==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 23-MAR-05 1X0J . COMPND 2 MOLECULE: BROMODOMAIN-CONTAINING PROTEIN 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.NAKAMURA,T.UMEHARA,M.SHIROUZU,B.PADMANABHAN,S.YOKOYAMA, . 333 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18016.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 70.0 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 . 6 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 48.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 4.5 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 5 0 0 3 3 3 0 0 0 0 0 0 0 2 4 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 73 A G 0 0 78 0, 0.0 2,-0.3 0, 0.0 63,-0.2 0.000 360.0 360.0 360.0 126.7 22.6 42.3 9.8 2 74 A R - 0 0 62 61,-1.2 2,-0.5 59,-0.4 61,-0.2 -0.997 360.0-142.5-160.5 148.8 24.3 39.6 7.8 3 75 A V + 0 0 66 -2,-0.3 2,-0.3 111,-0.1 61,-0.1 -0.983 34.4 167.8-111.7 120.1 24.3 36.1 6.1 4 76 A T > - 0 0 0 -2,-0.5 4,-2.1 110,-0.2 110,-0.2 -0.794 49.5-107.5-121.8 169.7 27.6 34.2 6.4 5 77 A N H > S+ 0 0 26 108,-1.7 4,-1.7 -2,-0.3 5,-0.1 0.849 120.7 48.6 -61.8 -35.1 28.7 30.6 5.7 6 78 A Q H > S+ 0 0 4 2,-0.2 4,-2.8 107,-0.2 5,-0.2 0.883 109.2 51.1 -76.5 -38.1 29.1 30.0 9.5 7 79 A L H > S+ 0 0 10 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.917 110.1 50.6 -64.0 -43.2 25.7 31.5 10.3 8 80 A Q H X S+ 0 0 113 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.883 110.5 49.7 -53.2 -45.4 24.1 29.2 7.6 9 81 A Y H X>S+ 0 0 35 -4,-1.7 4,-2.2 2,-0.2 5,-2.1 0.920 109.8 50.5 -60.0 -46.5 25.9 26.2 9.2 10 82 A L H <>S+ 0 0 0 -4,-2.8 5,-2.8 3,-0.2 -2,-0.2 0.876 119.1 39.4 -57.5 -36.4 24.6 27.2 12.7 11 83 A H H <>S+ 0 0 34 -4,-2.0 5,-0.6 -5,-0.2 -2,-0.2 0.956 124.7 31.8 -79.6 -52.7 21.1 27.4 11.3 12 84 A K H <5S+ 0 0 124 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.747 134.1 20.8 -87.1 -21.5 21.0 24.5 8.9 13 85 A V T X5S+ 0 0 60 -4,-2.2 4,-1.2 -5,-0.3 -3,-0.2 0.808 128.2 35.0-111.5 -50.5 23.3 22.0 10.6 14 86 A V H >< S+ 0 0 0 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.929 108.9 57.0 -61.9 -42.7 19.5 20.4 18.3 19 91 A W H 3< S+ 0 0 67 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.870 109.3 43.9 -57.9 -45.1 15.9 21.3 17.6 20 92 A K H 3< S+ 0 0 148 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.510 87.3 121.1 -79.7 -7.6 14.8 17.7 16.7 21 93 A H S X< S- 0 0 42 -3,-1.1 3,-2.1 -4,-0.6 4,-0.3 -0.257 72.3-124.1 -60.9 144.4 16.7 16.2 19.7 22 94 A Q T 3 S+ 0 0 150 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.697 112.4 50.1 -69.0 -15.9 14.6 14.2 22.1 23 95 A F T 3 S+ 0 0 64 1,-0.1 -1,-0.3 70,-0.1 4,-0.1 0.373 91.0 85.0 -97.7 10.2 15.8 16.4 25.0 24 96 A A X + 0 0 0 -3,-2.1 3,-2.4 1,-0.2 4,-0.5 0.678 56.9 92.2 -83.9 -20.3 15.0 19.7 23.1 25 97 A W G > S+ 0 0 160 -4,-0.3 3,-0.8 1,-0.3 4,-0.2 0.763 82.6 54.4 -56.0 -33.8 11.4 20.3 23.9 26 98 A P G 3 S+ 0 0 24 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.668 113.0 46.0 -66.5 -20.0 11.9 22.4 27.1 27 99 A F G < S+ 0 0 15 -3,-2.4 24,-2.7 1,-0.1 25,-0.4 0.376 84.2 87.7-105.4 -2.8 14.1 24.8 25.1 28 100 A R S < S+ 0 0 74 -3,-0.8 -1,-0.1 -4,-0.5 22,-0.1 0.576 98.4 22.9 -76.4 -16.0 12.2 25.4 21.8 29 101 A Q S S- 0 0 95 -4,-0.2 22,-0.2 -3,-0.2 3,-0.1 -0.965 103.8 -68.8-138.3 164.9 10.2 28.3 23.2 30 102 A P - 0 0 79 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.119 58.0 -97.3 -52.5 147.8 10.7 30.8 26.0 31 103 A V - 0 0 49 18,-0.1 2,-0.8 -4,-0.1 -4,-0.0 -0.557 35.2-147.5 -62.2 126.7 10.4 29.5 29.6 32 104 A D > - 0 0 81 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 -0.889 15.0-174.1-108.3 94.8 6.8 30.3 30.7 33 105 A A H >>S+ 0 0 15 -2,-0.8 5,-3.0 2,-0.2 4,-0.8 0.795 79.7 53.5 -67.8 -32.1 7.3 31.0 34.4 34 106 A V H >45S+ 0 0 134 3,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.993 112.3 43.1 -61.4 -64.4 3.5 31.3 35.0 35 107 A K H 345S+ 0 0 170 1,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.921 118.3 44.6 -41.2 -55.4 2.6 27.9 33.4 36 108 A L H 3<5S- 0 0 106 -4,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.607 111.5-119.2 -78.7 -11.0 5.5 26.1 35.0 37 109 A G T <<5 + 0 0 53 -3,-1.1 -3,-0.2 -4,-0.8 -4,-0.1 0.945 65.3 139.3 74.0 55.0 4.9 27.6 38.4 38 110 A L > < + 0 0 40 -5,-3.0 3,-1.3 1,-0.1 4,-0.4 -0.774 17.3 168.3-133.6 73.5 8.3 29.4 38.7 39 111 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.658 79.6 49.2 -72.5 -13.6 7.6 32.9 40.3 40 112 A D T >> S+ 0 0 66 1,-0.1 4,-1.2 2,-0.1 3,-0.9 0.442 81.8 98.5 -96.9 0.8 11.2 33.5 41.0 41 113 A Y H X> S+ 0 0 12 -3,-1.3 4,-2.9 1,-0.3 3,-1.0 0.943 87.4 41.9 -57.6 -52.9 12.5 32.6 37.4 42 114 A H H 34 S+ 0 0 93 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.582 108.8 59.8 -75.1 -3.7 12.7 36.2 36.1 43 115 A K H <4 S+ 0 0 159 -3,-0.9 -1,-0.2 -4,-0.1 -2,-0.2 0.727 117.1 32.1 -87.6 -24.1 14.2 37.4 39.4 44 116 A I H << S+ 0 0 57 -4,-1.2 2,-0.7 -3,-1.0 -2,-0.2 0.807 116.2 55.2 -97.8 -40.6 17.1 35.0 38.9 45 117 A I < + 0 0 4 -4,-2.9 -1,-0.2 -5,-0.2 34,-0.0 -0.868 57.6 176.9-102.4 114.5 17.5 34.9 35.1 46 118 A K S S+ 0 0 163 -2,-0.7 -1,-0.1 1,-0.3 -4,-0.1 0.634 75.1 43.2 -96.5 -16.3 17.9 38.4 33.7 47 119 A Q S S- 0 0 101 28,-0.1 -1,-0.3 2,-0.0 32,-0.1 -0.685 76.8-162.3-129.2 82.1 18.4 37.4 30.1 48 120 A P + 0 0 58 0, 0.0 2,-0.3 0, 0.0 28,-0.1 -0.244 15.2 179.6 -57.9 145.6 15.9 34.6 29.1 49 121 A X + 0 0 17 26,-0.1 2,-0.3 27,-0.1 -18,-0.1 -0.984 8.1 172.0-152.5 141.9 17.0 32.8 25.9 50 122 A D > - 0 0 8 -2,-0.3 4,-2.0 -22,-0.1 3,-0.2 -0.953 44.5-108.0-145.5 163.3 15.5 29.9 23.9 51 123 A X H > S+ 0 0 0 -24,-2.7 4,-2.9 -2,-0.3 5,-0.2 0.827 114.8 61.3 -65.1 -29.0 16.0 28.1 20.6 52 124 A G H > S+ 0 0 12 -25,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.911 107.1 44.7 -58.2 -48.0 12.9 29.6 19.1 53 125 A T H > S+ 0 0 19 -3,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.911 113.8 49.4 -64.0 -45.2 14.4 33.1 19.5 54 126 A I H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.916 110.9 49.8 -62.9 -47.9 17.8 32.0 18.2 55 127 A K H X S+ 0 0 58 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.950 111.0 49.3 -57.1 -44.9 16.2 30.3 15.1 56 128 A R H X S+ 0 0 129 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.906 109.0 52.5 -62.6 -41.4 14.2 33.4 14.4 57 129 A R H <>S+ 0 0 59 -4,-2.3 5,-2.4 1,-0.2 6,-0.5 0.899 109.0 50.1 -57.7 -43.5 17.2 35.6 14.7 58 130 A L H ><5S+ 0 0 15 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.879 110.3 50.2 -63.2 -36.6 19.0 33.4 12.3 59 131 A E H 3<5S+ 0 0 99 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.713 113.5 46.2 -74.8 -20.4 16.1 33.6 9.8 60 132 A N T 3<5S- 0 0 113 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.215 111.0-114.1-107.6 12.9 15.9 37.5 10.0 61 133 A N T < 5 + 0 0 69 -3,-0.8 -59,-0.4 -4,-0.2 -3,-0.2 0.847 65.9 146.2 54.1 39.4 19.6 38.2 9.6 62 134 A Y < + 0 0 130 -5,-2.4 2,-0.2 -61,-0.2 -4,-0.1 0.860 50.1 74.9 -69.9 -38.9 19.8 39.5 13.2 63 135 A Y - 0 0 3 -6,-0.5 -61,-1.2 -61,-0.2 3,-0.1 -0.555 54.5-170.2 -82.2 142.1 23.3 38.2 13.7 64 136 A W S S+ 0 0 140 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.755 77.7 19.1 -92.5 -32.3 26.4 39.9 12.2 65 137 A A S >> S- 0 0 19 1,-0.1 3,-1.0 -59,-0.1 4,-0.9 -0.959 74.8-117.8-140.0 157.5 28.8 37.1 13.2 66 138 A A H >> S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.3 3,-0.6 0.856 110.7 65.8 -63.7 -36.3 28.6 33.4 14.2 67 139 A S H 3> S+ 0 0 16 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.836 96.6 56.4 -55.5 -33.2 30.1 34.3 17.6 68 140 A E H <> S+ 0 0 76 -3,-1.0 4,-1.4 2,-0.2 -1,-0.3 0.865 109.2 44.9 -68.2 -34.8 27.0 36.3 18.4 69 141 A C H - 0 0 139 1,-0.1 3,-1.9 2,-0.0 6,-0.3 -0.561 35.5-114.0 -71.1 148.4 18.8 22.5 41.1 86 158 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.817 116.4 52.7 -53.1 -31.3 21.9 20.3 40.3 87 159 A T T 3 S+ 0 0 119 4,-0.1 2,-0.1 3,-0.0 5,-0.0 0.455 80.8 117.1 -89.4 -1.1 19.6 17.2 40.5 88 160 A D X> - 0 0 44 -3,-1.9 3,-1.2 1,-0.1 4,-0.9 -0.406 68.1-132.6 -70.7 137.1 17.0 18.5 38.1 89 161 A D H 3> S+ 0 0 118 1,-0.2 4,-1.8 2,-0.2 3,-0.3 0.799 103.9 67.6 -54.2 -34.7 16.6 16.4 34.9 90 162 A I H 3> S+ 0 0 41 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.849 93.1 57.8 -60.2 -30.0 16.6 19.6 32.9 91 163 A V H <> S+ 0 0 2 -3,-1.2 4,-2.3 -6,-0.3 -1,-0.2 0.906 106.7 48.3 -66.4 -43.5 20.2 20.1 33.8 92 164 A L H X S+ 0 0 97 -4,-0.9 4,-1.8 -3,-0.3 -1,-0.2 0.868 110.6 51.3 -62.2 -39.3 21.2 16.7 32.3 93 165 A X H X S+ 0 0 28 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.949 110.2 48.8 -64.4 -46.5 19.2 17.5 29.1 94 166 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.912 110.8 51.0 -58.9 -44.6 21.0 20.9 28.7 95 167 A Q H X S+ 0 0 49 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.922 109.6 49.3 -61.4 -39.7 24.4 19.2 29.2 96 168 A T H X S+ 0 0 52 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.920 114.8 45.0 -67.6 -41.4 23.7 16.6 26.6 97 169 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.914 110.4 54.6 -69.9 -36.4 22.5 19.3 24.1 98 170 A E H X S+ 0 0 2 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.861 103.3 55.7 -68.2 -36.9 25.5 21.5 24.9 99 171 A K H X S+ 0 0 78 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.903 109.0 47.1 -60.2 -42.0 27.9 18.7 24.1 100 172 A I H X S+ 0 0 35 -4,-1.4 4,-3.3 2,-0.2 5,-0.3 0.930 109.4 54.6 -61.3 -45.5 26.4 18.4 20.7 101 173 A F H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.961 111.7 43.3 -55.3 -47.2 26.6 22.1 20.2 102 174 A L H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.894 112.1 53.3 -70.0 -34.7 30.3 22.1 21.0 103 175 A Q H < S+ 0 0 106 -4,-2.2 4,-0.3 2,-0.2 -1,-0.2 0.935 112.3 45.2 -62.6 -45.3 31.0 19.1 18.9 104 176 A K H >< S+ 0 0 74 -4,-3.3 3,-1.5 1,-0.2 -2,-0.2 0.889 108.4 56.1 -70.8 -34.1 29.3 20.7 15.9 105 177 A V H >< S+ 0 0 2 -4,-2.6 3,-1.6 -5,-0.3 -1,-0.2 0.872 98.5 62.8 -63.1 -34.6 31.1 24.1 16.5 106 178 A A T 3< S+ 0 0 6 -4,-1.8 120,-0.3 1,-0.3 -1,-0.3 0.631 106.9 44.3 -64.9 -13.2 34.4 22.3 16.2 107 179 A S T < S+ 0 0 52 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.169 82.4 131.9-112.0 15.4 33.4 21.3 12.6 108 180 A X < - 0 0 3 -3,-1.6 -102,-0.1 1,-0.1 -3,-0.1 -0.480 67.5-102.7 -73.0 138.6 32.2 24.7 11.6 109 181 A P - 0 0 34 0, 0.0 2,-0.3 0, 0.0 3,-0.2 -0.265 27.7-145.5 -62.1 141.6 33.6 26.0 8.2 110 182 A Q S S+ 0 0 17 1,-0.2 115,-0.1 2,-0.1 -2,-0.0 -0.414 73.3 94.9-114.5 57.9 36.3 28.5 8.7 111 183 A E - 0 0 84 -2,-0.3 -106,-0.2 2,-0.1 -1,-0.2 -0.127 62.3-163.1-123.5 39.4 35.9 30.9 5.9 112 184 A E + 0 0 44 -3,-0.2 2,-0.3 -108,-0.1 -2,-0.1 0.161 39.2 150.2 -39.4 93.8 33.8 33.3 8.0 113 185 A Q 0 0 111 1,-0.1 -108,-1.7 0, 0.0 -107,-0.2 -0.947 360.0 360.0-143.5 155.4 32.5 35.0 4.8 114 186 A E 0 0 150 -2,-0.3 -110,-0.2 -110,-0.2 -111,-0.1 -0.345 360.0 360.0 112.5 360.0 29.8 37.0 3.0 115 !* 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 0.0 116 73 B G 0 0 81 0, 0.0 147,-0.1 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 115.9 53.7 14.0 18.0 117 74 B R - 0 0 154 145,-0.1 146,-0.0 1,-0.0 143,-0.0 0.664 360.0-142.5 -72.5 -38.0 52.5 16.5 15.3 118 75 B V - 0 0 37 58,-0.1 61,-0.1 144,-0.0 5,-0.0 0.849 17.9-104.4 77.0 119.4 49.5 18.4 16.9 119 76 B T > - 0 0 62 1,-0.1 4,-2.2 60,-0.1 5,-0.2 -0.244 26.8-116.2 -65.7 156.0 46.4 19.4 15.0 120 77 B N H > S+ 0 0 31 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.869 117.5 55.6 -59.7 -36.2 46.0 23.0 14.0 121 78 B Q H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.920 108.8 45.3 -65.4 -42.2 42.9 23.0 16.2 122 79 B L H > S+ 0 0 15 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.874 111.6 52.5 -67.5 -33.0 44.8 21.8 19.2 123 80 B Q H X S+ 0 0 23 -4,-2.2 4,-3.0 1,-0.2 5,-0.2 0.902 109.6 50.1 -66.7 -44.3 47.6 24.3 18.6 124 81 B Y H X>S+ 0 0 9 -4,-2.2 4,-2.6 2,-0.2 5,-1.7 0.902 107.4 52.8 -61.6 -44.9 45.0 27.0 18.5 125 82 B L H <>S+ 0 0 0 -4,-2.3 5,-3.1 3,-0.2 6,-0.2 0.847 117.3 40.0 -60.8 -34.3 43.4 26.0 21.8 126 83 B H H <>S+ 0 0 58 -4,-1.7 5,-1.0 3,-0.2 -2,-0.2 0.949 123.3 35.5 -76.4 -48.3 46.8 26.1 23.4 127 84 B K H <5S+ 0 0 37 -4,-3.0 -2,-0.2 3,-0.2 -3,-0.2 0.653 134.2 18.8 -86.3 -26.5 48.3 29.2 21.8 128 85 B V T X5S+ 0 0 11 -4,-2.6 4,-1.8 -5,-0.2 -3,-0.2 0.724 129.4 36.2-108.8 -56.3 45.2 31.4 21.5 129 86 B V H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.2 -2,-0.2 0.922 105.9 57.9 -74.2 -39.1 42.3 32.6 29.7 134 91 B W H 3< S+ 0 0 83 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.822 113.7 38.1 -61.4 -38.4 45.3 31.6 31.8 135 92 B K H 3< S+ 0 0 160 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.432 87.1 121.3 -92.3 -3.8 46.5 35.2 32.2 136 93 B H S X< S- 0 0 43 -3,-1.0 3,-1.8 -4,-0.6 4,-0.3 -0.285 72.1-121.7 -58.6 148.9 43.1 36.8 32.5 137 94 B Q T 3 S+ 0 0 157 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.721 112.3 50.2 -68.3 -18.1 42.5 38.7 35.8 138 95 B F T 3 S+ 0 0 63 1,-0.2 -1,-0.3 70,-0.1 4,-0.1 0.394 89.8 86.5 -96.2 3.3 39.4 36.5 36.6 139 96 B A X + 0 0 0 -3,-1.8 3,-2.3 1,-0.2 4,-0.5 0.683 58.1 89.9 -78.4 -18.2 41.3 33.3 36.1 140 97 B W G > S+ 0 0 155 -3,-0.3 3,-1.0 -4,-0.3 4,-0.3 0.826 82.7 54.6 -61.3 -35.4 42.9 32.7 39.5 141 98 B P G 3 S+ 0 0 24 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.689 114.2 45.3 -63.8 -15.4 40.0 30.7 41.0 142 99 B F G < S+ 0 0 13 -3,-2.3 24,-2.9 1,-0.1 25,-0.5 0.344 85.5 88.9-109.2 -1.4 40.2 28.3 38.1 143 100 B R S < S+ 0 0 71 -3,-1.0 24,-0.2 -4,-0.5 -1,-0.1 0.684 95.9 24.9 -78.5 -18.2 43.9 27.7 37.7 144 101 B Q S S- 0 0 91 -4,-0.3 22,-0.2 -3,-0.1 3,-0.1 -0.929 103.1 -71.7-135.6 164.5 44.2 24.8 40.1 145 102 B P - 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0 0 2 -3,-1.3 -102,-0.1 1,-0.1 -3,-0.0 -0.481 65.2-102.7 -71.3 141.9 39.5 28.3 15.5 224 181 B P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 -116,-0.1 -0.073 42.8 -90.7 -61.1 164.8 40.9 26.7 12.3 225 182 B Q - 0 0 67 -115,-0.1 -104,-0.2 1,-0.1 -105,-0.2 -0.370 43.1-108.2 -69.4 154.5 39.1 23.7 10.5 226 183 B E 0 0 101 -120,-0.3 -1,-0.1 1,-0.2 -46,-0.0 -0.184 360.0 360.0 -68.9 173.2 40.0 20.2 11.4 227 184 B E 0 0 233 86,-0.0 -1,-0.2 -2,-0.0 -2,-0.0 0.902 360.0 360.0 48.4 360.0 41.9 17.8 9.1 228 !* 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 0.0 229 76 C T > 0 0 110 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 174.6 61.9 57.2 11.0 230 77 C N H > + 0 0 110 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.797 360.0 60.6 -62.0 -31.1 58.3 57.7 10.1 231 78 C Q H > S+ 0 0 36 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.952 105.8 42.9 -67.0 -47.5 58.7 54.4 8.1 232 79 C L H > S+ 0 0 31 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.872 114.6 53.2 -67.3 -30.7 59.6 52.2 11.1 233 80 C Q H X S+ 0 0 114 -4,-1.4 4,-3.1 1,-0.2 5,-0.3 0.890 108.5 48.1 -72.9 -36.4 56.8 54.0 13.0 234 81 C Y H X>S+ 0 0 38 -4,-2.2 4,-2.3 2,-0.2 5,-2.0 0.932 110.2 52.5 -65.3 -45.3 54.3 53.2 10.3 235 82 C L H <>S+ 0 0 0 -4,-2.8 5,-2.9 3,-0.2 -2,-0.2 0.872 119.8 35.7 -57.9 -32.5 55.5 49.5 10.3 236 83 C H H <>S+ 0 0 41 -4,-1.8 5,-1.0 3,-0.2 -2,-0.2 0.971 124.4 37.9 -83.6 -54.7 55.0 49.3 14.1 237 84 C K H <5S+ 0 0 133 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.631 134.8 14.4 -81.7 -18.0 51.9 51.5 14.5 238 85 C V T X5S+ 0 0 59 -4,-2.3 4,-1.9 -5,-0.3 -3,-0.2 0.701 128.1 39.3-123.2 -54.3 50.0 50.5 11.4 239 86 C V H >< S+ 0 0 1 -4,-2.9 3,-1.0 1,-0.2 -2,-0.2 0.924 106.4 56.6 -66.9 -44.3 48.9 42.0 11.4 244 91 C W H 3< S+ 0 0 78 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.884 112.2 42.2 -59.3 -37.7 49.2 41.1 15.1 245 92 C K H 3< S+ 0 0 154 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.530 84.9 116.2 -90.2 -4.1 45.5 41.1 15.8 246 93 C H S X< S- 0 0 47 -3,-1.0 3,-1.9 -4,-0.7 4,-0.3 -0.322 72.7-125.4 -63.1 144.6 44.4 39.3 12.6 247 94 C Q G > S+ 0 0 75 1,-0.3 3,-0.6 2,-0.2 -1,-0.1 0.787 110.4 55.1 -65.3 -23.5 42.7 35.9 13.3 248 95 C F G 3 S+ 0 0 52 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.466 86.7 83.8 -86.8 -3.0 45.2 34.2 11.0 249 96 C A G X> + 0 0 0 -3,-1.9 3,-2.5 1,-0.2 4,-0.7 0.657 61.8 95.4 -68.8 -19.3 48.2 35.5 12.9 250 97 C W G X4 S+ 0 0 6 -3,-0.6 3,-0.6 1,-0.3 4,-0.3 0.774 79.9 49.3 -55.7 -40.1 48.2 32.8 15.5 251 98 C P G 34 S+ 0 0 16 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.661 116.3 47.5 -66.0 -13.6 50.7 30.4 14.1 252 99 C F G <4 S+ 0 0 11 -3,-2.5 24,-2.6 1,-0.1 25,-0.6 0.483 84.3 86.9-107.1 -7.6 53.1 33.4 13.6 253 100 C R S << S+ 0 0 55 -4,-0.7 -1,-0.1 -3,-0.6 -3,-0.1 0.663 97.0 26.3 -74.4 -15.4 52.9 35.1 17.0 254 101 C Q S S- 0 0 41 -4,-0.3 22,-0.2 -3,-0.1 20,-0.1 -0.918 98.5 -78.0-143.3 156.2 55.7 33.0 18.7 255 102 C P - 0 0 83 0, 0.0 2,-0.4 0, 0.0 20,-0.1 -0.286 54.6 -98.9 -56.1 145.3 58.7 31.1 17.5 256 103 C V - 0 0 48 18,-0.1 2,-1.1 1,-0.1 3,-0.1 -0.519 32.3-149.8 -64.7 118.6 58.1 27.7 16.0 257 104 C D > - 0 0 71 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 -0.785 14.6-174.8 -93.2 94.1 58.7 25.2 18.9 258 105 C A T 4>S+ 0 0 11 -2,-1.1 5,-2.8 1,-0.2 4,-0.4 0.839 78.9 49.6 -63.3 -33.4 59.9 22.2 16.8 259 106 C V T >45S+ 0 0 119 3,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.975 114.1 43.3 -70.0 -49.1 60.2 19.9 19.8 260 107 C K T 345S+ 0 0 135 1,-0.3 -2,-0.2 2,-0.1 -1,-0.2 0.838 118.3 44.5 -68.2 -31.7 56.7 20.6 21.2 261 108 C L T 3<5S- 0 0 20 -4,-2.3 -1,-0.3 2,-0.1 -2,-0.2 0.458 112.8-120.7 -92.8 -2.1 55.1 20.5 17.7 262 109 C G T < 5 + 0 0 17 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.893 64.6 140.9 68.8 41.3 57.0 17.4 16.9 263 110 C L > < + 0 0 14 -5,-2.8 3,-2.1 -6,-0.2 4,-0.4 -0.630 17.7 170.3-115.1 68.4 58.9 18.8 13.8 264 111 C P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.647 78.6 48.6 -58.2 -19.5 62.4 17.2 14.1 265 112 C D T >> S+ 0 0 60 1,-0.1 4,-2.1 2,-0.1 3,-1.0 0.529 82.2 98.9 -95.9 -2.9 63.4 18.4 10.7 266 113 C Y H <> S+ 0 0 13 -3,-2.1 4,-3.3 1,-0.3 3,-0.3 0.897 88.1 40.0 -45.4 -56.2 62.2 22.0 11.0 267 114 C H H 34 S+ 0 0 91 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.610 110.1 59.7 -80.0 -12.8 65.6 23.5 11.9 268 115 C K H <4 S+ 0 0 158 -3,-1.0 -1,-0.2 -4,-0.1 -2,-0.2 0.855 118.1 31.4 -74.1 -33.2 67.4 21.3 9.3 269 116 C I H < S+ 0 0 77 -4,-2.1 2,-0.7 -3,-0.3 -2,-0.2 0.896 117.2 55.3 -91.8 -46.0 65.2 22.9 6.5 270 117 C I < + 0 0 5 -4,-3.3 -1,-0.2 -5,-0.3 34,-0.0 -0.844 58.9 179.0 -96.7 118.8 64.6 26.4 7.9 271 118 C K S S+ 0 0 153 -2,-0.7 -1,-0.1 1,-0.2 -4,-0.1 0.715 73.8 40.1 -89.9 -25.7 67.9 28.2 8.6 272 119 C Q S S- 0 0 136 28,-0.1 -1,-0.2 2,-0.0 32,-0.1 -0.770 76.0-160.2-127.0 84.0 66.7 31.5 9.8 273 120 C P + 0 0 60 0, 0.0 2,-0.3 0, 0.0 28,-0.1 -0.298 16.2 174.7 -59.4 145.1 63.6 31.2 12.0 274 121 C X + 0 0 35 26,-0.1 2,-0.3 27,-0.1 -18,-0.1 -0.979 7.7 175.2-154.4 144.0 61.5 34.4 12.4 275 122 C D > - 0 0 12 -2,-0.3 4,-1.9 -22,-0.1 -22,-0.2 -0.965 42.2-109.5-146.4 161.0 58.2 35.2 14.0 276 123 C X H > S+ 0 0 0 -24,-2.6 4,-2.9 -2,-0.3 -23,-0.2 0.767 112.5 64.3 -65.4 -31.3 56.0 38.2 14.7 277 124 C G H > S+ 0 0 19 -25,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.941 107.6 42.4 -54.7 -46.9 56.7 38.2 18.4 278 125 C T H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.887 113.9 49.6 -65.7 -46.2 60.3 38.9 17.6 279 126 C I H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.924 112.1 49.9 -59.6 -44.6 59.6 41.4 15.0 280 127 C K H X S+ 0 0 53 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.930 111.0 47.9 -61.6 -42.5 57.2 43.2 17.4 281 128 C R H X S+ 0 0 131 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.896 110.9 52.6 -67.2 -36.1 59.7 43.3 20.2 282 129 C R H <>S+ 0 0 52 -4,-2.3 5,-2.2 2,-0.2 6,-0.5 0.878 109.3 48.3 -64.7 -40.1 62.3 44.6 17.8 283 130 C L H ><5S+ 0 0 14 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.935 111.1 52.1 -65.1 -41.3 60.0 47.4 16.7 284 131 C E H 3<5S+ 0 0 96 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.760 114.4 41.9 -63.6 -29.2 59.3 48.2 20.4 285 132 C N T 3<5S- 0 0 109 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.194 111.1-114.3-109.2 13.0 63.0 48.4 21.3 286 133 C N T < 5 + 0 0 147 -3,-1.1 -3,-0.2 -4,-0.2 -4,-0.1 0.773 64.9 146.6 60.5 31.3 64.2 50.3 18.2 287 134 C Y < + 0 0 128 -5,-2.2 -4,-0.1 -6,-0.2 2,-0.1 0.877 38.3 92.8 -57.6 -44.8 66.2 47.4 17.0 288 135 C Y - 0 0 14 -6,-0.5 3,-0.1 1,-0.2 -56,-0.1 -0.375 55.1-162.6 -71.5 132.3 65.8 48.0 13.3 289 136 C W S S+ 0 0 232 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.779 78.8 1.5 -72.2 -33.5 68.4 50.1 11.5 290 137 C A S >> S- 0 0 35 1,-0.1 4,-1.0 -59,-0.0 3,-0.6 -0.971 72.9-107.0-153.9 161.6 66.0 50.7 8.6 291 138 C A H >> S+ 0 0 2 -2,-0.3 4,-2.2 1,-0.2 3,-0.5 0.876 115.3 61.4 -59.2 -37.4 62.5 49.9 7.3 292 139 C S H 3> S+ 0 0 74 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.825 98.9 56.3 -61.1 -35.3 63.9 47.4 4.8 293 140 C E H <> S+ 0 0 72 -3,-0.6 4,-1.3 2,-0.2 -1,-0.3 0.878 107.8 47.2 -66.4 -38.5 65.3 45.3 7.6 294 141 C C H - 0 0 142 1,-0.1 3,-1.3 2,-0.0 6,-0.3 -0.515 35.8-116.9 -69.5 145.7 52.7 21.2 2.9 311 158 C P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.839 113.2 51.2 -54.5 -30.8 51.0 23.1 0.1 312 159 C T T 3 S+ 0 0 126 4,-0.1 5,-0.0 3,-0.0 2,-0.0 0.560 78.4 113.8 -86.5 -11.7 47.6 22.1 1.4 313 160 C D S X> S- 0 0 30 -3,-1.3 3,-1.2 1,-0.2 4,-0.9 -0.376 70.8-131.9 -55.2 134.6 48.0 23.1 5.1 314 161 C D H 3> S+ 0 0 58 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.664 103.4 73.0 -64.8 -19.5 45.7 25.9 5.9 315 162 C I H 3> S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.857 92.5 56.6 -59.1 -36.0 48.7 27.7 7.5 316 163 C V H <> S+ 0 0 15 -3,-1.2 4,-2.4 -6,-0.3 -2,-0.2 0.940 107.3 47.5 -59.5 -46.0 50.0 28.3 4.0 317 164 C L H X S+ 0 0 90 -4,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.890 110.5 52.1 -63.4 -38.0 46.7 30.0 3.1 318 165 C X H X S+ 0 0 10 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.891 108.6 50.0 -65.3 -41.6 46.9 32.1 6.3 319 166 C A H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.917 110.0 51.4 -61.9 -44.2 50.4 33.2 5.4 320 167 C Q H X S+ 0 0 76 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.925 110.8 48.8 -58.9 -45.5 49.3 34.2 1.9 321 168 C T H X S+ 0 0 52 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.947 114.5 43.8 -58.6 -50.5 46.4 36.2 3.4 322 169 C L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.898 111.4 53.6 -62.1 -40.7 48.6 38.0 5.8 323 170 C E H X S+ 0 0 38 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.862 105.5 53.9 -65.0 -35.5 51.4 38.6 3.3 324 171 C K H X S+ 0 0 137 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.891 110.6 46.6 -65.7 -39.6 49.0 40.3 0.9 325 172 C I H X S+ 0 0 48 -4,-1.6 4,-2.5 -5,-0.2 5,-0.3 0.935 109.7 54.8 -66.8 -41.7 47.9 42.6 3.6 326 173 C F H X S+ 0 0 8 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.951 111.0 44.1 -54.8 -49.1 51.5 43.3 4.6 327 174 C L H X S+ 0 0 96 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.886 109.4 56.0 -66.5 -42.0 52.4 44.3 1.0 328 175 C Q H X S+ 0 0 140 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.944 112.7 43.0 -52.5 -45.5 49.2 46.4 0.6 329 176 C K H >< S+ 0 0 55 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.903 109.3 56.5 -71.5 -39.1 50.2 48.4 3.6 330 177 C V H >< S+ 0 0 22 -4,-2.5 3,-1.7 -5,-0.3 -1,-0.2 0.864 99.5 61.3 -57.3 -37.0 53.8 48.6 2.6 331 178 C A H 3< S+ 0 0 82 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.798 106.6 46.0 -63.2 -31.5 52.7 50.2 -0.6 332 179 C S T << S+ 0 0 88 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.108 82.6 132.7 -94.6 20.8 51.2 53.1 1.4 333 180 C X < - 0 0 18 -3,-1.7 -102,-0.1 1,-0.1 -3,-0.0 -0.417 65.1-118.9 -69.9 149.7 54.2 53.6 3.7 334 181 C P 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -103,-0.1 0.769 360.0 360.0 -65.7 -31.0 55.3 57.3 4.0 335 182 C Q 0 0 178 -106,-0.0 -2,-0.0 -105,-0.0 0, 0.0 0.986 360.0 360.0 56.6 360.0 58.9 57.0 2.6