==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-DEC-03 1VHL . COMPND 2 MOLECULE: DEPHOSPHO-COA KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR STRUCTURAL GENOMIX . 599 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34055.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 444 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 62 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 3 0.5 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-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 . 31 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 249 41.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.5 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 5 1 3 7 0 3 0 0 1 0 2 1 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 10 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 . 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 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 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 0 A S 0 0 124 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 154.4 37.8 0.6 81.6 2 1 A L - 0 0 115 2,-0.0 2,-0.2 0, 0.0 200,-0.1 -0.878 360.0-147.8 -87.4 122.2 37.2 1.5 78.0 3 2 A R - 0 0 60 -2,-0.7 2,-0.4 1,-0.0 105,-0.1 -0.643 14.1-122.3 -91.6 141.7 37.3 5.2 77.4 4 3 A Y E -a 108 0A 13 103,-0.5 105,-2.5 -2,-0.2 2,-0.6 -0.717 29.9-152.5 -82.3 129.5 35.1 6.8 74.7 5 4 A I E -a 109 0A 15 -2,-0.4 121,-2.0 103,-0.2 122,-1.6 -0.921 17.5-175.8-111.9 119.0 37.4 8.6 72.2 6 5 A V E -ab 110 127A 0 103,-2.7 105,-2.7 -2,-0.6 2,-0.3 -0.940 18.9-151.0-108.1 120.0 36.3 11.7 70.2 7 6 A A E -ab 111 128A 0 120,-3.1 122,-3.4 -2,-0.6 2,-0.4 -0.686 6.0-157.7 -90.7 134.1 39.1 12.7 67.7 8 7 A L E +ab 112 129A 0 103,-2.7 105,-2.8 -2,-0.3 2,-0.3 -0.978 20.8 160.1-109.2 134.5 39.4 16.3 66.7 9 8 A T E + b 0 130A 1 120,-2.0 122,-2.4 -2,-0.4 2,-0.2 -0.914 5.3 149.6-146.2 167.5 41.1 17.3 63.4 10 9 A G - 0 0 3 104,-0.3 122,-0.1 -2,-0.3 3,-0.1 -0.847 45.2 -86.5 173.6 159.4 41.2 20.3 61.1 11 10 A G > - 0 0 1 120,-0.4 3,-2.0 -2,-0.2 5,-0.3 -0.185 67.8 -59.0 -76.1 176.2 43.7 21.9 58.7 12 11 A I T 3 S+ 0 0 24 1,-0.3 130,-0.2 2,-0.1 -1,-0.2 -0.267 124.3 9.8 -58.3 129.4 46.3 24.5 59.7 13 12 A G T 3 S+ 0 0 9 128,-0.1 -1,-0.3 -3,-0.1 128,-0.1 0.554 93.0 115.5 78.7 15.6 44.7 27.6 61.2 14 13 A S S < S- 0 0 2 -3,-2.0 -2,-0.1 117,-0.1 162,-0.1 0.768 91.3 -87.7 -90.6 -25.6 41.1 26.1 61.5 15 14 A G S > S+ 0 0 9 -4,-0.3 4,-3.1 116,-0.1 5,-0.4 0.595 74.4 140.1 131.0 17.8 40.7 26.1 65.3 16 15 A K H > S+ 0 0 33 -5,-0.3 4,-2.5 1,-0.2 5,-0.2 0.952 82.9 40.0 -52.9 -54.8 42.0 22.9 66.7 17 16 A S H > S+ 0 0 81 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.890 116.2 50.7 -61.4 -44.0 43.6 24.5 69.7 18 17 A T H > S+ 0 0 73 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.931 114.1 43.6 -59.8 -46.5 40.7 26.9 70.2 19 18 A V H X S+ 0 0 0 -4,-3.1 4,-1.9 2,-0.2 5,-0.2 0.901 110.8 55.0 -67.2 -41.0 38.1 24.1 70.1 20 19 A A H X S+ 0 0 7 -4,-2.5 4,-2.5 -5,-0.4 -2,-0.2 0.944 106.5 51.2 -57.9 -45.5 40.2 21.8 72.3 21 20 A N H X S+ 0 0 93 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.867 105.6 56.8 -60.2 -35.8 40.4 24.5 75.0 22 21 A A H X S+ 0 0 15 -4,-1.5 4,-0.8 2,-0.2 -1,-0.2 0.893 110.3 43.7 -62.1 -40.1 36.5 24.8 74.8 23 22 A F H ><>S+ 0 0 0 -4,-1.9 5,-1.6 2,-0.2 3,-0.7 0.916 111.2 54.5 -70.5 -39.0 36.2 21.1 75.6 24 23 A A H ><5S+ 0 0 40 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.889 101.8 58.3 -63.1 -33.8 38.8 21.3 78.3 25 24 A D H 3<5S+ 0 0 139 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.817 101.8 56.6 -65.6 -28.7 36.9 24.1 80.0 26 25 A L T <<5S- 0 0 74 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.390 130.2 -94.1 -81.5 3.2 33.9 21.7 80.2 27 26 A G T < 5S+ 0 0 49 -3,-2.0 2,-0.4 1,-0.3 -3,-0.2 0.651 78.6 139.2 101.0 10.7 36.1 19.1 82.1 28 27 A I < - 0 0 5 -5,-1.6 2,-0.4 78,-0.1 -1,-0.3 -0.766 52.0-126.2 -94.9 133.3 37.3 16.9 79.3 29 28 A N E -c 109 0A 69 79,-0.6 81,-2.1 -2,-0.4 2,-0.5 -0.680 23.2-145.7 -75.0 128.6 40.9 15.7 79.2 30 29 A V E -c 110 0A 50 -2,-0.4 2,-0.6 79,-0.2 81,-0.2 -0.831 8.8-163.0 -98.1 128.1 42.6 16.5 75.9 31 30 A I E -c 111 0A 4 79,-2.7 81,-2.4 -2,-0.5 2,-0.6 -0.973 14.7-160.0-111.2 111.0 45.2 14.0 74.5 32 31 A D E > -c 112 0A 53 -2,-0.6 4,-2.6 79,-0.2 3,-0.4 -0.867 16.9-149.7-106.1 121.3 47.2 15.9 71.9 33 32 A A H > S+ 0 0 21 79,-2.7 4,-2.0 -2,-0.6 -1,-0.1 0.844 99.1 51.7 -56.8 -33.2 49.2 14.0 69.3 34 33 A D H > S+ 0 0 98 78,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.855 110.1 49.0 -75.5 -31.5 51.9 16.7 69.1 35 34 A I H > S+ 0 0 81 -3,-0.4 4,-2.3 2,-0.2 3,-0.3 0.920 109.8 52.3 -70.5 -38.4 52.4 16.7 72.9 36 35 A I H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.3 -2,-0.2 0.912 105.8 54.4 -63.3 -40.0 52.6 12.9 72.9 37 36 A A H < S+ 0 0 36 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.808 111.2 45.3 -64.6 -34.2 55.3 13.0 70.1 38 37 A R H >< S+ 0 0 137 -4,-1.4 3,-1.5 -3,-0.3 -1,-0.2 0.844 108.3 58.9 -74.2 -33.0 57.4 15.4 72.3 39 38 A Q H >< S+ 0 0 55 -4,-2.3 3,-1.6 1,-0.3 -2,-0.2 0.873 95.6 60.4 -63.7 -35.6 56.8 13.2 75.4 40 39 A V T 3< S+ 0 0 13 -4,-1.8 7,-0.5 1,-0.3 -1,-0.3 0.527 108.6 44.7 -73.7 -6.5 58.3 10.1 74.0 41 40 A V T < S+ 0 0 12 -3,-1.5 25,-0.5 6,-0.1 -1,-0.3 0.105 85.9 124.8-120.0 16.5 61.7 11.9 73.6 42 41 A E S X S- 0 0 98 -3,-1.6 3,-2.5 1,-0.2 6,-0.3 -0.332 79.8 -67.7 -68.1 160.9 61.7 13.5 77.0 43 42 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.2 0, 0.0 22,-0.1 -0.114 124.4 17.8 -53.8 134.0 64.7 12.9 79.3 44 43 A G T 3 S+ 0 0 80 20,-0.5 -2,-0.1 1,-0.3 21,-0.1 0.324 90.0 139.2 87.6 -10.0 64.9 9.3 80.4 45 44 A A X> - 0 0 17 -3,-2.5 3,-1.5 1,-0.1 4,-0.6 -0.436 62.2-122.5 -68.5 142.3 62.5 8.0 77.7 46 45 A P H >> S+ 0 0 101 0, 0.0 4,-1.4 0, 0.0 3,-0.8 0.825 107.6 66.9 -53.7 -35.0 63.5 4.7 76.0 47 46 A A H 3> S+ 0 0 1 -7,-0.5 4,-2.5 1,-0.2 5,-0.2 0.871 91.5 64.2 -57.4 -33.2 63.6 6.3 72.6 48 47 A L H <> S+ 0 0 10 -3,-1.5 4,-2.5 -6,-0.3 -1,-0.2 0.877 99.0 51.5 -61.8 -41.1 66.6 8.4 73.6 49 48 A H H < - 0 0 24 -4,-2.0 3,-2.2 -5,-0.4 4,-0.3 -0.073 36.1 -91.1 120.4 141.7 75.6 9.2 67.8 57 56 A A G > S+ 0 0 80 1,-0.3 3,-1.5 2,-0.2 -1,-0.1 0.792 117.9 67.9 -54.6 -33.4 76.1 9.7 71.5 58 57 A N G 3 S+ 0 0 126 1,-0.3 -1,-0.3 -6,-0.1 12,-0.1 0.452 77.4 80.6 -72.6 2.3 76.2 13.5 71.0 59 58 A M G < S+ 0 0 2 -3,-2.2 8,-2.9 1,-0.1 2,-0.5 0.716 92.8 57.6 -74.3 -22.1 72.5 13.5 70.0 60 59 A I B < S-E 66 0B 34 -3,-1.5 6,-0.2 -4,-0.3 -1,-0.1 -0.965 89.1-133.0-111.2 124.3 71.8 13.4 73.8 61 60 A A > - 0 0 19 4,-3.1 3,-2.2 -2,-0.5 -2,-0.1 -0.149 29.6 -98.5 -70.9 169.1 73.3 16.1 76.0 62 61 A A T 3 S+ 0 0 118 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.861 123.8 55.6 -55.1 -38.0 75.1 15.6 79.3 63 62 A D T 3 S- 0 0 116 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.151 122.7-103.9 -81.3 10.8 72.0 16.4 81.3 64 63 A G S < S+ 0 0 27 -3,-2.2 -20,-0.5 1,-0.3 2,-0.3 0.371 77.0 136.4 82.1 1.5 70.1 13.6 79.4 65 64 A T - 0 0 47 -22,-0.1 -4,-3.1 1,-0.1 -1,-0.3 -0.539 60.5-113.0 -85.0 140.8 68.1 16.0 77.2 66 65 A L B -E 60 0B 11 -25,-0.5 2,-1.6 -2,-0.3 -6,-0.2 -0.490 24.8-127.5 -64.9 134.9 67.7 15.3 73.5 67 66 A Q > - 0 0 93 -8,-2.9 4,-2.1 1,-0.2 5,-0.2 -0.719 34.6-177.7 -86.9 83.4 69.5 17.9 71.4 68 67 A R H > S+ 0 0 89 -2,-1.6 4,-2.9 2,-0.2 5,-0.2 0.938 75.4 48.0 -50.4 -53.6 66.4 18.7 69.4 69 68 A R H > S+ 0 0 69 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.946 111.7 51.8 -56.5 -47.4 68.0 21.3 67.1 70 69 A A H > S+ 0 0 36 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.796 111.9 45.9 -60.1 -37.6 70.9 18.9 66.4 71 70 A L H >X S+ 0 0 14 -4,-2.1 4,-2.9 2,-0.2 3,-0.7 0.957 110.8 52.0 -70.6 -48.0 68.6 16.0 65.5 72 71 A R H 3X S+ 0 0 201 -4,-2.9 4,-1.7 1,-0.3 -2,-0.2 0.890 110.6 49.2 -52.5 -44.8 66.3 18.2 63.3 73 72 A E H 3X S+ 0 0 147 -4,-2.4 4,-0.6 -5,-0.2 -1,-0.3 0.776 112.8 47.7 -67.7 -28.6 69.4 19.4 61.4 74 73 A R H X< S+ 0 0 99 -4,-1.0 3,-1.0 -3,-0.7 -2,-0.2 0.959 113.3 45.5 -77.5 -49.7 70.7 15.9 60.9 75 74 A I H >< S+ 0 0 12 -4,-2.9 3,-1.1 1,-0.3 7,-0.5 0.783 108.0 58.8 -63.7 -28.2 67.4 14.4 59.7 76 75 A F H 3< S+ 0 0 80 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.759 110.2 42.5 -72.3 -26.7 66.8 17.3 57.4 77 76 A A T << S+ 0 0 87 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.034 117.9 48.7-106.4 23.1 70.0 16.6 55.5 78 77 A N S X> S- 0 0 27 -3,-1.1 3,-2.0 1,-0.1 4,-0.7 -0.467 70.6-172.5-161.7 69.6 69.4 12.8 55.6 79 78 A P H >> S+ 0 0 97 0, 0.0 3,-0.9 0, 0.0 4,-0.9 0.786 80.5 57.0 -37.4 -49.4 65.9 12.2 54.3 80 79 A E H 3> S+ 0 0 157 1,-0.2 4,-1.8 2,-0.2 3,-0.1 0.784 95.7 68.1 -62.2 -26.2 65.7 8.5 55.0 81 80 A E H <> S+ 0 0 40 -3,-2.0 4,-3.7 2,-0.2 5,-0.3 0.896 90.7 60.7 -60.2 -39.4 66.5 9.2 58.7 82 81 A K H S+ 0 0 63 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.882 115.6 53.4 -62.2 -35.9 55.0 2.2 68.5 92 91 A L H X S+ 0 0 43 -4,-0.6 4,-2.8 2,-0.2 -2,-0.2 0.914 109.1 48.1 -66.9 -39.4 56.1 4.4 71.4 93 92 A I H X S+ 0 0 43 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.917 110.2 52.4 -66.1 -41.7 53.6 7.0 70.4 94 93 A Q H X S+ 0 0 105 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.955 113.4 44.1 -59.1 -47.8 50.9 4.4 70.1 95 94 A Q H X S+ 0 0 145 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.931 114.8 47.2 -62.7 -46.4 51.7 3.1 73.6 96 95 A E H X S+ 0 0 51 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.874 111.0 53.1 -65.9 -37.2 52.0 6.6 75.2 97 96 A T H X S+ 0 0 9 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.950 111.8 44.7 -61.6 -44.6 48.7 7.7 73.6 98 97 A Q H X S+ 0 0 76 -4,-2.2 4,-2.7 -5,-0.3 -2,-0.2 0.890 110.8 54.5 -66.3 -37.3 46.9 4.7 75.0 99 98 A H H X S+ 0 0 92 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.927 110.8 45.3 -61.1 -45.5 48.4 5.2 78.4 100 99 A Q H X S+ 0 0 44 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.832 112.3 51.3 -67.3 -34.1 47.2 8.8 78.5 101 100 A I H >< S+ 0 0 3 -4,-2.1 3,-0.6 2,-0.2 -2,-0.2 0.941 111.6 47.9 -64.2 -46.0 43.8 7.7 77.3 102 101 A Q H 3< S+ 0 0 75 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.862 111.7 51.4 -60.0 -37.0 43.7 5.1 80.0 103 102 A Q H 3< S+ 0 0 130 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.2 0.640 87.0 99.3 -80.0 -17.5 44.8 7.7 82.6 104 103 A A << - 0 0 7 -4,-1.2 5,-0.0 -3,-0.6 -76,-0.0 -0.511 51.1-169.0 -75.5 135.7 42.2 10.3 81.7 105 104 A T + 0 0 126 -2,-0.3 -1,-0.1 -102,-0.0 4,-0.1 0.416 46.9 114.1-104.5 3.7 39.1 10.3 84.0 106 105 A S S S- 0 0 11 1,-0.1 -78,-0.1 2,-0.0 -79,-0.1 -0.291 85.0-101.5 -71.9 161.0 36.8 12.6 82.1 107 106 A P S S- 0 0 80 0, 0.0 -103,-0.5 0, 0.0 2,-0.3 0.857 104.3 -5.3 -52.2 -34.4 33.5 11.0 80.7 108 107 A Y E S-a 4 0A 0 -105,-0.1 -79,-0.6 -102,-0.0 2,-0.3 -0.894 79.6-121.8-147.2 168.8 35.1 10.8 77.3 109 108 A V E -ac 5 29A 0 -105,-2.5 -103,-2.7 -2,-0.3 2,-0.7 -0.899 9.8-136.1-118.5 152.7 38.5 12.1 76.0 110 109 A L E -ac 6 30A 0 -81,-2.1 -79,-2.7 -2,-0.3 2,-0.8 -0.939 18.1-162.0-106.9 109.8 39.2 14.5 73.1 111 110 A W E -ac 7 31A 18 -105,-2.7 -103,-2.7 -2,-0.7 2,-0.7 -0.862 6.5-153.8 -97.2 112.1 42.1 13.3 71.0 112 111 A V E +ac 8 32A 6 -81,-2.4 -79,-2.7 -2,-0.8 -78,-0.3 -0.733 20.7 171.2 -92.5 113.4 43.6 16.1 69.0 113 112 A V > - 0 0 3 -105,-2.8 3,-1.9 -2,-0.7 -103,-0.2 -0.817 21.5-173.2-128.4 96.0 45.2 14.7 65.9 114 113 A P T 3 S+ 0 0 31 0, 0.0 3,-0.3 0, 0.0 -104,-0.3 0.859 92.8 45.7 -50.3 -42.5 46.4 17.1 63.2 115 114 A L T 3> S+ 0 0 84 1,-0.2 4,-2.8 2,-0.1 6,-0.4 0.056 74.7 126.3 -93.9 31.9 47.2 14.2 60.9 116 115 A L T <4>S+ 0 0 0 -3,-1.9 5,-1.8 1,-0.2 6,-0.8 0.892 81.5 32.0 -57.5 -47.9 43.9 12.2 61.5 117 116 A V T >45S+ 0 0 20 -3,-0.3 3,-1.5 -4,-0.2 -1,-0.2 0.935 118.1 54.8 -75.6 -43.4 43.0 11.9 57.8 118 117 A E T 345S+ 0 0 60 1,-0.3 -2,-0.2 -4,-0.2 -1,-0.2 0.882 119.2 32.7 -56.7 -41.7 46.5 11.7 56.5 119 118 A N T 3<5S- 0 0 95 -4,-2.8 -1,-0.3 0, 0.0 -2,-0.2 0.228 107.2-120.6-100.4 8.6 47.5 8.8 58.7 120 119 A S T X 5 + 0 0 48 -3,-1.5 3,-1.3 -5,-0.2 -3,-0.2 0.794 61.3 148.2 58.0 35.6 44.0 7.2 58.8 121 120 A L G > < + 0 0 52 -5,-1.8 3,-1.9 -6,-0.4 -4,-0.1 0.577 49.3 84.7 -79.5 -5.3 43.8 7.5 62.5 122 121 A Y G > S+ 0 0 65 -6,-0.8 3,-1.7 1,-0.3 -1,-0.3 0.767 75.6 74.9 -67.5 -15.1 40.0 8.0 62.5 123 122 A K G < S+ 0 0 157 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.675 96.3 48.2 -68.6 -18.6 40.0 4.1 62.5 124 123 A K G < S+ 0 0 109 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.3 0.271 98.2 87.2-103.1 9.1 41.0 4.4 66.2 125 124 A A < - 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0 0 56 -3,-0.2 4,-2.4 1,-0.2 3,-0.3 -0.782 48.7-179.9-119.8 97.7 -10.1 32.9 8.7 288 78 B P H > S+ 0 0 84 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.875 85.2 55.9 -57.9 -43.1 -8.5 35.3 11.1 289 79 B E H > S+ 0 0 155 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.916 111.0 44.1 -57.8 -44.4 -11.1 34.6 13.8 290 80 B E H > S+ 0 0 37 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.883 111.0 54.8 -71.3 -33.0 -10.3 30.9 13.6 291 81 B K H X S+ 0 0 63 -4,-2.4 4,-2.3 -7,-0.3 5,-0.2 0.952 109.6 47.2 -62.9 -46.0 -6.6 31.6 13.6 292 82 B N H X S+ 0 0 104 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.890 109.1 54.3 -62.7 -40.2 -6.9 33.6 16.8 293 83 B W H X S+ 0 0 83 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.932 109.9 47.3 -59.2 -48.4 -9.0 30.9 18.4 294 84 B L H X S+ 0 0 10 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.926 111.7 48.6 -60.0 -49.9 -6.3 28.3 17.7 295 85 B N H X S+ 0 0 86 -4,-2.3 4,-3.9 1,-0.2 -1,-0.2 0.877 108.8 54.6 -56.6 -41.7 -3.5 30.5 19.0 296 86 B A H < S+ 0 0 70 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.848 113.2 43.6 -59.7 -39.9 -5.5 31.2 22.2 297 87 B L H X S+ 0 0 39 -4,-1.7 4,-0.8 -3,-0.2 -2,-0.2 0.944 123.4 34.1 -70.2 -51.4 -5.8 27.5 22.7 298 88 B L H X S+ 0 0 25 -4,-3.2 4,-2.7 -5,-0.2 5,-0.3 0.854 101.5 73.6 -78.8 -29.8 -2.2 26.6 21.8 299 89 B H H X S+ 0 0 133 -4,-3.9 4,-2.6 1,-0.2 5,-0.2 0.919 101.6 40.8 -53.2 -55.0 -0.2 29.6 23.2 300 90 B P H > S+ 0 0 74 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.894 116.1 50.9 -61.5 -36.5 -0.6 28.8 26.9 301 91 B L H X S+ 0 0 62 -4,-0.8 4,-3.0 2,-0.2 5,-0.2 0.921 110.6 48.1 -68.0 -42.3 -0.0 25.0 26.3 302 92 B I H X S+ 0 0 46 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.924 111.1 52.0 -63.8 -45.1 3.1 25.6 24.3 303 93 B Q H X S+ 0 0 34 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.962 113.9 44.0 -53.3 -52.5 4.4 28.0 27.0 304 94 B Q H X S+ 0 0 41 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.898 113.9 47.3 -61.5 -44.3 3.8 25.3 29.6 305 95 B E H X S+ 0 0 54 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.901 111.9 51.6 -71.5 -32.9 5.3 22.4 27.7 306 96 B T H X S+ 0 0 11 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.976 112.2 45.2 -64.9 -53.0 8.4 24.4 26.8 307 97 B Q H X S+ 0 0 105 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.918 111.8 54.7 -56.2 -43.2 8.9 25.4 30.5 308 98 B H H X S+ 0 0 62 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.927 110.3 44.0 -53.9 -49.8 8.3 21.8 31.5 309 99 B Q H X S+ 0 0 44 -4,-2.4 4,-0.8 2,-0.2 -1,-0.2 0.861 111.7 53.3 -67.8 -35.0 10.9 20.4 29.1 310 100 B I H >< S+ 0 0 16 -4,-2.5 3,-1.1 -5,-0.2 -2,-0.2 0.957 109.0 50.9 -65.5 -41.0 13.4 23.1 30.2 311 101 B Q H 3< S+ 0 0 63 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.865 113.5 44.3 -61.6 -37.4 12.9 22.1 33.8 312 102 B Q H 3< S+ 0 0 33 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.529 87.2 108.7 -89.2 -6.0 13.5 18.5 33.1 313 103 B A << - 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0 0 18 -3,-1.6 -119,-0.2 1,-0.1 3,-0.1 -0.810 65.1-148.3-117.8 147.6 15.9 33.7 26.9 335 125 B N S S+ 0 0 80 -121,-2.0 2,-0.3 -2,-0.3 -120,-0.2 0.641 89.8 11.2 -80.6 -23.1 19.1 34.4 29.0 336 126 B R E S-g 215 0C 48 -122,-1.5 -120,-3.0 2,-0.0 2,-0.5 -0.975 70.8-140.5-151.6 145.7 21.2 34.6 25.8 337 127 B V E -g 216 0C 7 -2,-0.3 43,-2.7 -122,-0.2 44,-2.1 -0.950 11.4-172.1-116.4 128.9 20.5 34.8 22.1 338 128 B L E -gi 217 381C 0 -122,-3.6 -120,-2.0 -2,-0.5 2,-0.5 -0.964 8.8-161.6-114.4 118.8 22.4 33.0 19.4 339 129 B V E -gi 218 382C 1 42,-2.2 44,-2.6 -2,-0.5 2,-0.8 -0.900 14.4-142.7-104.9 134.4 21.6 33.9 15.8 340 130 B V E - i 0 383C 3 -122,-3.1 -120,-0.4 -2,-0.5 2,-0.4 -0.848 31.4-159.4 -88.2 109.1 22.7 31.6 12.9 341 131 B D E + i 0 384C 20 42,-2.7 44,-2.4 -2,-0.8 2,-0.3 -0.752 22.9 157.5-101.6 136.6 23.6 34.1 10.3 342 132 B V - 0 0 6 -2,-0.4 -122,-0.1 42,-0.2 -119,-0.1 -0.968 44.3 -95.2-144.1 166.4 23.8 33.6 6.5 343 133 B S > - 0 0 23 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.419 34.6-115.2 -79.2 161.5 23.6 36.0 3.5 344 134 B P H > S+ 0 0 58 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.900 119.0 62.0 -59.7 -35.7 20.2 36.4 1.8 345 135 B E H > S+ 0 0 119 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.939 103.6 47.4 -54.0 -48.4 21.9 34.8 -1.2 346 136 B T H > S+ 0 0 16 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.915 110.4 52.2 -62.0 -38.9 22.5 31.6 0.8 347 137 B Q H X S+ 0 0 14 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.932 114.6 42.9 -61.0 -44.6 18.8 31.7 2.0 348 138 B L H X S+ 0 0 22 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.962 115.4 47.5 -65.8 -55.4 17.7 32.0 -1.6 349 139 B K H X S+ 0 0 121 -4,-3.2 4,-2.6 1,-0.2 -2,-0.2 0.945 115.3 44.6 -53.8 -56.3 20.1 29.3 -3.0 350 140 B R H X S+ 0 0 71 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.865 115.6 46.8 -57.5 -38.7 19.4 26.8 -0.3 351 141 B T H X S+ 0 0 4 -4,-1.6 4,-1.8 -5,-0.3 6,-0.3 0.912 112.7 48.7 -74.1 -37.7 15.6 27.2 -0.4 352 142 B M H X S+ 0 0 66 -4,-2.9 4,-1.8 1,-0.2 5,-0.5 0.932 109.7 54.6 -63.9 -47.7 15.5 27.1 -4.2 353 143 B Q H < S+ 0 0 84 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.881 115.2 34.7 -55.0 -47.2 17.6 24.0 -4.3 354 144 B R H < S+ 0 0 207 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.707 127.4 33.1 -87.1 -24.8 15.4 21.9 -1.9 355 145 B D H < S- 0 0 99 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.481 97.3-130.0-104.7 -7.4 11.9 23.0 -2.7 356 146 B D < + 0 0 150 -4,-1.8 2,-0.2 -5,-0.3 -3,-0.2 0.908 57.0 148.3 54.4 50.1 12.6 23.6 -6.4 357 147 B V - 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