==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 19-NOV-08 3FBI . COMPND 2 MOLECULE: MEDIATOR OF RNA POLYMERASE II TRANSCRIPTION . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR T.KOSCHUBS,M.SEIZL,L.LARIVIERE,F.KURTH,S.BAUMLI,D.E.MARTIN, . 294 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17988.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 61.9 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 . 4 1.4 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 . 2 0.7 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 . 14 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 23.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 31.6 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 3 1 0 2 0 0 2 2 0 0 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 . 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 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 12 A S 0 0 138 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 91.6 13.9 92.0 17.8 2 13 A L + 0 0 180 2,-0.1 0, 0.0 0, 0.0 0, 0.0 0.563 360.0 100.8 -72.4 -10.2 16.8 90.6 15.7 3 14 A Y S S- 0 0 81 1,-0.0 0, 0.0 80,-0.0 0, 0.0 -0.703 78.6-130.3 -73.5 117.5 18.5 90.1 19.0 4 15 A P - 0 0 68 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.238 15.1-115.8 -66.6 158.1 18.1 86.4 19.9 5 16 A P - 0 0 105 0, 0.0 82,-0.0 0, 0.0 0, 0.0 -0.474 47.0 -79.2 -81.6 164.7 16.8 85.3 23.3 6 17 A P - 0 0 28 0, 0.0 4,-0.1 0, 0.0 93,-0.0 -0.328 67.3 -75.8 -63.3 152.6 19.0 83.2 25.6 7 18 A P > - 0 0 10 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.056 39.7-114.8 -50.0 144.7 19.4 79.5 24.7 8 19 A P G > S+ 0 0 94 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.757 108.4 77.7 -53.5 -26.3 16.4 77.2 25.6 9 20 A Y G > S+ 0 0 31 1,-0.3 3,-1.2 2,-0.1 4,-0.2 0.553 71.1 84.8 -62.8 -9.2 18.7 75.4 28.1 10 21 A V G X S+ 0 0 19 -3,-2.1 3,-2.2 1,-0.2 -1,-0.3 0.855 74.6 68.9 -64.3 -33.6 18.3 78.3 30.5 11 22 A K G < S+ 0 0 152 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.736 92.6 60.2 -58.6 -23.5 15.0 76.8 31.9 12 23 A F G < S+ 0 0 42 -3,-1.2 2,-1.6 1,-0.2 -1,-0.3 0.591 79.7 90.8 -80.6 -10.9 16.9 74.0 33.5 13 24 A F < + 0 0 2 -3,-2.2 88,-0.2 -4,-0.2 -1,-0.2 -0.325 55.4 144.6 -90.2 57.5 19.0 76.3 35.6 14 25 A T > - 0 0 43 -2,-1.6 4,-1.6 -3,-0.1 5,-0.1 -0.458 62.5-116.5 -86.0 163.0 16.8 76.3 38.7 15 26 A Q H > S+ 0 0 121 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.837 116.0 58.7 -72.8 -27.6 18.1 76.5 42.2 16 27 A S H >> S+ 0 0 57 2,-0.2 4,-1.6 1,-0.2 3,-0.5 0.976 107.4 44.1 -56.0 -60.0 16.6 73.0 42.8 17 28 A N H 3> S+ 0 0 24 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.816 109.4 57.8 -57.4 -33.9 18.6 71.5 40.0 18 29 A L H >< S+ 0 0 61 -4,-1.6 3,-0.5 1,-0.2 -1,-0.2 0.886 105.5 50.2 -66.0 -36.8 21.7 73.3 41.2 19 30 A E H << S+ 0 0 158 -4,-1.7 4,-0.4 -3,-0.5 -2,-0.2 0.856 110.4 49.5 -67.8 -36.7 21.4 71.6 44.6 20 31 A K H 3X S+ 0 0 117 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.591 92.7 84.1 -77.1 -11.3 21.0 68.2 43.0 21 32 A L H S+ 0 0 79 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.895 113.5 42.8 -53.3 -44.7 26.9 67.7 43.2 23 34 A K H > S+ 0 0 173 -4,-0.4 4,-2.6 2,-0.2 5,-0.2 0.888 113.3 52.6 -68.6 -40.0 25.4 64.3 43.9 24 35 A Y H X S+ 0 0 47 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.924 106.3 53.2 -59.0 -46.4 24.5 63.8 40.3 25 36 A K H X S+ 0 0 116 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.901 110.7 48.4 -57.3 -42.2 28.1 64.5 39.2 26 37 A E H >X S+ 0 0 138 -4,-1.6 4,-0.7 -5,-0.3 3,-0.7 0.987 110.8 48.1 -58.5 -62.3 29.3 61.9 41.6 27 38 A K H >< S+ 0 0 164 -4,-2.6 3,-1.1 1,-0.3 -2,-0.2 0.833 107.9 58.0 -48.4 -38.4 26.8 59.2 40.5 28 39 A K H 3< S+ 0 0 102 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.929 94.6 63.5 -59.9 -46.4 27.8 59.9 36.9 29 40 A A H << 0 0 93 -4,-1.7 -1,-0.3 -3,-0.7 -2,-0.2 0.714 360.0 360.0 -52.1 -22.5 31.4 59.1 37.6 30 41 A A << 0 0 124 -3,-1.1 -2,-0.1 -4,-0.7 -3,-0.1 0.523 360.0 360.0 -85.8 360.0 30.2 55.6 38.4 31 ! 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 32 57 A E 0 0 203 0, 0.0 34,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 122.5 25.5 63.8 22.6 33 58 A E + 0 0 151 6,-0.1 2,-0.5 0, 0.0 6,-0.0 -0.428 360.0 161.7-135.1 60.4 24.1 61.7 25.4 34 59 A I + 0 0 50 1,-0.2 3,-0.1 6,-0.0 4,-0.0 -0.719 6.2 152.1 -87.6 127.9 21.3 63.8 27.1 35 60 A T + 0 0 104 -2,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.583 61.3 15.1-127.0 -26.2 18.9 61.8 29.3 36 61 A C S > S- 0 0 47 1,-0.1 3,-1.0 0, 0.0 -1,-0.3 -0.926 80.1 -94.8-148.3 173.6 17.7 64.2 32.0 37 62 A A G > S+ 0 0 35 -2,-0.3 3,-1.8 1,-0.2 4,-0.3 0.862 114.7 62.3 -59.4 -39.8 17.5 67.9 32.9 38 63 A L G > S+ 0 0 22 1,-0.3 3,-1.9 2,-0.2 -1,-0.2 0.763 86.6 73.7 -63.0 -25.0 20.6 67.9 35.1 39 64 A D G X S+ 0 0 10 -3,-1.0 3,-0.9 1,-0.3 -1,-0.3 0.731 88.3 62.5 -60.6 -22.2 22.8 67.0 32.1 40 65 A Y G < S+ 0 0 54 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.633 91.1 65.2 -79.8 -16.7 22.4 70.6 30.8 41 66 A L G < S+ 0 0 7 -3,-1.9 -1,-0.2 -4,-0.3 -2,-0.2 0.246 92.3 77.5 -88.0 11.7 24.1 72.0 33.9 42 67 A I S < S- 0 0 27 -3,-0.9 63,-0.0 -4,-0.0 -1,-0.0 -0.988 94.4-107.9-126.6 122.6 27.3 70.2 32.7 43 68 A P - 0 0 45 0, 0.0 -2,-0.1 0, 0.0 25,-0.1 -0.120 39.6-105.6 -52.6 143.3 29.3 71.8 29.9 44 69 A P - 0 0 3 0, 0.0 2,-0.1 0, 0.0 -4,-0.0 -0.318 43.1 -95.0 -64.9 154.3 29.1 69.9 26.6 45 70 A P - 0 0 102 0, 0.0 23,-0.1 0, 0.0 0, 0.0 -0.361 41.1 -98.7 -73.1 149.5 32.2 67.8 25.6 46 71 A X - 0 0 61 1,-0.1 68,-0.0 -2,-0.1 3,-0.0 -0.518 41.4-119.3 -64.8 127.5 34.9 69.2 23.3 47 72 A P - 0 0 36 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.219 14.2-127.0 -58.9 158.2 34.4 68.1 19.7 48 73 A K S S+ 0 0 201 2,-0.0 2,-0.4 3,-0.0 -2,-0.0 0.923 87.1 86.9 -75.9 -48.0 37.2 66.0 18.1 49 74 A N S > S- 0 0 63 1,-0.2 3,-1.3 2,-0.1 4,-0.1 -0.392 70.8-150.0 -58.5 111.1 37.6 68.2 15.0 50 75 A Q G > S+ 0 0 132 -2,-0.4 3,-1.6 1,-0.3 -1,-0.2 0.311 77.2 101.4 -70.0 13.3 40.1 70.9 16.0 51 76 A Q G 3 S+ 0 0 159 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.522 70.2 66.6 -76.6 -5.2 38.4 73.1 13.5 52 77 A Y G < S+ 0 0 55 -3,-1.3 2,-0.3 -5,-0.1 -1,-0.3 0.482 76.6 107.3 -86.8 -6.1 36.6 74.6 16.5 53 78 A R S < S- 0 0 128 -3,-1.6 64,-0.3 1,-0.1 63,-0.1 -0.600 86.4-102.7 -73.2 131.3 40.0 75.9 17.6 54 79 A A - 0 0 31 62,-2.6 64,-0.1 -2,-0.3 -1,-0.1 -0.285 20.0-152.9 -63.1 131.5 40.0 79.7 17.0 55 80 A F S S- 0 0 171 1,-0.2 2,-0.3 62,-0.1 -1,-0.2 0.782 70.4 -47.7 -70.0 -28.7 41.9 80.9 13.9 56 81 A G - 0 0 26 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.973 68.7 -64.6 179.4-170.5 42.6 84.2 15.6 57 82 A S - 0 0 61 -2,-0.3 2,-0.4 -3,-0.1 63,-0.2 -0.807 22.9-167.0-108.6 147.4 41.2 87.1 17.6 58 83 A I 0 0 75 61,-2.1 64,-0.2 -2,-0.3 61,-0.0 -0.842 360.0 360.0-129.2 90.8 38.6 89.8 16.7 59 84 A W 0 0 159 -2,-0.4 61,-0.0 61,-0.1 20,-0.0 -0.575 360.0 360.0-104.9 360.0 38.5 92.6 19.3 60 !* 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 61 19 B Q 0 0 244 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 150.0 22.6 74.1 4.5 62 20 B N - 0 0 152 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.760 360.0-103.3-102.8 153.9 23.8 72.7 7.8 63 21 B P - 0 0 116 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.011 60.7 -65.4 -61.0 172.4 21.8 70.7 10.4 64 22 B L - 0 0 162 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.408 67.5 -92.5 -66.3 143.2 20.6 72.5 13.5 65 23 B P - 0 0 64 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.087 35.8-116.5 -51.5 147.5 23.5 73.5 15.9 66 24 B T > - 0 0 66 -3,-0.1 4,-3.4 1,-0.1 5,-0.2 -0.407 28.5-107.7 -75.9 160.3 24.8 71.4 18.7 67 25 B R H > S+ 0 0 24 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.925 125.2 50.1 -55.2 -48.0 24.5 72.5 22.3 68 26 B F H > S+ 0 0 4 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.944 114.0 45.3 -55.4 -49.3 28.3 73.1 22.3 69 27 B E H > S+ 0 0 56 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.885 111.9 52.3 -60.5 -40.3 27.8 75.1 19.1 70 28 B V H X S+ 0 0 27 -4,-3.4 4,-1.8 2,-0.2 -1,-0.2 0.865 113.0 44.0 -65.0 -34.9 24.8 77.0 20.6 71 29 B E H X S+ 0 0 0 -4,-2.3 4,-3.7 2,-0.2 5,-0.3 0.898 111.7 51.4 -82.8 -39.6 26.7 78.0 23.7 72 30 B L H X S+ 0 0 20 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.923 113.3 46.5 -57.7 -48.7 29.9 79.0 21.9 73 31 B E H X S+ 0 0 124 -4,-2.3 4,-1.3 -5,-0.2 -2,-0.2 0.928 116.5 46.1 -57.1 -44.0 27.8 81.2 19.5 74 32 B F H X S+ 0 0 12 -4,-1.8 4,-0.8 2,-0.2 3,-0.5 0.940 109.5 49.5 -73.5 -46.4 25.9 82.6 22.5 75 33 B I H >< S+ 0 0 0 -4,-3.7 3,-1.1 1,-0.2 -1,-0.2 0.918 111.2 53.1 -58.2 -37.2 28.8 83.4 24.8 76 34 B Q H >< S+ 0 0 28 -4,-1.7 3,-1.7 -5,-0.3 -1,-0.2 0.800 96.2 65.5 -70.1 -28.7 30.5 85.1 22.0 77 35 B S H >< S+ 0 0 37 -4,-1.3 3,-1.8 -3,-0.5 -1,-0.3 0.761 86.6 72.9 -63.3 -21.7 27.5 87.4 21.3 78 36 B L T << S+ 0 0 0 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.513 76.7 79.2 -70.5 -3.2 28.1 89.0 24.7 79 37 B A T < S+ 0 0 23 -3,-1.7 2,-0.9 1,-0.1 -1,-0.3 0.639 75.8 85.6 -77.9 -15.2 31.1 90.6 23.1 80 38 B N S <> S- 0 0 73 -3,-1.8 4,-2.2 -4,-0.2 3,-0.5 -0.797 70.2-158.0 -89.3 104.8 28.6 93.1 21.7 81 39 B I H > S+ 0 0 16 -2,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.864 89.5 54.5 -49.8 -46.2 28.0 95.8 24.3 82 40 B Q H > S+ 0 0 101 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.906 109.3 48.2 -56.3 -43.8 24.6 96.9 22.9 83 41 B Y H > S+ 0 0 4 -3,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.948 109.3 50.7 -66.3 -49.0 23.3 93.3 23.0 84 42 B V H X S+ 0 0 0 -4,-2.2 4,-2.9 -7,-0.2 -1,-0.2 0.880 111.5 51.9 -52.4 -39.3 24.4 92.8 26.6 85 43 B T H X S+ 0 0 39 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.933 103.1 55.4 -60.0 -49.4 22.6 96.0 27.3 86 44 B Y H < S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.825 113.8 43.5 -58.5 -29.2 19.4 94.9 25.7 87 45 B L H >< S+ 0 0 5 -4,-1.7 3,-2.6 1,-0.1 -2,-0.2 0.953 108.2 55.0 -77.4 -56.6 19.5 91.9 28.1 88 46 B L H 3< S+ 0 0 3 -4,-2.9 57,-0.4 1,-0.3 -2,-0.2 0.775 111.2 48.5 -45.8 -32.3 20.5 93.8 31.2 89 47 B T T 3< S+ 0 0 67 -4,-2.0 -1,-0.3 -5,-0.2 2,-0.2 -0.130 88.9 111.4-108.0 33.7 17.5 96.0 30.7 90 48 B Q < - 0 0 44 -3,-2.6 55,-0.3 1,-0.1 -3,-0.1 -0.403 55.6-151.3 -86.2 179.5 15.1 93.2 30.1 91 49 B Q S > S+ 0 0 110 -2,-0.2 3,-1.4 53,-0.1 4,-0.5 0.735 80.4 45.7-116.5 -63.7 12.4 92.4 32.6 92 50 B Q G >> S+ 0 0 111 1,-0.3 3,-1.5 2,-0.2 4,-0.8 0.835 101.7 62.9 -58.2 -43.7 11.5 88.7 32.7 93 51 B I G 34 S+ 0 0 31 1,-0.3 6,-0.5 2,-0.2 7,-0.4 0.585 103.9 48.6 -68.8 -9.2 14.9 87.1 32.7 94 52 B W G <4 S+ 0 0 15 -3,-1.4 -1,-0.3 48,-0.1 -2,-0.2 0.523 90.9 78.3-107.6 -8.9 15.9 88.6 36.0 95 53 B K T <4 S+ 0 0 129 -3,-1.5 -2,-0.2 -4,-0.5 -3,-0.1 0.972 101.6 39.7 -56.1 -55.9 12.7 87.6 37.9 96 54 B S S >< S- 0 0 50 -4,-0.8 3,-0.6 1,-0.1 4,-0.5 -0.782 84.7-127.4-100.6 144.6 14.1 84.1 38.2 97 55 B P T 3> S+ 0 0 43 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.518 85.8 99.3 -62.7 -9.5 17.7 83.2 38.9 98 56 B N H 3> S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.919 84.7 39.6 -48.3 -61.0 17.8 80.9 35.9 99 57 B F H <> S+ 0 0 3 -3,-0.6 4,-2.5 -6,-0.5 -1,-0.2 0.915 115.4 52.7 -57.3 -46.3 19.6 83.3 33.5 100 58 B K H > S+ 0 0 84 -4,-0.5 4,-1.2 -7,-0.4 -1,-0.2 0.909 112.6 45.9 -52.6 -43.0 21.9 84.6 36.2 101 59 B N H X S+ 0 0 26 -4,-2.8 4,-2.2 -88,-0.2 -2,-0.2 0.860 108.7 56.2 -72.8 -34.9 22.8 81.0 37.0 102 60 B Y H X S+ 0 0 0 -4,-2.5 4,-1.7 -5,-0.3 -2,-0.2 0.922 104.3 52.5 -60.0 -48.2 23.3 80.2 33.3 103 61 B L H < S+ 0 0 0 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.836 109.3 49.0 -61.1 -33.0 25.8 83.0 32.8 104 62 B K H >< S+ 0 0 137 -4,-1.2 3,-1.4 -5,-0.2 -1,-0.2 0.903 108.4 54.0 -74.0 -37.8 27.9 81.7 35.7 105 63 B Y H >< S+ 0 0 29 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.841 98.8 65.8 -56.9 -32.2 27.7 78.2 34.2 106 64 B L G >< S+ 0 0 0 -4,-1.7 3,-2.1 1,-0.3 -1,-0.2 0.583 73.1 88.4 -72.8 -10.2 29.1 79.7 31.0 107 65 B E G X + 0 0 46 -3,-1.4 3,-1.5 1,-0.3 -1,-0.3 0.502 62.5 90.6 -66.9 0.5 32.4 80.6 32.6 108 66 B Y G X S+ 0 0 21 -3,-1.2 3,-0.9 1,-0.3 -1,-0.3 0.765 77.8 63.2 -63.5 -21.4 33.3 77.1 31.6 109 67 B W G < S+ 0 0 0 -3,-2.1 -1,-0.3 1,-0.2 9,-0.2 0.634 84.5 75.7 -76.3 -14.4 34.6 78.8 28.4 110 68 B C G < S+ 0 0 15 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.2 0.598 94.0 54.7 -77.6 -10.5 37.2 80.8 30.3 111 69 B N S X> S- 0 0 97 -3,-0.9 4,-2.1 -4,-0.2 3,-0.5 -0.837 92.6 -52.4-122.7 159.4 39.5 77.8 30.7 112 70 B P T 34 S+ 0 0 91 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.342 111.8 20.2 -68.6 153.9 41.1 75.3 28.3 113 71 B P T >4 S+ 0 0 61 0, 0.0 3,-0.9 0, 0.0 4,-0.1 -0.986 130.0 48.4 -79.0 -5.7 40.4 73.5 26.2 114 72 B Y G X4 S+ 0 0 38 -3,-0.5 3,-2.7 -6,-0.3 4,-0.4 0.927 104.3 56.9 -59.1 -52.0 37.2 75.6 25.8 115 73 B S G >< S+ 0 0 34 -4,-2.1 3,-1.3 1,-0.3 -1,-0.3 0.720 93.2 71.5 -54.2 -24.9 38.8 79.0 25.8 116 74 B Q G < S+ 0 0 86 -3,-0.9 -62,-2.6 1,-0.3 -1,-0.3 0.514 94.0 56.3 -72.3 -4.2 40.9 78.0 22.8 117 75 B C G < S+ 0 0 5 -3,-2.7 2,-0.5 -64,-0.3 -1,-0.3 0.551 80.7 108.7 -99.1 -14.5 37.7 78.1 20.8 118 76 B I < + 0 0 11 -3,-1.3 -64,-0.1 -4,-0.4 -46,-0.0 -0.548 35.0 171.8 -70.7 115.3 36.9 81.7 21.6 119 77 B V S S+ 0 0 22 -2,-0.5 -61,-2.1 1,-0.2 -1,-0.2 0.733 75.3 57.4 -89.1 -31.5 37.4 84.0 18.6 120 78 B Y > - 0 0 99 -63,-0.2 3,-1.6 1,-0.2 4,-0.4 -0.744 67.5-177.9-104.8 86.2 35.9 87.1 20.4 121 79 B P T >> S+ 0 0 26 0, 0.0 3,-1.3 0, 0.0 4,-0.9 0.760 72.8 69.1 -59.8 -31.5 38.1 87.5 23.5 122 80 B N H 3> S+ 0 0 18 1,-0.3 4,-3.0 -64,-0.2 5,-0.3 0.797 86.2 68.7 -56.5 -32.0 36.1 90.4 24.9 123 81 B C H <> S+ 0 0 0 -3,-1.6 4,-1.9 1,-0.2 -1,-0.3 0.813 97.4 52.6 -61.6 -30.2 33.1 88.2 25.6 124 82 B L H <> S+ 0 0 18 -3,-1.3 4,-2.2 -4,-0.4 -1,-0.2 0.895 110.6 46.1 -70.6 -41.0 35.1 86.4 28.3 125 83 B F H X S+ 0 0 10 -4,-0.9 4,-2.6 2,-0.2 -2,-0.2 0.956 115.1 47.0 -65.6 -49.0 36.0 89.7 30.0 126 84 B I H X S+ 0 0 1 -4,-3.0 4,-3.2 2,-0.2 -2,-0.2 0.838 109.0 54.4 -62.3 -35.2 32.4 91.0 29.8 127 85 B L H X S+ 0 0 0 -4,-1.9 4,-3.1 -5,-0.3 -1,-0.2 0.968 109.4 48.8 -61.2 -50.1 31.0 87.7 31.1 128 86 B K H X S+ 0 0 34 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.913 115.8 42.4 -54.3 -50.8 33.3 88.0 34.1 129 87 B L H X S+ 0 0 1 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.976 114.2 51.4 -57.0 -54.9 32.2 91.6 34.7 130 88 B L H X S+ 0 0 3 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.885 113.3 46.9 -53.0 -41.1 28.6 90.7 34.0 131 89 B N H X S+ 0 0 10 -4,-3.1 4,-1.2 2,-0.2 -1,-0.2 0.936 111.2 46.6 -68.3 -52.1 28.8 87.9 36.5 132 90 B G H X S+ 0 0 5 -4,-2.6 4,-0.9 1,-0.2 3,-0.3 0.876 111.8 54.1 -60.6 -39.0 30.5 89.6 39.4 133 91 B F H >X S+ 0 0 8 -4,-2.8 4,-1.1 -5,-0.3 3,-0.6 0.947 103.6 56.4 -55.7 -49.2 28.1 92.5 39.0 134 92 B X H 3< S+ 0 0 9 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.760 95.7 64.9 -59.6 -31.1 25.1 90.1 39.3 135 93 B E H 3< S+ 0 0 114 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.949 118.2 23.8 -55.6 -52.6 26.2 88.7 42.6 136 94 B S H << S+ 0 0 32 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.416 96.3 118.5 -96.3 -2.2 25.7 92.0 44.4 137 95 B A < - 0 0 19 -4,-1.1 2,-0.5 -5,-0.1 -3,-0.0 -0.456 62.6-133.2 -68.8 137.3 23.2 93.4 41.9 138 96 B I - 0 0 92 -2,-0.1 8,-2.5 1,-0.0 2,-0.7 -0.828 14.0-143.6 -96.9 127.0 19.9 94.1 43.6 139 97 B V B -A 145 0A 72 -2,-0.5 6,-0.2 6,-0.2 5,-0.1 -0.801 11.6-137.6 -95.8 116.7 16.9 92.8 41.6 140 98 B N - 0 0 44 4,-2.8 -1,-0.0 -2,-0.7 6,-0.0 -0.027 31.2-101.4 -55.7 172.5 13.8 95.0 41.7 141 99 B E S S+ 0 0 173 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.840 120.3 45.8 -72.6 -34.2 10.4 93.2 42.2 142 100 B D S S- 0 0 101 2,-0.1 -1,-0.2 1,-0.0 -47,-0.2 0.830 126.8 -92.2 -76.9 -34.6 9.4 93.4 38.5 143 101 B G S S+ 0 0 0 1,-0.3 -3,-0.1 -49,-0.1 -53,-0.1 0.001 79.1 141.9 139.5 -25.6 12.8 92.2 37.2 144 102 B L - 0 0 67 -5,-0.1 -4,-2.8 1,-0.1 2,-0.8 -0.160 57.9-121.9 -42.0 127.4 14.3 95.7 36.7 145 103 B L B > -A 139 0A 3 -57,-0.4 3,-1.7 -55,-0.3 4,-0.3 -0.726 23.2-146.5 -79.2 113.5 18.0 95.5 37.7 146 104 B E G > S+ 0 0 87 -8,-2.5 3,-2.1 -2,-0.8 4,-0.2 0.875 88.9 58.3 -51.3 -54.2 18.1 98.1 40.5 147 105 B G G 3 S+ 0 0 28 -9,-0.4 -1,-0.3 1,-0.3 -8,-0.1 0.394 109.3 48.0 -62.1 6.4 21.6 99.5 40.0 148 106 B L G X S+ 0 0 14 -3,-1.7 3,-1.2 2,-0.1 -1,-0.3 0.417 73.6 108.4-124.7 -5.3 20.8 100.5 36.4 149 107 B D T < S+ 0 0 106 -3,-2.1 -2,-0.1 -4,-0.3 -3,-0.1 0.728 76.8 55.8 -52.2 -32.1 17.4 102.2 36.8 150 108 B E T 3 S+ 0 0 72 -4,-0.2 -1,-0.3 2,-0.0 -2,-0.1 0.855 98.4 72.4 -72.3 -36.9 18.9 105.7 36.1 151 109 B L < 0 0 28 -3,-1.2 -3,-0.1 1,-0.1 107,-0.0 -0.335 360.0 360.0 -75.3 159.1 20.3 104.7 32.7 152 110 B P 0 0 151 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.581 360.0 360.0 -63.8 360.0 18.2 104.1 29.6 153 !* 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 0.0 154 15 C P 0 0 69 0, 0.0 70,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 110.5 44.5 109.0 29.5 155 16 C P - 0 0 105 0, 0.0 66,-0.0 0, 0.0 0, 0.0 -0.111 360.0 -64.3 -59.2 167.5 45.9 107.5 32.7 156 17 C P - 0 0 44 0, 0.0 90,-0.0 0, 0.0 4,-0.0 -0.352 68.2 -98.7 -59.2 135.8 43.7 107.7 35.8 157 18 C P > - 0 0 6 0, 0.0 3,-1.4 0, 0.0 4,-0.2 -0.119 26.4-117.2 -51.2 151.3 43.3 111.4 36.7 158 19 C P G > S+ 0 0 98 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.804 106.6 78.4 -60.2 -32.1 45.5 112.7 39.5 159 20 C Y G > S+ 0 0 28 1,-0.3 3,-1.7 2,-0.2 4,-0.2 0.642 70.6 82.6 -52.2 -17.6 42.4 113.4 41.7 160 21 C V G X S+ 0 0 15 -3,-1.4 3,-2.4 1,-0.3 -1,-0.3 0.880 76.5 73.4 -58.9 -35.4 42.3 109.7 42.5 161 22 C K G < S+ 0 0 153 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.747 93.3 51.9 -44.9 -36.0 44.8 110.5 45.2 162 23 C F G < S+ 0 0 52 -3,-1.7 2,-1.5 -4,-0.2 -1,-0.3 0.447 79.7 99.4 -84.7 -2.5 42.2 112.2 47.3 163 24 C F < + 0 0 2 -3,-2.4 85,-0.2 -4,-0.2 -1,-0.2 -0.294 50.9 147.5 -90.9 57.4 39.6 109.4 47.4 164 25 C T > - 0 0 44 -2,-1.5 4,-3.3 1,-0.1 5,-0.2 -0.463 61.9-118.6 -87.4 157.0 40.4 107.9 50.8 165 26 C Q H > S+ 0 0 101 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.883 117.9 57.1 -60.2 -37.1 37.9 106.2 53.2 166 27 C S H >> S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 3,-0.7 0.992 111.1 38.1 -49.1 -74.9 39.0 109.0 55.5 167 28 C N H 3> S+ 0 0 22 1,-0.3 4,-0.7 2,-0.2 -2,-0.2 0.873 112.7 58.5 -47.6 -47.7 38.0 111.8 53.2 168 29 C L H >< S+ 0 0 54 -4,-3.3 3,-1.0 1,-0.2 -1,-0.3 0.915 108.1 46.6 -49.7 -46.0 34.9 109.9 52.0 169 30 C E H << S+ 0 0 151 -4,-2.3 4,-0.5 -3,-0.7 -1,-0.2 0.912 110.2 52.4 -63.7 -42.8 33.7 109.8 55.6 170 31 C K H 3X S+ 0 0 114 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.526 93.3 84.2 -69.7 -4.9 34.5 113.5 56.1 171 32 C L H S+ 0 0 78 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.877 114.5 47.1 -51.7 -41.4 28.8 114.5 54.2 173 34 C K H > S+ 0 0 163 -4,-0.5 4,-1.9 1,-0.2 -2,-0.2 0.921 112.2 49.6 -64.4 -45.7 29.8 116.9 57.0 174 35 C Y H X S+ 0 0 52 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.865 109.1 54.8 -59.8 -38.8 31.9 119.0 54.6 175 36 C K H >X S+ 0 0 108 -4,-2.9 3,-0.8 2,-0.2 4,-0.8 0.977 110.5 40.3 -61.8 -59.8 29.0 119.1 52.1 176 37 C E H >< S+ 0 0 142 -4,-1.9 3,-0.9 1,-0.3 -1,-0.2 0.863 113.1 56.3 -61.3 -36.1 26.2 120.5 54.4 177 38 C K H 3< S+ 0 0 167 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.815 96.3 65.6 -62.3 -29.8 28.8 122.9 56.0 178 39 C K H << S+ 0 0 115 -4,-1.2 2,-3.5 -3,-0.8 -1,-0.3 0.802 76.4 89.9 -64.4 -27.2 29.4 124.2 52.5 179 40 C A << 0 0 91 -3,-0.9 -1,-0.2 -4,-0.8 -3,-0.1 -0.352 360.0 360.0 -65.6 64.7 25.8 125.4 52.6 180 41 C A 0 0 132 -2,-3.5 -2,-0.1 0, 0.0 -3,-0.0 -0.473 360.0 360.0-112.7 360.0 27.2 128.7 54.1 181 ! 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 60 C T 0 0 178 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -43.1 40.3 125.2 47.0 183 61 C C - 0 0 48 1,-0.1 3,-0.2 0, 0.0 4,-0.2 -0.793 360.0 -98.3-131.5-177.9 40.7 122.1 49.3 184 62 C A S > S+ 0 0 39 -2,-0.2 3,-3.0 1,-0.2 4,-0.3 0.979 114.9 54.7 -63.8 -61.1 40.9 118.3 49.0 185 63 C L G > S+ 0 0 18 1,-0.3 3,-1.8 2,-0.2 -1,-0.2 0.748 90.8 79.0 -48.3 -25.6 37.4 117.2 49.6 186 64 C D G > S+ 0 0 21 1,-0.3 3,-0.7 -3,-0.2 -1,-0.3 0.741 86.3 60.3 -55.3 -23.4 36.4 119.5 46.8 187 65 C Y G < S+ 0 0 77 -3,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.671 91.1 64.7 -81.7 -21.5 37.6 116.8 44.4 188 66 C L G < S+ 0 0 8 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.115 93.4 79.6 -83.9 21.0 35.1 114.2 45.7 189 67 C I S < S- 0 0 38 -3,-0.7 -1,-0.1 -14,-0.0 63,-0.0 -0.969 93.7-109.8-133.2 117.4 32.4 116.6 44.3 190 68 C P - 0 0 46 0, 0.0 -2,-0.1 0, 0.0 25,-0.1 -0.064 37.8-107.4 -49.1 138.8 31.6 116.6 40.6 191 69 C P - 0 0 2 0, 0.0 2,-0.0 0, 0.0 -4,-0.0 -0.242 39.1-100.9 -61.5 154.6 32.8 119.7 38.6 192 70 C P - 0 0 105 0, 0.0 23,-0.1 0, 0.0 3,-0.1 -0.338 42.3 -88.9 -73.4 158.4 30.1 122.1 37.4 193 71 C X - 0 0 62 1,-0.1 4,-0.1 2,-0.0 68,-0.0 -0.457 56.4-103.2 -61.2 139.1 28.8 122.3 33.9 194 72 C P - 0 0 46 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 -0.119 9.5-130.5 -62.2 159.7 31.1 124.6 31.8 195 73 C K S S+ 0 0 204 -3,-0.1 2,-0.3 2,-0.0 -2,-0.0 0.857 97.7 74.8 -72.9 -41.8 30.1 128.2 30.8 196 74 C N S S- 0 0 109 1,-0.1 2,-0.9 2,-0.0 3,-0.4 -0.595 78.6-149.6 -70.9 129.1 31.1 127.2 27.3 197 75 C Q + 0 0 173 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 -0.669 60.1 109.9-106.2 77.4 28.5 124.9 25.7 198 76 C Q + 0 0 115 -2,-0.9 -1,-0.2 66,-0.0 -2,-0.0 0.511 69.6 57.9-122.7 -15.5 30.4 122.7 23.4 199 77 C Y S S+ 0 0 63 -3,-0.4 2,-1.9 1,-0.1 3,-0.2 0.581 76.8 91.3 -99.8 -13.3 30.2 119.3 25.1 200 78 C R > + 0 0 76 1,-0.2 3,-0.7 2,-0.0 64,-0.2 -0.528 44.4 155.2 -83.0 74.3 26.4 119.0 25.3 201 79 C A T 3 S+ 0 0 64 -2,-1.9 -1,-0.2 1,-0.3 63,-0.2 0.632 70.4 44.6 -82.5 -12.3 26.1 117.1 22.0 202 80 C F T 3 S+ 0 0 141 61,-2.0 2,-0.3 -3,-0.2 -1,-0.3 -0.370 95.9 143.8-127.3 53.7 22.9 115.4 23.0 203 81 C G < 0 0 38 -3,-0.7 -3,-0.0 1,-0.2 0, 0.0 -0.966 360.0 360.0-144.4 156.3 20.8 118.2 24.6 204 82 C S 0 0 149 -2,-0.3 -1,-0.2 0, 0.0 -3,-0.0 -0.349 360.0 360.0-120.2 360.0 18.4 119.5 25.0 205 !* 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 0.0 206 17 D S 0 0 163 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 10.2 48.6 130.2 16.4 207 18 D D - 0 0 139 1,-0.1 2,-0.4 3,-0.0 0, 0.0 -0.011 360.0 -78.7 -97.6-163.1 48.5 129.7 20.2 208 19 D Q - 0 0 176 1,-0.1 -1,-0.1 -2,-0.0 0, 0.0 -0.812 45.1-103.0-104.0 139.6 48.9 126.9 22.7 209 20 D N - 0 0 155 -2,-0.4 -1,-0.1 1,-0.1 0, 0.0 -0.345 43.0-121.2 -52.6 133.1 46.2 124.3 23.6 210 21 D P - 0 0 113 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.275 33.6 -95.1 -74.0 171.0 44.7 125.3 26.9 211 22 D L - 0 0 154 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.585 46.4 -95.0 -86.4 149.0 45.0 122.8 29.7 212 23 D P - 0 0 71 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.161 35.0-127.9 -54.7 155.2 42.2 120.4 30.4 213 24 D T > - 0 0 73 1,-0.1 4,-2.9 -3,-0.1 5,-0.2 -0.616 27.2-107.8 -89.3 161.9 39.6 121.3 33.0 214 25 D R H > S+ 0 0 50 -2,-0.2 4,-2.2 2,-0.2 5,-0.2 0.919 126.8 49.6 -53.3 -43.0 38.7 118.9 35.8 215 26 D F H > S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.924 113.2 44.1 -60.8 -47.9 35.4 118.5 33.9 216 27 D E H > S+ 0 0 46 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.832 112.1 55.0 -65.8 -29.4 37.3 118.0 30.6 217 28 D V H X S+ 0 0 25 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.926 114.4 38.3 -70.3 -42.6 39.7 115.6 32.3 218 29 D E H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.865 112.2 57.4 -77.0 -36.7 36.9 113.4 33.7 219 30 D L H X S+ 0 0 12 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.905 112.8 41.6 -58.3 -43.4 34.8 113.7 30.6 220 31 D E H X S+ 0 0 111 -4,-1.8 4,-1.0 -5,-0.2 -2,-0.2 0.889 115.7 50.2 -70.8 -40.0 37.7 112.3 28.6 221 32 D F H X S+ 0 0 2 -4,-1.8 4,-0.6 1,-0.2 3,-0.3 0.893 108.1 48.6 -71.3 -42.3 38.6 109.7 31.1 222 33 D I H >< S+ 0 0 0 -4,-3.0 3,-1.1 1,-0.2 -1,-0.2 0.890 110.0 53.3 -67.7 -33.7 35.2 108.1 31.7 223 34 D Q H >< S+ 0 0 27 -4,-1.1 3,-1.4 -5,-0.3 -1,-0.2 0.746 95.8 67.6 -74.0 -20.9 34.7 107.8 28.0 224 35 D S H >< S+ 0 0 20 -4,-1.0 3,-1.6 -3,-0.3 -1,-0.3 0.744 87.8 70.7 -61.0 -24.0 38.0 106.0 27.7 225 36 D L T << S+ 0 0 0 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.399 77.5 76.4 -75.9 3.0 36.2 103.2 29.6 226 37 D A T < S+ 0 0 25 -3,-1.4 2,-0.8 1,-0.1 -1,-0.3 0.584 79.0 85.7 -86.8 -10.2 34.1 102.5 26.6 227 38 D N <> - 0 0 84 -3,-1.6 4,-2.2 1,-0.1 3,-0.4 -0.820 68.0-160.3 -94.0 106.6 37.3 100.7 25.3 228 39 D I H > S+ 0 0 10 -2,-0.8 4,-2.2 1,-0.2 -1,-0.1 0.784 89.1 56.6 -57.7 -33.1 37.3 97.1 26.6 229 40 D Q H > S+ 0 0 62 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.926 110.0 45.7 -64.4 -44.3 41.1 96.7 26.0 230 41 D Y H > S+ 0 0 41 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.926 112.4 48.5 -65.6 -47.9 41.8 99.7 28.2 231 42 D V H X S+ 0 0 0 -4,-2.2 4,-2.6 -7,-0.2 -1,-0.2 0.888 113.1 50.5 -58.8 -39.6 39.4 98.7 31.0 232 43 D T H X S+ 0 0 28 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.930 106.2 53.8 -62.5 -47.1 41.0 95.3 30.9 233 44 D Y H < S+ 0 0 125 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.851 110.6 47.8 -58.7 -34.7 44.5 96.7 31.1 234 45 D L H >< S+ 0 0 3 -4,-2.0 3,-0.9 1,-0.2 -1,-0.2 0.949 108.9 52.9 -68.1 -49.3 43.4 98.6 34.2 235 46 D L H 3< S+ 0 0 3 -4,-2.6 57,-0.5 1,-0.3 2,-0.3 0.784 106.0 55.4 -58.8 -29.2 41.8 95.5 35.7 236 47 D T T 3< S+ 0 0 77 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.3 -0.340 86.6 122.0 -99.2 49.9 45.1 93.6 35.2 237 48 D Q < - 0 0 28 -3,-0.9 55,-0.2 -2,-0.3 4,-0.2 -0.856 52.5-152.7-112.3 148.8 47.1 96.2 37.1 238 49 D Q S > S+ 0 0 97 -2,-0.3 3,-0.7 53,-0.1 4,-0.3 0.970 85.1 33.9 -80.8 -61.9 49.2 95.6 40.2 239 50 D Q G >> S+ 0 0 119 1,-0.2 3,-2.3 2,-0.2 4,-0.6 0.884 102.0 65.7 -68.5 -48.2 49.2 98.9 42.1 240 51 D I G 34 S+ 0 0 39 1,-0.3 6,-0.5 2,-0.2 7,-0.4 0.574 101.3 50.4 -64.4 -10.8 45.8 100.5 41.7 241 52 D W G <4 S+ 0 0 17 -3,-0.7 -1,-0.3 49,-0.3 -2,-0.2 0.508 86.7 82.4-104.7 -5.6 43.8 97.9 43.5 242 53 D K T <4 S+ 0 0 127 -3,-2.3 -2,-0.2 -4,-0.3 -1,-0.1 0.885 100.6 40.6 -56.2 -40.1 46.0 97.8 46.6 243 54 D S S X S- 0 0 51 -4,-0.6 4,-0.5 47,-0.1 3,-0.4 -0.830 81.7-127.1-116.2 153.2 44.0 100.9 47.8 244 55 D P H > S+ 0 0 49 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.472 86.6 98.4 -75.8 -4.7 40.3 101.8 47.6 245 56 D N H > S+ 0 0 35 2,-0.2 4,-2.3 1,-0.2 3,-0.4 0.956 87.6 35.1 -41.9 -72.5 41.2 105.1 45.9 246 57 D F H > S+ 0 0 4 -6,-0.5 4,-2.8 -3,-0.4 5,-0.2 0.884 116.2 55.2 -57.2 -44.2 40.6 104.0 42.3 247 58 D K H X S+ 0 0 88 -4,-0.5 4,-1.1 -7,-0.4 -1,-0.3 0.892 112.4 45.3 -53.9 -38.6 37.7 101.8 43.3 248 59 D N H X S+ 0 0 23 -4,-2.5 4,-2.0 -3,-0.4 -2,-0.2 0.839 109.3 53.8 -77.2 -34.5 36.2 104.9 45.0 249 60 D Y H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.937 105.4 54.6 -62.8 -45.8 37.0 107.2 42.0 250 61 D L H < S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.863 109.6 47.1 -58.0 -36.6 35.1 104.9 39.7 251 62 D K H >< S+ 0 0 103 -4,-1.1 3,-1.4 -5,-0.2 -1,-0.2 0.880 108.7 54.6 -73.1 -37.9 32.0 105.1 41.9 252 63 D Y H >< S+ 0 0 28 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.844 97.6 67.8 -57.4 -36.0 32.3 108.9 42.1 253 64 D L G >< S+ 0 0 0 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.502 71.3 89.9 -70.4 -5.7 32.3 108.9 38.3 254 65 D E G X + 0 0 23 -3,-1.4 3,-1.2 1,-0.3 -1,-0.3 0.444 61.5 89.0 -73.1 4.6 28.7 107.8 38.1 255 66 D Y G X S+ 0 0 21 -3,-1.1 3,-1.3 1,-0.3 7,-0.3 0.791 78.4 64.7 -68.0 -24.5 27.7 111.4 38.1 256 67 D W G < S+ 0 0 0 -3,-1.6 -1,-0.3 1,-0.2 9,-0.2 0.682 85.6 73.5 -67.8 -18.4 28.1 111.2 34.4 257 68 D C G < S+ 0 0 5 -3,-1.2 -1,-0.2 -4,-0.1 -2,-0.2 0.574 96.2 55.6 -73.6 -10.1 25.1 108.7 34.4 258 69 D N S <> S- 0 0 59 -3,-1.3 4,-2.8 -4,-0.2 3,-0.4 -0.819 92.3 -51.4-122.1 161.2 22.7 111.6 35.1 259 70 D P T 4 S+ 0 0 87 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.396 111.6 17.2 -73.2 154.9 21.7 114.9 33.5 260 71 D P T >4 S+ 0 0 41 0, 0.0 3,-0.6 0, 0.0 4,-0.1 -0.988 130.3 49.7 -82.6 -1.5 23.0 117.2 32.5 261 72 D Y G >4 S+ 0 0 39 -3,-0.4 3,-2.9 -6,-0.3 4,-0.4 0.936 104.9 57.0 -59.3 -50.8 26.2 115.3 32.6 262 73 D S G >< S+ 0 0 31 -4,-2.8 3,-1.5 -7,-0.3 -1,-0.2 0.800 96.4 65.5 -51.2 -33.1 24.9 112.3 30.6 263 74 D Q G < S+ 0 0 48 -3,-0.6 -61,-2.0 1,-0.3 -1,-0.3 0.486 96.9 57.3 -72.3 1.0 23.9 114.6 27.8 264 75 D C G < S+ 0 0 2 -3,-2.9 2,-0.7 -64,-0.2 -1,-0.3 0.509 80.9 103.9-104.5 -10.7 27.6 115.3 27.3 265 76 D I < + 0 0 5 -3,-1.5 -46,-0.0 -4,-0.4 -65,-0.0 -0.670 40.9 176.8 -79.8 115.4 28.6 111.7 26.7 266 77 D V S S+ 0 0 68 -2,-0.7 -1,-0.2 1,-0.2 -4,-0.0 0.803 81.2 46.2 -80.8 -36.1 29.2 110.9 23.1 267 78 D Y > + 0 0 151 1,-0.1 3,-1.6 2,-0.0 -1,-0.2 -0.673 68.7 175.6-111.5 77.5 30.2 107.3 23.7 268 79 D P T >> + 0 0 75 0, 0.0 3,-1.1 0, 0.0 4,-0.8 0.490 63.8 84.0 -66.8 -9.1 27.6 106.1 26.2 269 80 D N H >> S+ 0 0 45 1,-0.3 4,-2.4 2,-0.2 3,-1.4 0.914 81.9 66.0 -58.7 -39.3 28.9 102.5 26.2 270 81 D C H <> S+ 0 0 0 -3,-1.6 4,-2.3 1,-0.3 -1,-0.3 0.780 95.0 56.5 -49.6 -33.0 31.3 103.8 28.9 271 82 D L H <> S+ 0 0 14 -3,-1.1 4,-1.5 -4,-0.2 -1,-0.3 0.830 108.5 47.3 -70.7 -31.1 28.3 104.4 31.2 272 83 D F H X S+ 0 0 5 -4,-2.2 4,-0.9 1,-0.2 3,-0.7 0.883 109.6 57.2 -63.6 -39.1 29.1 96.5 40.8 280 91 D F H 3< S+ 0 0 18 -4,-3.1 4,-0.3 1,-0.2 -1,-0.2 0.778 105.0 53.2 -60.3 -25.9 31.8 94.0 40.1 281 92 D X H 3< S+ 0 0 10 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.682 93.7 69.1 -85.9 -20.0 34.0 95.8 42.6 282 93 D E H << S+ 0 0 106 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.891 117.9 22.3 -61.3 -39.0 31.4 95.7 45.4 283 94 D S S < S+ 0 0 38 -4,-0.9 -1,-0.2 -151,-0.1 -2,-0.2 0.304 95.4 122.1-113.3 4.1 31.9 91.9 45.7 284 95 D A - 0 0 33 -4,-0.3 2,-0.4 -5,-0.1 10,-0.1 -0.468 52.7-142.1 -72.4 141.8 35.4 91.6 44.1 285 96 D I - 0 0 114 8,-0.4 8,-1.6 -2,-0.2 2,-0.5 -0.900 13.6-164.8-108.8 132.6 38.1 90.0 46.3 286 97 D V B -B 292 0B 65 -2,-0.4 6,-0.2 6,-0.2 -2,-0.0 -0.962 11.0-139.7-123.6 122.7 41.7 91.2 46.2 287 98 D N > - 0 0 87 4,-1.1 3,-0.8 -2,-0.5 6,-0.0 -0.033 34.7-102.0 -64.2 174.4 44.7 89.4 47.5 288 99 D E T 3 S+ 0 0 185 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.857 122.3 71.1 -63.1 -35.4 47.5 91.1 49.4 289 100 D D T 3 S- 0 0 106 1,-0.1 -1,-0.2 2,-0.1 -47,-0.1 0.794 111.8-124.6 -50.6 -29.9 49.4 90.8 46.1 290 101 D G < + 0 0 0 -3,-0.8 -49,-0.3 1,-0.3 2,-0.2 0.436 66.0 131.3 97.4 2.0 46.9 93.5 44.9 291 102 D L - 0 0 79 -50,-0.1 -4,-1.1 -55,-0.1 2,-0.8 -0.527 65.4-108.6 -87.7 154.0 45.6 91.4 41.9 292 103 D L B > -B 286 0B 10 -57,-0.5 3,-1.5 -55,-0.2 -6,-0.2 -0.735 33.5-138.6 -82.9 109.2 42.0 90.9 41.1 293 104 D E T 3 S+ 0 0 94 -8,-1.6 -8,-0.4 -2,-0.8 3,-0.0 -0.474 88.2 37.1 -66.4 137.4 41.2 87.3 41.9 294 105 D G T 3 S+ 0 0 33 -2,-0.2 2,-1.1 -10,-0.1 -1,-0.2 -0.030 92.3 93.6 107.3 -27.5 39.0 85.7 39.2 295 106 D L < + 0 0 26 -3,-1.5 -3,-0.1 1,-0.1 -170,-0.0 -0.574 40.7 132.1 -97.7 69.5 40.7 87.6 36.4 296 107 D D + 0 0 138 -2,-1.1 2,-0.2 -3,-0.0 -1,-0.1 -0.308 43.2 104.1-115.0 45.3 43.2 84.9 35.5 297 108 D E - 0 0 50 1,-0.1 -186,-0.1 -186,-0.0 -187,-0.0 -0.597 57.2 -35.5-119.7-179.3 42.7 85.0 31.7 298 109 D L 0 0 158 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 -0.329 360.0 360.0 -96.9 174.2 44.5 86.4 28.7 299 110 D P 0 0 121 0, 0.0 -1,-0.3 0, 0.0 -2,-0.0 -0.635 360.0 360.0 -88.8 360.0 46.2 88.2 27.0