==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-MAR-12 3VPN . COMPND 2 MOLECULE: RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE SUBUNIT M2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.CHEN,Z.XU,H.LIU,L.ZHANG,B.CHEN,L.ZHU,C.YANG,W.ZHU,J.SHAO . 572 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22869.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 431 75.3 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 . 17 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 337 58.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 3.0 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 4 0 2 0 2 0 0 0 4 2 0 2 0 0 2 0 2 0 0 0 0 0 2 2 2 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 65 A M 0 0 175 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 86.2 -51.5 -20.2 57.2 2 66 A G - 0 0 66 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.816 360.0 -32.6 -97.3 -42.7 -51.5 -17.9 55.5 3 67 A V S > S+ 0 0 65 -2,-0.1 3,-2.3 1,-0.1 6,-0.3 0.559 110.4 87.2-113.7 -14.5 -48.6 -15.5 56.5 4 68 A E T 3 S+ 0 0 129 1,-0.3 -1,-0.1 6,-0.1 6,-0.1 0.557 88.2 58.7 -69.4 -4.9 -48.3 -15.9 60.3 5 69 A D T 3 S+ 0 0 42 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.311 86.5 89.4-100.8 9.4 -46.0 -18.8 59.6 6 70 A E X> - 0 0 9 -3,-2.3 4,-2.7 1,-0.1 3,-1.6 -0.901 63.1-158.2-106.6 108.3 -43.5 -16.6 57.6 7 71 A P T 34 S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 83,-0.1 0.835 94.6 51.6 -51.5 -34.9 -40.9 -15.0 59.9 8 72 A L T 34 S+ 0 0 0 207,-0.3 82,-2.9 1,-0.2 83,-0.8 0.730 122.3 28.0 -74.0 -23.0 -40.3 -12.3 57.3 9 73 A L T <4 S+ 0 0 25 -3,-1.6 -1,-0.2 -6,-0.3 3,-0.1 0.580 96.7 98.5-118.4 -17.9 -44.0 -11.4 56.9 10 74 A R S < S- 0 0 108 -4,-2.7 -6,-0.1 1,-0.2 80,-0.1 -0.272 88.5 -62.7 -74.6 163.4 -45.7 -12.2 60.3 11 75 A E - 0 0 138 1,-0.1 -1,-0.2 2,-0.0 3,-0.1 -0.140 48.7-176.2 -49.1 124.3 -46.4 -9.7 63.1 12 76 A N > - 0 0 38 -3,-0.1 3,-2.1 1,-0.1 4,-0.2 -0.852 12.4-174.0-127.1 94.1 -43.3 -8.0 64.5 13 77 A P T 3 S+ 0 0 112 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.695 91.3 53.9 -58.6 -17.6 -44.2 -5.7 67.5 14 78 A R T > S+ 0 0 64 1,-0.2 3,-1.7 2,-0.1 78,-0.1 0.093 72.1 118.3-100.4 18.0 -40.5 -4.8 67.4 15 79 A R T < S+ 0 0 59 -3,-2.1 -1,-0.2 1,-0.3 80,-0.1 0.797 80.5 39.3 -61.0 -32.1 -40.5 -3.8 63.7 16 80 A F T 3 S+ 0 0 28 -3,-0.3 2,-0.6 -4,-0.2 -1,-0.3 0.209 95.4 91.8-104.1 12.6 -39.5 -0.2 64.4 17 81 A V < - 0 0 27 -3,-1.7 75,-0.2 1,-0.1 342,-0.1 -0.948 64.1-159.1-103.6 123.3 -37.1 -0.9 67.2 18 82 A I + 0 0 10 -2,-0.6 -1,-0.1 340,-0.2 379,-0.1 0.922 47.3 97.4 -75.0 -45.0 -33.7 -1.3 65.6 19 83 A F + 0 0 18 377,-0.1 2,-0.1 2,-0.1 3,-0.0 -0.686 57.1 38.9-107.1 158.9 -31.7 -3.4 68.2 20 84 A P S S- 0 0 61 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 0.606 78.8-132.7 -80.5 158.8 -30.7 -6.0 69.0 21 85 A I + 0 0 20 1,-0.2 3,-0.1 -2,-0.1 -2,-0.1 -0.592 31.9 168.2 -73.1 132.1 -29.9 -7.4 65.5 22 86 A E + 0 0 143 -2,-0.3 2,-0.9 1,-0.2 -1,-0.2 0.632 67.7 56.7-114.5 -31.0 -31.3 -10.9 65.0 23 87 A Y > + 0 0 57 1,-0.2 4,-2.6 2,-0.1 -1,-0.2 -0.802 63.0 173.6-106.5 88.4 -30.9 -11.5 61.3 24 88 A H H > S+ 0 0 115 -2,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.826 75.2 52.4 -69.2 -35.0 -27.2 -10.9 60.9 25 89 A D H > S+ 0 0 61 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.920 113.5 43.5 -65.3 -45.5 -27.0 -12.0 57.3 26 90 A I H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 3,-0.4 0.935 114.1 52.0 -65.3 -44.5 -29.8 -9.6 56.3 27 91 A W H X S+ 0 0 13 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.852 104.4 55.1 -60.5 -39.1 -28.3 -6.8 58.4 28 92 A Q H X S+ 0 0 119 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.800 103.6 56.0 -69.0 -28.1 -24.8 -7.2 56.9 29 93 A M H X S+ 0 0 26 -4,-1.1 4,-2.6 -3,-0.4 -1,-0.2 0.918 108.1 48.6 -65.3 -42.7 -26.3 -6.7 53.4 30 94 A Y H X S+ 0 0 1 -4,-1.5 4,-3.1 2,-0.2 -2,-0.2 0.916 110.4 50.1 -58.9 -46.4 -27.7 -3.4 54.6 31 95 A K H X S+ 0 0 28 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.851 110.6 50.6 -62.3 -36.1 -24.4 -2.4 56.1 32 96 A K H X S+ 0 0 132 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.912 111.4 47.4 -65.9 -45.3 -22.7 -3.2 52.8 33 97 A A H >< S+ 0 0 5 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.954 113.0 50.2 -58.0 -47.9 -25.3 -1.1 50.9 34 98 A E H >< S+ 0 0 5 -4,-3.1 3,-1.2 1,-0.3 -2,-0.2 0.848 107.2 52.9 -60.0 -40.1 -24.8 1.7 53.5 35 99 A A H 3< S+ 0 0 93 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.629 105.7 55.5 -74.2 -14.0 -21.0 1.7 53.1 36 100 A S T << S+ 0 0 26 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.226 75.3 145.1-105.6 15.5 -21.1 2.0 49.4 37 101 A F < + 0 0 42 -3,-1.2 2,-0.3 -4,-0.1 -3,-0.1 -0.207 18.2 162.3 -47.4 137.3 -23.3 5.2 49.4 38 102 A W - 0 0 9 159,-0.0 2,-0.3 66,-0.0 69,-0.1 -0.945 23.8-141.0-152.8 164.1 -22.4 7.6 46.5 39 103 A T > - 0 0 18 -2,-0.3 3,-1.7 1,-0.1 4,-0.3 -0.867 29.3-109.8-128.2 164.9 -24.1 10.5 44.8 40 104 A A G > S+ 0 0 3 -2,-0.3 3,-2.1 1,-0.3 -1,-0.1 0.863 116.1 66.1 -60.3 -34.0 -24.5 11.8 41.2 41 105 A E G 3 S+ 0 0 110 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.681 89.9 66.3 -61.8 -20.4 -22.2 14.7 42.2 42 106 A D G < S+ 0 0 100 -3,-1.7 2,-0.6 2,-0.0 -1,-0.3 0.659 86.9 82.6 -71.5 -18.9 -19.4 12.2 42.6 43 107 A V S < S- 0 0 12 -3,-2.1 2,-0.6 -4,-0.3 147,-0.1 -0.788 70.4-148.1-100.8 120.8 -19.4 11.4 38.9 44 108 A D + 0 0 95 -2,-0.6 3,-0.2 1,-0.1 149,-0.1 -0.787 20.8 172.1 -89.3 119.8 -17.4 13.7 36.6 45 109 A L > + 0 0 20 -2,-0.6 3,-1.7 1,-0.1 4,-0.5 0.417 50.8 100.8-101.2 -2.8 -19.1 13.9 33.1 46 110 A S T 3 S+ 0 0 70 1,-0.3 4,-0.2 2,-0.2 3,-0.2 0.668 79.9 52.0 -63.6 -18.2 -16.8 16.8 31.7 47 111 A K T 3 S+ 0 0 136 -3,-0.2 4,-0.3 1,-0.2 -1,-0.3 0.181 96.6 72.3-101.6 17.3 -14.6 14.4 29.6 48 112 A D S <> S+ 0 0 0 -3,-1.7 4,-2.7 140,-0.2 -1,-0.2 0.750 76.0 72.1-101.5 -29.4 -17.5 12.7 27.9 49 113 A I H > S+ 0 0 58 -4,-0.5 4,-2.6 1,-0.3 5,-0.2 0.877 94.4 53.7 -64.5 -41.5 -18.8 15.2 25.4 50 114 A Q H > S+ 0 0 158 -4,-0.2 4,-1.1 1,-0.2 -1,-0.3 0.908 113.7 43.6 -60.5 -43.7 -15.9 15.1 23.0 51 115 A H H > S+ 0 0 55 -4,-0.3 4,-0.8 2,-0.2 3,-0.4 0.906 109.9 56.8 -65.3 -43.2 -16.4 11.3 22.8 52 116 A W H >< S+ 0 0 18 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.910 107.6 48.2 -53.9 -45.6 -20.2 11.7 22.6 53 117 A E H 3< S+ 0 0 138 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.766 104.7 60.5 -68.0 -26.3 -19.7 13.9 19.5 54 118 A S H 3< S+ 0 0 81 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.653 88.1 95.4 -75.0 -18.9 -17.3 11.4 17.8 55 119 A L S << S- 0 0 11 -3,-0.9 -3,-0.0 -4,-0.8 0, 0.0 -0.196 83.6-100.8 -71.7 163.1 -19.9 8.6 17.7 56 120 A K >> - 0 0 126 1,-0.1 4,-1.7 4,-0.0 3,-1.0 -0.462 36.4-110.0 -73.0 155.3 -22.1 7.7 14.8 57 121 A P H 3> S+ 0 0 87 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.861 119.0 57.5 -55.0 -35.5 -25.7 8.9 15.0 58 122 A E H 3> S+ 0 0 84 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.773 105.0 52.7 -66.5 -25.8 -27.0 5.3 15.6 59 123 A E H <> S+ 0 0 8 -3,-1.0 4,-2.8 2,-0.2 5,-0.2 0.917 108.6 46.9 -76.9 -45.1 -24.7 5.1 18.6 60 124 A R H X S+ 0 0 67 -4,-1.7 4,-2.7 2,-0.2 5,-0.3 0.903 112.6 52.5 -58.6 -43.5 -26.0 8.2 20.3 61 125 A Y H X S+ 0 0 114 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.956 111.3 45.8 -55.1 -53.7 -29.5 6.9 19.5 62 126 A F H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.932 115.2 45.8 -56.1 -51.0 -28.7 3.6 21.2 63 127 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.942 112.2 49.5 -64.0 -47.2 -27.1 5.1 24.3 64 128 A S H X S+ 0 0 4 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.836 111.8 49.6 -62.6 -32.0 -29.8 7.7 24.9 65 129 A H H X S+ 0 0 8 -4,-1.8 4,-2.8 -5,-0.3 -1,-0.2 0.888 109.5 51.1 -75.5 -35.2 -32.5 5.1 24.6 66 130 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.937 111.0 49.1 -60.8 -47.1 -30.6 2.8 27.1 67 131 A L H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.868 111.8 48.6 -57.6 -40.0 -30.5 5.8 29.5 68 132 A A H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.921 109.7 51.7 -72.1 -43.1 -34.2 6.5 29.0 69 133 A F H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.926 112.0 47.1 -51.7 -49.6 -35.0 2.8 29.6 70 134 A F H X S+ 0 0 2 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.924 110.6 50.8 -63.9 -46.2 -33.0 2.9 32.9 71 135 A A H X S+ 0 0 13 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.925 115.4 42.9 -57.7 -46.6 -34.5 6.1 34.2 72 136 A A H X S+ 0 0 10 -4,-2.3 4,-0.7 2,-0.2 -2,-0.2 0.917 113.8 50.8 -66.6 -45.0 -38.0 4.8 33.6 73 137 A S H >X S+ 0 0 8 -4,-2.9 4,-2.2 -5,-0.2 3,-1.2 0.904 103.1 59.6 -63.1 -41.1 -37.3 1.3 35.0 74 138 A D H 3X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.3 -1,-0.2 0.893 101.4 54.1 -51.7 -48.0 -35.8 2.7 38.2 75 139 A G H 3X S+ 0 0 4 -4,-1.2 4,-1.7 1,-0.2 -1,-0.3 0.711 108.0 50.2 -63.1 -22.1 -39.0 4.5 39.1 76 140 A I H S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 5,-1.4 0.883 111.9 46.8 -59.3 -42.0 -42.7 -1.5 44.1 81 145 A L H <>S+ 0 0 3 -4,-1.9 5,-2.4 3,-0.2 6,-0.3 0.926 115.8 44.7 -67.4 -44.7 -40.4 -0.9 47.1 82 146 A V H <5S+ 0 0 11 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.914 125.6 30.5 -66.0 -46.0 -42.4 2.1 48.4 83 147 A E H <5S+ 0 0 61 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.780 136.6 7.7 -89.2 -29.8 -45.9 0.5 47.9 84 148 A R T >X5S+ 0 0 53 -4,-2.5 4,-2.6 -5,-0.4 3,-1.2 0.727 120.4 40.8-119.6 -73.8 -45.1 -3.2 48.4 85 149 A F H 3>> - 0 0 6 -83,-0.8 4,-2.0 1,-0.1 3,-0.5 -0.603 67.1-138.6 -77.7 131.2 -38.2 -7.7 59.9 92 156 A T H 3> S+ 0 0 13 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.815 98.0 58.7 -55.7 -41.5 -36.3 -4.6 60.9 93 157 A E H 3> S+ 0 0 9 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.883 110.7 42.0 -62.2 -40.5 -33.1 -5.6 59.1 94 158 A A H <> S+ 0 0 0 -3,-0.5 4,-3.2 2,-0.2 5,-0.2 0.854 109.4 57.1 -76.1 -38.5 -34.8 -5.9 55.7 95 159 A R H X S+ 0 0 19 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.907 107.7 50.2 -57.8 -39.7 -36.9 -2.7 56.2 96 160 A C H X S+ 0 0 3 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.918 111.4 48.5 -62.8 -44.7 -33.6 -0.9 56.7 97 161 A F H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.956 114.0 44.4 -58.5 -52.4 -32.2 -2.5 53.5 98 162 A Y H X S+ 0 0 5 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.844 110.7 54.8 -65.3 -37.0 -35.3 -1.6 51.4 99 163 A G H X S+ 0 0 5 -4,-2.4 4,-1.5 -5,-0.2 291,-0.3 0.880 112.0 44.5 -59.5 -41.6 -35.4 1.9 52.9 100 164 A F H X S+ 0 0 3 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.850 109.7 56.1 -71.4 -37.3 -31.8 2.5 51.8 101 165 A Q H X S+ 0 0 4 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.888 103.5 54.5 -61.0 -42.0 -32.5 0.9 48.4 102 166 A I H X S+ 0 0 13 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.947 109.0 48.3 -56.0 -48.8 -35.3 3.4 47.8 103 167 A A H X S+ 0 0 2 -4,-1.5 4,-1.5 283,-0.3 -1,-0.2 0.901 112.4 48.7 -57.8 -43.5 -32.8 6.2 48.4 104 168 A M H X S+ 0 0 6 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.845 106.5 55.4 -69.6 -35.0 -30.3 4.7 46.1 105 169 A E H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.889 106.8 51.7 -61.7 -38.8 -32.9 4.2 43.3 106 170 A N H X S+ 0 0 18 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.862 110.6 48.1 -64.6 -34.7 -33.6 7.9 43.5 107 171 A I H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.882 110.5 51.9 -70.0 -41.4 -29.9 8.6 43.2 108 172 A H H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.932 110.4 48.0 -55.1 -49.5 -29.8 6.1 40.2 109 173 A S H X S+ 0 0 3 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.923 112.5 49.1 -62.0 -45.9 -32.7 8.0 38.5 110 174 A E H X S+ 0 0 7 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.931 109.1 52.1 -56.3 -47.6 -31.0 11.3 39.1 111 175 A M H X S+ 0 0 1 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.935 111.9 46.7 -56.9 -46.5 -27.8 10.0 37.7 112 176 A Y H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.890 112.6 49.0 -63.4 -41.9 -29.5 8.8 34.5 113 177 A S H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.827 110.6 51.2 -67.8 -32.6 -31.4 12.0 34.1 114 178 A L H X S+ 0 0 53 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.845 108.3 52.0 -69.2 -38.4 -28.2 14.0 34.5 115 179 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 5,-0.2 0.928 112.0 46.2 -62.5 -46.2 -26.5 11.9 31.9 116 180 A I H X S+ 0 0 1 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.946 114.3 47.7 -58.9 -48.4 -29.4 12.6 29.5 117 181 A D H < S+ 0 0 32 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.785 113.0 49.1 -66.3 -29.9 -29.4 16.3 30.3 118 182 A T H < S+ 0 0 38 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.873 120.0 34.7 -76.9 -42.2 -25.6 16.5 29.9 119 183 A Y H < S+ 0 0 16 -4,-2.2 2,-0.6 1,-0.2 -2,-0.2 0.822 119.2 49.8 -82.3 -31.2 -25.5 14.7 26.5 120 184 A I < + 0 0 23 -4,-2.9 -1,-0.2 -5,-0.2 6,-0.0 -0.937 51.9 171.4-119.5 112.3 -28.8 16.0 25.0 121 185 A K + 0 0 145 -2,-0.6 -1,-0.1 -3,-0.1 -4,-0.1 0.739 48.4 104.9 -88.4 -28.3 -29.5 19.8 25.1 122 186 A D > - 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0 0 29 -5,-2.0 5,-0.2 1,-0.2 -1,-0.2 -0.878 52.4 -4.4-115.7 141.5 -18.4 15.6 78.7 475 252 B M > - 0 0 0 -2,-0.4 4,-2.4 -140,-0.2 -1,-0.2 0.961 54.4-161.0 44.4 87.0 -18.6 12.6 76.2 476 253 B P H > S+ 0 0 63 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.864 89.6 53.5 -59.1 -42.9 -17.3 13.8 72.8 477 254 B G H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.929 111.9 45.0 -56.8 -49.7 -19.0 10.9 70.9 478 255 B L H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.928 115.8 45.2 -60.4 -48.1 -22.4 11.8 72.4 479 256 B T H X S+ 0 0 15 -4,-2.4 4,-1.2 -5,-0.2 -2,-0.2 0.865 114.0 47.9 -73.4 -33.8 -22.1 15.5 71.8 480 257 B F H >X S+ 0 0 92 -4,-2.7 4,-1.9 2,-0.2 3,-0.5 0.942 113.2 47.4 -68.5 -47.3 -20.8 15.2 68.2 481 258 B S H 3X S+ 0 0 1 -4,-2.4 4,-2.7 -5,-0.3 5,-0.2 0.908 109.1 57.9 -60.3 -35.5 -23.5 12.7 67.2 482 259 B N H 3X S+ 0 0 3 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.833 102.5 52.1 -63.0 -35.5 -26.0 15.1 68.9 483 260 B E H < S+ 0 0 2 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.931 105.0 53.4 -56.9 -49.7 -47.3 23.1 54.9 501 278 B K H 3< S+ 0 0 156 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.829 104.7 56.6 -53.6 -37.1 -46.7 26.3 52.9 502 279 B H T 3< S+ 0 0 48 -4,-1.5 2,-0.3 -3,-0.2 -207,-0.3 0.409 85.2 105.3 -79.2 0.8 -47.5 24.4 49.7 503 280 B L < - 0 0 7 -3,-2.0 3,-0.2 -4,-0.2 -210,-0.1 -0.671 54.6-162.2 -85.3 139.5 -50.9 23.3 51.0 504 281 B V S S+ 0 0 79 -2,-0.3 2,-0.9 1,-0.3 -1,-0.2 0.892 88.3 45.4 -82.3 -47.3 -54.0 25.1 49.6 505 282 B H S S+ 0 0 100 0, 0.0 -1,-0.3 0, 0.0 -60,-0.2 -0.825 80.0 178.7-101.5 94.3 -56.3 24.0 52.4 506 283 B K - 0 0 91 -2,-0.9 3,-0.1 -3,-0.2 -60,-0.0 -0.692 33.9-104.8 -89.0 144.8 -54.3 24.6 55.7 507 284 B P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.255 51.4 -89.9 -56.4 156.5 -55.7 23.9 59.2 508 285 B S > - 0 0 71 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.244 28.3-113.7 -69.9 160.5 -56.7 27.1 61.1 509 286 B E H > S+ 0 0 70 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.892 119.7 53.8 -59.1 -38.1 -54.4 29.0 63.3 510 287 B E H > S+ 0 0 117 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.914 108.3 47.6 -63.0 -45.7 -56.5 28.0 66.2 511 288 B R H > S+ 0 0 72 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.899 114.7 45.9 -62.3 -42.8 -56.3 24.3 65.4 512 289 B V H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 3,-0.3 0.914 108.5 57.9 -67.2 -45.4 -52.5 24.5 64.9 513 290 B R H X S+ 0 0 70 -4,-2.9 4,-3.2 1,-0.2 5,-0.3 0.891 106.7 48.0 -46.3 -49.3 -52.2 26.4 68.2 514 291 B E H X S+ 0 0 96 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.791 111.1 49.0 -73.8 -29.5 -53.8 23.7 70.2 515 292 B I H X S+ 0 0 3 -4,-1.3 4,-2.4 -3,-0.3 -2,-0.2 0.944 117.3 43.1 -66.2 -48.6 -51.7 20.9 68.7 516 293 B I H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.944 115.2 46.4 -65.1 -52.5 -48.6 22.9 69.4 517 294 B I H X S+ 0 0 46 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.924 112.9 52.2 -53.4 -49.4 -49.6 24.1 72.9 518 295 B N H X S+ 0 0 72 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.920 109.6 48.4 -52.8 -49.1 -50.6 20.5 73.7 519 296 B A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.894 108.6 54.1 -61.0 -43.0 -47.2 19.2 72.5 520 297 B V H X S+ 0 0 0 -4,-2.5 4,-3.2 1,-0.2 5,-0.2 0.899 107.4 51.1 -56.6 -42.0 -45.3 21.8 74.6 521 298 B R H X S+ 0 0 115 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.905 110.1 47.8 -65.3 -44.7 -47.2 20.7 77.8 522 299 B I H X S+ 0 0 16 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.930 115.2 47.2 -61.6 -43.4 -46.4 17.0 77.2 523 300 B E H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.903 110.7 49.6 -65.0 -46.3 -42.7 18.1 76.6 524 301 B Q H X S+ 0 0 9 -4,-3.2 4,-0.9 1,-0.2 -1,-0.2 0.868 113.1 48.7 -59.4 -38.1 -42.5 20.4 79.7 525 302 B E H >X>S+ 0 0 43 -4,-2.1 4,-2.1 -5,-0.2 5,-1.9 0.913 107.6 54.0 -66.9 -46.2 -43.9 17.6 81.8 526 303 B F H 3<>S+ 0 0 2 -4,-2.3 5,-2.5 1,-0.2 -2,-0.2 0.852 114.7 42.1 -53.4 -37.7 -41.5 15.0 80.4 527 304 B L H 3<5S+ 0 0 0 -4,-1.6 6,-2.1 3,-0.2 -1,-0.2 0.545 124.0 31.4 -94.8 -11.5 -38.6 17.3 81.4 528 305 B T H <<5S+ 0 0 39 -4,-0.9 -2,-0.2 -3,-0.6 -3,-0.2 0.503 135.6 14.9-118.6 -10.8 -39.7 18.5 84.9 529 306 B E T <5S+ 0 0 138 -4,-2.1 -3,-0.2 -5,-0.2 -4,-0.1 0.660 126.4 40.2-132.8 -58.0 -41.6 15.5 86.2 530 307 B A T - 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