0 19.7 27.5 95 7 B T H X S+ 0 0 1 -4,-1.5 4,-1.8 1,-0.2 3,-1.0 0.958 110.3 52.7 -67.5 -48.4 32.6 30.3 31.6 102 14 B V H 3X S+ 0 0 0 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.828 108.8 50.4 -47.3 -33.6 32.5 32.7 28.7 103 15 B A H 3X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.686 104.3 57.1 -87.7 -11.7 29.2 34.1 29.8 104 16 B S H S+ 0 0 0 -4,-1.3 5,-3.0 1,-0.2 -2,-0.2 0.928 111.8 42.5 -62.3 -41.1 30.3 38.7 30.1 107 19 B I H ><5S+ 0 0 55 -4,-1.6 3,-1.1 3,-0.3 -1,-0.2 0.817 105.9 62.9 -78.8 -20.4 28.7 39.3 33.4 108 20 B K H 3<5S+ 0 0 88 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.931 110.4 41.0 -57.3 -41.9 32.0 40.0 35.1 109 21 B F T 3<5S- 0 0 55 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.386 120.5-116.0 -84.1 3.2 32.1 42.9 32.6 110 22 B S T < 5S+ 0 0 85 -3,-1.1 -3,-0.3 -5,-0.1 3,-0.2 0.837 71.2 137.2 61.8 39.7 28.4 43.6 33.3 111 23 B R >>< + 0 0 139 -5,-3.0 3,-1.4 1,-0.2 4,-0.5 -0.359 6.9 145.6-111.8 52.8 27.4 42.8 29.7 112 24 B E H 3> + 0 0 79 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.598 53.5 85.7 -67.2 -6.8 24.3 40.8 30.4 113 25 B D H 34 S+ 0 0 97 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.806 91.6 47.6 -57.9 -35.6 22.7 42.2 27.2 114 26 B I H X4 S+ 0 0 41 -3,-1.4 3,-0.7 1,-0.1 -1,-0.2 0.848 113.4 46.6 -72.4 -38.5 24.4 39.5 25.2 115 27 B V H 3< S+ 0 0 4 -4,-0.5 -2,-0.2 1,-0.2 -1,-0.1 0.857 94.4 77.6 -77.5 -34.8 23.3 36.8 27.7 116 28 B E T 3< S+ 0 0 111 -4,-2.4 2,-0.4 1,-0.1 -1,-0.2 0.526 99.3 39.9 -56.7 -12.8 19.7 37.9 27.9 117 29 B N S <> S- 0 0 57 -3,-0.7 4,-1.3 -4,-0.2 59,-0.1 -0.990 71.3-140.4-141.3 139.2 18.9 36.4 24.5 118 30 B R H > S+ 0 0 96 57,-0.8 4,-2.5 -2,-0.4 5,-0.2 0.855 100.3 55.5 -55.5 -40.6 19.9 33.1 23.0 119 31 B A H > S+ 0 0 27 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.960 107.2 45.7 -66.1 -56.4 20.3 34.6 19.5 120 32 B N H > S+ 0 0 93 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.815 114.5 52.3 -45.9 -35.4 22.8 37.3 20.4 121 33 B F H X S+ 0 0 5 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.922 106.2 51.4 -72.4 -45.6 24.6 34.7 22.4 122 34 B I H X S+ 0 0 7 -4,-2.5 4,-2.0 2,-0.3 -2,-0.2 0.828 109.1 52.0 -55.9 -40.0 24.8 32.3 19.4 123 35 B A H X S+ 0 0 58 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.961 110.9 46.8 -61.2 -53.1 26.2 35.1 17.3 124 36 B F H X S+ 0 0 11 -4,-1.9 4,-2.3 2,-0.2 5,-0.3 0.826 107.2 58.4 -54.8 -33.8 28.8 35.7 20.0 125 37 B L H X>S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 5,-1.5 0.920 106.6 47.6 -64.1 -40.9 29.4 31.9 20.1 126 38 B N H <5S+ 0 0 78 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.830 111.7 54.5 -67.3 -31.2 30.3 32.1 16.4 127 39 B E H <5S+ 0 0 125 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.994 115.7 32.0 -57.4 -67.6 32.5 35.0 17.2 128 40 B I H <5S- 0 0 12 -4,-2.3 -2,-0.2 1,-0.1 -3,-0.2 0.649 113.5-115.3 -80.4 -12.5 34.7 33.5 19.9 129 41 B G T <5 + 0 0 22 -4,-1.6 2,-1.0 -5,-0.3 -3,-0.2 0.856 44.9 170.8 89.0 40.5 34.5 30.1 18.4 130 42 B V < - 0 0 2 -5,-1.5 2,-0.5 -6,-0.1 7,-0.3 -0.721 17.2-173.4 -76.3 110.0 32.8 27.7 20.7 131 43 B T - 0 0 22 -2,-1.0 3,-0.3 1,-0.2 5,-0.2 -0.895 8.4-157.0-106.3 127.8 32.5 24.7 18.3 132 44 B H S S+ 0 0 29 3,-1.2 2,-1.3 -2,-0.5 -1,-0.2 0.947 76.7 5.3 -74.2 -92.6 30.5 21.8 19.6 133 45 B E S S- 0 0 110 1,-0.1 -1,-0.2 3,-0.1 3,-0.1 -0.289 126.6 -69.3 -92.8 52.0 31.1 18.4 18.1 134 46 B G S S+ 0 0 43 -2,-1.3 2,-0.3 1,-0.3 -1,-0.1 0.635 117.4 101.9 68.7 15.3 34.0 19.8 16.1 135 47 B R S S- 0 0 171 1,-0.1 -3,-1.2 0, 0.0 -1,-0.3 -0.836 83.6 -82.6-128.0 161.3 31.4 21.6 14.1 136 48 B K - 0 0 149 -2,-0.3 2,-0.5 -5,-0.2 -3,-0.1 -0.331 48.5-114.5 -63.7 141.0 30.0 25.1 13.8 137 49 B L - 0 0 5 -7,-0.3 2,-0.2 -15,-0.1 -1,-0.1 -0.700 34.8-162.6 -90.3 124.7 27.3 25.9 16.4 138 50 B N > - 0 0 68 -2,-0.5 4,-1.5 1,-0.1 5,-0.1 -0.476 30.7-108.9-101.4 170.6 23.9 26.6 15.0 139 51 B Q H > S+ 0 0 102 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.914 120.3 37.7 -69.0 -42.9 20.7 28.2 16.3 140 52 B N H > S+ 0 0 119 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.894 116.0 52.8 -72.5 -39.0 18.8 25.0 16.6 141 53 B S H > S+ 0 0 34 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.748 105.7 56.8 -70.5 -23.6 21.9 23.1 17.8 142 54 B F H X S+ 0 0 4 -4,-1.5 4,-1.8 2,-0.2 5,-0.3 0.895 103.6 52.0 -65.3 -45.4 22.4 25.7 20.4 143 55 B R H X S+ 0 0 128 -4,-1.1 4,-2.2 1,-0.2 5,-0.3 0.907 108.2 51.5 -70.3 -33.2 19.0 25.2 21.9 144 56 B K H X S+ 0 0 79 -4,-1.7 4,-2.1 3,-0.2 5,-0.3 0.922 106.0 54.6 -56.3 -47.8 19.5 21.4 22.1 145 57 B I H < S+ 0 0 0 -4,-1.4 4,-0.3 1,-0.2 -49,-0.2 0.887 117.3 34.8 -58.4 -44.4 22.8 21.8 24.0 146 58 B V H < S+ 0 0 22 -4,-1.8 3,-0.3 2,-0.1 -1,-0.2 0.903 124.8 39.2 -76.5 -44.1 21.3 24.0 26.7 147 59 B S H < S+ 0 0 60 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.2 0.930 105.3 55.3 -74.3 -54.4 17.9 22.4 27.0 148 60 B E S < S+ 0 0 111 -4,-2.1 -1,-0.2 -5,-0.3 -3,-0.1 0.490 72.4 132.8 -78.5 -0.2 18.1 18.7 26.7 149 61 B L - 0 0 6 -4,-0.3 2,-0.1 -3,-0.3 -3,-0.0 -0.003 55.6-120.7 -41.0 142.2 20.6 18.1 29.5 150 62 B T > - 0 0 62 1,-0.1 4,-1.8 4,-0.0 5,-0.2 -0.352 23.1-108.5 -86.0 171.7 19.7 15.4 31.9 151 63 B Q H > S+ 0 0 126 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.921 123.4 51.3 -67.8 -37.9 19.3 16.0 35.6 152 64 B E H > S+ 0 0 137 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.837 107.8 51.5 -58.5 -40.9 22.6 14.2 36.2 153 65 B D H > S+ 0 0 33 2,-0.2 4,-1.5 3,-0.2 -1,-0.2 0.880 113.3 44.8 -65.3 -36.5 24.3 16.4 33.6 154 66 B K H X S+ 0 0 40 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.943 112.6 50.3 -75.3 -46.1 23.0 19.4 35.4 155 67 B K H X S+ 0 0 116 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.843 105.7 59.5 -52.6 -37.9 23.9 18.0 38.8 156 68 B T H X S+ 0 0 55 -4,-2.0 4,-1.9 2,-0.2 5,-0.2 0.934 107.5 43.7 -58.3 -44.8 27.3 17.4 37.3 157 69 B L H X S+ 0 0 0 -4,-1.5 4,-2.9 2,-0.2 8,-0.3 0.903 109.8 57.4 -69.9 -37.8 27.7 21.1 36.6 158 70 B I H < S+ 0 0 75 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.908 111.9 42.3 -51.2 -47.0 26.4 21.9 40.0 159 71 B D H < S+ 0 0 108 -4,-2.3 3,-0.3 1,-0.1 -2,-0.2 0.844 123.2 35.3 -70.8 -37.2 29.1 19.8 41.6 160 72 B E H < S+ 0 0 59 -4,-1.9 2,-0.6 1,-0.2 -2,-0.2 0.840 122.0 41.3 -89.6 -35.7 32.0 20.9 39.3 161 73 B F S X S+ 0 0 5 -4,-2.9 4,-1.9 -5,-0.2 5,-0.5 -0.607 72.8 163.2-116.6 68.1 31.1 24.6 38.7 162 74 B N H > S+ 0 0 95 -2,-0.6 4,-1.1 -3,-0.3 -1,-0.2 0.966 72.4 23.3 -57.9 -71.6 30.0 25.5 42.2 163 75 B E H > S+ 0 0 121 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.929 126.9 47.9 -58.7 -51.1 30.1 29.3 42.3 164 76 B G H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 5,-0.4 0.930 109.4 46.3 -64.2 -52.5 29.8 29.9 38.6 165 77 B F H X S+ 0 0 11 -4,-1.9 4,-1.0 -8,-0.3 -1,-0.2 0.783 106.0 63.1 -72.7 -20.9 26.9 27.6 37.5 166 78 B E H X S+ 0 0 138 -4,-1.1 4,-0.8 -5,-0.5 -1,-0.2 0.999 116.1 28.8 -56.1 -60.3 24.9 28.9 40.4 167 79 B G H >X S+ 0 0 37 -4,-1.5 3,-1.3 2,-0.2 4,-1.2 0.992 126.2 39.2 -61.9 -70.6 24.9 32.4 39.0 168 80 B V H 3X S+ 0 0 7 -4,-2.1 4,-3.1 1,-0.3 5,-0.3 0.833 109.6 60.2 -61.4 -32.2 25.2 32.0 35.2 169 81 B Y H 3X S+ 0 0 25 -4,-1.0 4,-1.0 -5,-0.4 -1,-0.3 0.724 100.5 55.1 -77.7 -13.1 22.9 29.0 35.0 170 82 B R H < S+ 0 0 81 -4,-1.0 3,-0.7 -5,-0.3 -1,-0.2 0.893 111.1 46.6 -79.3 -37.0 18.3 29.0 31.6 174 86 B M H >< S+ 0 0 99 -4,-1.8 3,-1.1 -3,-0.4 -2,-0.2 0.845 106.8 57.3 -76.4 -29.8 15.8 31.7 31.9 175 87 B Y T 3< S+ 0 0 54 -4,-1.9 -57,-0.8 1,-0.3 -1,-0.2 0.549 110.2 46.1 -82.5 -5.6 16.8 33.5 28.7 176 88 B T T < 0 0 18 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.1 -0.306 360.0 360.0-135.3 51.4 16.2 30.3 26.7 177 89 B N < 0 0 167 -3,-1.1 -3,-0.0 -30,-0.0 -4,-0.0 -0.926 360.0 360.0 -96.0 360.0 12.9 29.3 28.0