==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-JAN-09 2W8M . COMPND 2 MOLECULE: ORF D212; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS VIRUS RAGGED HILLS; . AUTHOR S.K.MENON,M.J.YOUNG,C.M.LAWRENCE . 333 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18592.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 19.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 22 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 31.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.7 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 1 0 0 0 4 0 0 0 0 1 0 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 1 3 0 2 2 3 1 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 2 0 0 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 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 19 A I 0 0 107 0, 0.0 206,-1.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 90.5 44.7 59.8 59.3 2 20 A L - 0 0 77 204,-0.2 204,-0.2 1,-0.1 2,-0.1 -0.669 360.0-108.5 -85.3 140.8 48.5 59.6 59.2 3 21 A P + 0 0 19 0, 0.0 2,-0.3 0, 0.0 202,-0.1 -0.426 39.9 177.1 -64.0 141.3 50.4 59.4 55.9 4 22 A T > - 0 0 73 -2,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.961 40.9-120.9-137.4 160.3 51.9 56.1 54.8 5 23 A V H > S+ 0 0 46 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.852 114.4 54.8 -64.8 -35.3 53.8 55.0 51.6 6 24 A G H > S+ 0 0 22 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.912 108.4 45.6 -64.4 -46.6 51.1 52.4 51.1 7 25 A L H > S+ 0 0 42 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.893 113.3 51.0 -64.4 -41.5 48.2 54.8 51.2 8 26 A G H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.893 109.0 50.9 -61.4 -42.2 50.0 57.2 48.9 9 27 A R H X S+ 0 0 35 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.833 108.5 53.2 -63.3 -35.6 50.7 54.3 46.4 10 28 A E H X S+ 0 0 74 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.933 109.2 46.6 -66.4 -47.9 47.0 53.5 46.5 11 29 A Y H X S+ 0 0 57 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.842 109.7 56.7 -61.3 -34.1 45.9 57.0 45.6 12 30 A L H X S+ 0 0 3 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.911 109.6 44.2 -61.0 -44.6 48.6 56.9 42.9 13 31 A V H X S+ 0 0 2 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.917 113.5 50.3 -66.7 -45.2 46.9 53.8 41.4 14 32 A L H X S+ 0 0 28 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.930 110.4 50.6 -57.9 -48.2 43.4 55.3 41.7 15 33 A G H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.923 111.2 47.3 -55.3 -49.7 44.6 58.5 40.0 16 34 A K H X S+ 0 0 48 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.826 111.3 52.3 -62.9 -34.7 46.1 56.6 37.1 17 35 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.924 108.5 49.7 -67.2 -46.0 43.0 54.5 36.8 18 36 A L H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.882 110.5 50.8 -60.1 -41.1 40.7 57.6 36.6 19 37 A I H X S+ 0 0 17 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.930 111.6 47.4 -61.9 -47.8 42.9 59.1 33.9 20 38 A S H X S+ 0 0 31 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.949 111.9 49.3 -57.7 -53.3 42.8 55.9 31.8 21 39 A L H X S+ 0 0 8 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.887 112.6 48.1 -53.9 -45.0 39.0 55.6 32.2 22 40 A S H X S+ 0 0 15 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.895 112.4 48.6 -62.7 -43.2 38.6 59.2 31.1 23 41 A K H X S+ 0 0 91 -4,-2.4 4,-2.3 2,-0.2 6,-0.3 0.842 108.5 53.6 -68.4 -35.3 40.9 58.8 28.2 24 42 A W H X>S+ 0 0 15 -4,-2.6 5,-2.4 2,-0.2 6,-1.3 0.918 111.8 45.7 -63.3 -44.2 39.1 55.7 27.0 25 43 A R H ><5S+ 0 0 98 -4,-1.9 3,-0.5 4,-0.2 -2,-0.2 0.893 114.6 47.0 -64.6 -43.5 35.8 57.5 27.0 26 44 A A H 3<5S+ 0 0 88 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.860 112.5 48.9 -68.9 -37.9 37.2 60.6 25.2 27 45 A K H 3<5S- 0 0 140 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.534 116.9-112.4 -79.5 -7.7 39.0 58.5 22.5 28 46 A G T <<5S+ 0 0 40 -4,-0.5 -3,-0.2 -3,-0.5 -4,-0.1 0.605 82.7 125.0 84.9 13.8 35.8 56.5 21.9 29 47 A L S - 0 0 117 22,-0.0 3,-1.0 1,-0.0 2,-0.1 -0.814 360.0-132.9 -94.0 112.8 19.5 46.2 44.2 40 70 A Y T 3 S+ 0 0 89 -2,-0.7 -1,-0.0 1,-0.2 0, 0.0 -0.416 81.3 0.7 -69.6 134.6 21.9 43.9 42.3 41 71 A Y T > S+ 0 0 55 -2,-0.1 3,-1.2 1,-0.1 -1,-0.2 0.831 75.2 156.6 59.8 39.5 25.0 42.6 44.1 42 72 A K G X + 0 0 120 -3,-1.0 3,-1.4 1,-0.3 -2,-0.1 0.809 68.1 62.5 -64.9 -30.1 24.2 44.4 47.3 43 73 A G G 3 S+ 0 0 32 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.695 95.0 61.3 -67.4 -20.8 26.3 41.9 49.3 44 74 A L G X> S+ 0 0 1 -3,-1.2 3,-1.9 2,-0.1 4,-0.6 0.496 77.1 118.5 -82.0 -6.7 29.3 43.0 47.3 45 75 A E T <4 S+ 0 0 99 -3,-1.4 -3,-0.0 1,-0.3 -4,-0.0 -0.448 87.2 5.3 -61.4 129.0 28.8 46.5 48.8 46 76 A D T 34 S+ 0 0 152 2,-0.2 -1,-0.3 -2,-0.2 -2,-0.1 0.622 104.0 104.4 66.5 17.1 31.9 47.5 50.9 47 77 A K T <4 S+ 0 0 95 -3,-1.9 2,-0.3 1,-0.1 -2,-0.1 0.765 80.6 36.4 -90.8 -31.4 33.7 44.3 49.7 48 78 A Y S < S- 0 0 13 -4,-0.6 -2,-0.2 1,-0.1 19,-0.2 -0.818 81.5-117.3-124.4 161.9 36.1 46.0 47.2 49 79 A D S S+ 0 0 89 -2,-0.3 2,-0.4 17,-0.2 18,-0.2 0.876 95.8 17.7 -66.2 -42.2 37.9 49.3 47.1 50 80 A L E - B 0 66A 29 16,-2.7 16,-3.8 -14,-0.0 2,-0.5 -0.998 62.1-159.5-138.9 135.3 36.2 50.8 44.1 51 81 A T E - B 0 65A 20 -2,-0.4 2,-0.7 14,-0.2 14,-0.2 -0.966 12.2-146.7-115.0 129.8 32.9 49.9 42.2 52 82 A L E - B 0 64A 0 12,-3.0 11,-3.2 -2,-0.5 12,-1.4 -0.874 23.8-169.3 -97.9 114.2 32.4 51.0 38.6 53 83 A Y E -AB 35 62A 48 -18,-3.5 -18,-2.8 -2,-0.7 2,-0.3 -0.588 10.3-157.8-100.0 160.9 28.7 51.7 38.0 54 84 A I E - B 0 61A 4 7,-1.8 7,-2.6 -20,-0.2 2,-0.6 -0.962 27.3-105.9-133.5 154.7 26.6 52.3 34.9 55 85 A R E + B 0 60A 137 -22,-0.5 5,-0.2 -2,-0.3 -22,-0.1 -0.718 30.9 174.7 -84.3 117.5 23.3 54.1 34.3 56 86 A A S S- 0 0 49 3,-2.3 -1,-0.2 -2,-0.6 4,-0.1 0.939 72.5 -63.3 -76.6 -59.3 20.4 51.8 33.6 57 87 A K S S- 0 0 167 2,-0.8 -2,-0.0 0, 0.0 3,-0.0 0.065 112.4 -17.5-152.7 -85.7 17.8 54.6 33.6 58 88 A D S S+ 0 0 143 -3,-0.0 2,-0.3 2,-0.0 -3,-0.0 0.141 128.4 74.8-113.2 12.7 17.3 56.4 37.0 59 89 A S S S- 0 0 79 2,-0.0 -3,-2.3 -5,-0.0 -2,-0.8 -0.832 75.7-130.2-120.7 160.5 19.1 53.6 38.8 60 90 A Y E -B 55 0A 56 -2,-0.3 -5,-0.2 -5,-0.2 -2,-0.0 -0.925 14.9-162.3-117.4 138.5 22.8 52.6 38.9 61 91 A Y E -B 54 0A 16 -7,-2.6 -7,-1.8 -2,-0.4 2,-0.4 -0.976 21.9-124.3-124.0 124.7 24.2 49.1 38.3 62 92 A P E +B 53 0A 8 0, 0.0 -9,-0.3 0, 0.0 3,-0.1 -0.551 30.5 174.0 -71.6 121.8 27.6 47.9 39.4 63 93 A L E + 0 0 1 -11,-3.2 2,-0.3 -2,-0.4 -10,-0.2 0.864 63.7 10.1 -94.4 -48.1 29.5 46.6 36.3 64 94 A L E -B 52 0A 0 -12,-1.4 -12,-3.0 38,-0.0 2,-0.4 -0.955 60.0-145.3-134.0 153.6 33.0 45.9 37.7 65 95 A W E -Bc 51 102A 3 36,-2.5 38,-2.7 -2,-0.3 2,-0.4 -0.979 20.0-162.6-119.4 133.4 34.6 45.8 41.2 66 96 A I E -Bc 50 103A 0 -16,-3.8 -16,-2.7 -2,-0.4 2,-0.5 -0.950 10.1-159.3-125.4 134.7 38.2 46.9 41.6 67 97 A D E - c 0 104A 18 36,-2.8 38,-2.6 -2,-0.4 2,-0.5 -0.954 17.2-140.1-112.9 126.3 40.7 46.4 44.3 68 98 A I E - c 0 105A 16 -2,-0.5 2,-0.6 36,-0.2 38,-0.2 -0.756 11.6-164.8 -89.4 124.3 43.7 48.8 44.6 69 99 A T + 0 0 19 36,-3.1 38,-0.5 -2,-0.5 3,-0.1 -0.935 14.4 170.5-109.6 108.8 47.1 47.2 45.4 70 100 A G + 0 0 7 -2,-0.6 37,-0.3 1,-0.2 2,-0.2 0.947 58.7 30.5 -80.4 -86.8 49.5 49.9 46.5 71 101 A S S S- 0 0 40 1,-0.1 -1,-0.2 35,-0.1 2,-0.1 -0.549 78.4-132.3 -78.8 140.0 52.8 48.5 48.0 72 102 A S - 0 0 2 -2,-0.2 4,-0.5 11,-0.1 11,-0.2 -0.358 20.2-115.0 -81.9 168.8 54.1 45.2 46.7 73 103 A W S S+ 0 0 144 9,-2.4 10,-0.2 2,-0.1 -1,-0.1 0.811 114.2 38.4 -72.1 -30.6 55.3 42.3 48.9 74 104 A T S > S+ 0 0 39 8,-1.1 3,-1.7 1,-0.1 -1,-0.1 0.909 101.5 65.2 -86.9 -49.0 58.8 42.7 47.5 75 105 A E T 3 S+ 0 0 65 1,-0.3 -1,-0.1 7,-0.2 -2,-0.1 0.636 92.9 65.8 -61.9 -15.3 59.4 46.5 47.1 76 106 A E T 3 0 0 131 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.078 360.0 360.0 -82.8 21.7 59.1 46.8 50.9 77 107 A Q < 0 0 205 -3,-1.7 -1,-0.3 0, 0.0 -2,-0.0 -0.318 360.0 360.0 52.0 360.0 62.4 44.7 50.9 78 ! 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 79 113 A G 0 0 134 0, 0.0 2,-0.2 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0-147.6 64.4 40.7 41.3 80 114 A E - 0 0 88 1,-0.1 2,-0.2 -6,-0.0 0, 0.0 -0.478 360.0-107.4 -75.9 142.7 60.8 40.6 40.0 81 115 A S - 0 0 24 -2,-0.2 63,-2.4 -7,-0.1 2,-0.4 -0.494 32.6-158.2 -73.4 133.9 58.1 42.3 42.0 82 116 A I E -F 143 0B 37 61,-0.2 -9,-2.4 -2,-0.2 -8,-1.1 -0.937 0.8-155.1-116.0 137.6 55.6 40.0 43.8 83 117 A Y E -F 142 0B 2 59,-1.9 59,-2.7 -2,-0.4 2,-0.5 -0.931 7.2-144.2-116.4 135.4 52.1 41.0 45.0 84 118 A A E -F 141 0B 31 -2,-0.4 2,-0.5 57,-0.2 57,-0.2 -0.864 18.4-172.4 -97.7 124.1 50.1 39.5 47.8 85 119 A I E -F 140 0B 5 55,-2.2 55,-3.2 -2,-0.5 2,-0.1 -0.978 28.9-112.3-122.6 125.6 46.4 39.3 47.2 86 120 A L E >> -F 139 0B 58 -2,-0.5 4,-0.9 53,-0.2 3,-0.9 -0.317 14.6-145.4 -58.9 124.8 43.9 38.3 49.9 87 121 A S H 3> S+ 0 0 1 51,-2.2 4,-2.6 1,-0.2 3,-0.4 0.822 98.0 66.0 -57.4 -34.4 42.3 34.9 49.2 88 122 A V H 3> S+ 0 0 80 50,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.845 96.1 56.0 -58.6 -35.9 39.0 36.2 50.8 89 123 A K H <> S+ 0 0 36 -3,-0.9 4,-1.2 2,-0.2 -1,-0.2 0.870 111.2 43.2 -63.2 -38.3 38.7 38.7 48.0 90 124 A V H X S+ 0 0 0 -4,-0.9 4,-1.7 -3,-0.4 -2,-0.2 0.887 111.1 53.7 -76.8 -41.5 38.8 36.0 45.3 91 125 A E H X S+ 0 0 96 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.845 106.6 53.7 -59.8 -37.0 36.5 33.6 47.3 92 126 A T H X S+ 0 0 19 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.895 107.0 50.8 -64.9 -41.5 33.9 36.5 47.5 93 127 A A H <>S+ 0 0 0 -4,-1.2 5,-3.0 2,-0.2 6,-0.3 0.842 111.2 49.2 -63.9 -35.3 34.0 36.9 43.7 94 128 A K H ><5S+ 0 0 142 -4,-1.7 3,-1.4 3,-0.2 -2,-0.2 0.927 108.9 52.6 -67.7 -46.6 33.5 33.1 43.3 95 129 A K H 3<5S+ 0 0 163 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.895 114.4 41.0 -56.7 -45.8 30.5 33.2 45.7 96 130 A Y T 3<5S- 0 0 65 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.259 111.6-119.8 -90.4 11.9 28.7 36.0 43.8 97 131 A D T < 5S+ 0 0 137 -3,-1.4 -3,-0.2 1,-0.1 -2,-0.1 0.935 79.7 119.3 51.1 56.0 29.7 34.5 40.4 98 132 A V >>< + 0 0 3 -5,-3.0 3,-1.1 -6,-0.1 4,-0.5 -0.075 19.3 134.9-140.0 33.1 31.6 37.6 39.3 99 133 A L G >4 S+ 0 0 25 -6,-0.3 21,-1.9 1,-0.3 20,-0.9 0.843 76.7 44.0 -60.1 -40.5 35.1 36.2 38.8 100 134 A G G 34 S+ 0 0 16 1,-0.2 -1,-0.3 19,-0.2 56,-0.0 0.586 112.2 54.0 -80.0 -11.7 35.8 38.0 35.5 101 135 A R G <4 S+ 0 0 20 -3,-1.1 -36,-2.5 -8,-0.1 2,-0.6 0.366 89.4 85.0-105.2 1.2 34.3 41.3 36.8 102 136 A V E << -c 65 0A 0 -3,-0.6 17,-2.1 -4,-0.5 2,-0.4 -0.933 61.9-176.0-108.0 114.1 36.5 41.5 39.9 103 137 A F E -cD 66 118A 2 -38,-2.7 -36,-2.8 -2,-0.6 2,-0.4 -0.869 20.1-153.7-116.0 143.6 39.9 43.1 39.1 104 138 A F E -cD 67 117A 1 13,-2.7 13,-1.5 -2,-0.4 2,-0.4 -0.940 21.5-166.2-109.5 137.2 43.0 43.8 41.2 105 139 A I E +cD 68 116A 0 -38,-2.6 -36,-3.1 -2,-0.4 2,-0.3 -0.973 14.7 167.4-129.7 139.0 45.2 46.7 40.0 106 140 A H E - D 0 115A 0 9,-2.3 9,-3.3 -2,-0.4 2,-0.5 -0.960 32.3-119.6-138.9 162.1 48.7 47.9 40.8 107 141 A Y E - D 0 114A 28 -38,-0.5 2,-0.7 -2,-0.3 7,-0.2 -0.910 18.6-148.7-103.0 122.7 51.1 50.4 39.2 108 142 A N E >> - D 0 113A 12 5,-2.6 5,-1.7 -2,-0.5 4,-1.0 -0.831 7.5-165.3 -90.3 116.9 54.5 49.1 38.0 109 143 A D T 45S+ 0 0 73 -2,-0.7 -1,-0.2 3,-0.2 5,-0.0 0.899 84.0 50.4 -71.0 -44.5 57.1 51.9 38.4 110 144 A T T 45S+ 0 0 133 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.891 120.3 35.4 -62.9 -43.4 59.8 50.4 36.1 111 145 A E T 45S- 0 0 108 2,-0.2 -1,-0.2 0, 0.0 -2,-0.2 0.610 102.4-136.5 -84.3 -15.2 57.4 49.8 33.2 112 146 A D T <5 + 0 0 102 -4,-1.0 2,-0.3 1,-0.2 -3,-0.2 0.966 63.3 109.5 56.4 59.6 55.4 53.0 34.0 113 147 A K E -D 103 0A 5 -2,-0.3 4,-1.7 -15,-0.2 -15,-0.2 -0.491 22.1-119.7 -89.2 159.8 41.0 39.2 37.4 119 153 A A H > S+ 0 0 0 -17,-2.1 4,-2.0 -20,-0.9 -19,-0.2 0.853 117.3 56.9 -61.2 -36.6 39.7 36.9 40.2 120 154 A L H > S+ 0 0 85 -21,-1.9 4,-2.0 -18,-0.3 -1,-0.2 0.923 106.8 46.8 -57.7 -48.9 39.0 34.4 37.4 121 155 A Q H > S+ 0 0 39 -22,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.818 107.6 56.8 -68.0 -32.8 42.6 34.4 36.2 122 156 A I H X S+ 0 0 0 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.955 110.4 43.9 -60.8 -51.0 44.0 34.1 39.8 123 157 A L H X S+ 0 0 19 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.852 112.3 54.3 -60.9 -36.9 41.9 30.8 40.2 124 158 A N H X S+ 0 0 50 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.892 107.8 48.8 -63.9 -41.7 43.1 29.8 36.7 125 159 A L H <>S+ 0 0 3 -4,-2.5 5,-2.9 1,-0.2 6,-0.9 0.817 109.6 53.4 -66.8 -31.8 46.8 30.3 37.7 126 160 A E H ><5S+ 0 0 46 -4,-1.7 3,-1.2 3,-0.2 -2,-0.2 0.884 106.2 51.5 -69.2 -41.3 46.1 28.2 40.9 127 161 A R H 3<5S+ 0 0 172 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.845 110.6 49.7 -61.5 -35.8 44.7 25.3 38.9 128 162 A Q T 3<5S- 0 0 87 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.385 113.6-122.0 -82.5 1.7 47.8 25.5 36.7 129 163 A N T < 5S+ 0 0 109 -3,-1.2 -3,-0.2 2,-0.2 -2,-0.1 0.830 78.2 123.3 57.2 36.1 50.0 25.4 39.9 130 164 A K S -F 82 0B 26 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.297 27.1-113.9 -61.4 151.5 54.5 37.7 40.3 144 183 A T G > S+ 0 0 11 -63,-2.4 3,-0.9 1,-0.3 -62,-0.1 0.738 110.9 67.7 -61.7 -27.3 54.2 40.8 38.2 145 184 A S G 3 S+ 0 0 72 1,-0.2 -1,-0.3 -64,-0.2 -3,-0.0 0.770 95.7 56.2 -65.0 -27.7 54.7 38.9 34.9 146 185 A Y G < S+ 0 0 72 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.656 92.9 88.0 -77.5 -18.1 51.3 37.1 35.4 147 186 A W < - 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j 0 276C 10 34,-2.7 36,-2.6 -2,-0.4 2,-0.6 -0.956 14.9-140.6-117.0 132.8 46.0 73.4 47.0 242 98 B I E j 0 277C 16 -2,-0.4 36,-0.2 34,-0.2 -61,-0.1 -0.819 360.0 360.0 -97.0 122.0 46.4 71.0 44.1 243 99 B T 0 0 63 34,-3.1 36,-0.4 -2,-0.6 14,-0.1 -0.409 360.0 360.0-140.0 360.0 46.7 72.5 40.6 244 ! 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 0.0 245 107 B Q > 0 0 183 0, 0.0 4,-0.7 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -81.3 51.1 71.5 25.8 246 108 B S H > + 0 0 29 2,-0.2 4,-2.5 3,-0.1 6,-0.4 0.762 360.0 55.9 -86.2 -28.8 51.7 74.7 27.6 247 109 B K H > S+ 0 0 150 2,-0.2 4,-2.5 3,-0.2 -1,-0.1 0.915 110.2 42.1 -72.5 -46.8 55.2 75.3 26.1 248 110 B E H 4 S+ 0 0 167 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.822 119.2 48.1 -67.8 -30.6 54.1 75.1 22.4 249 111 B R H < S+ 0 0 181 -4,-0.7 -2,-0.2 1,-0.1 -1,-0.2 0.899 134.5 8.9 -75.8 -44.9 51.1 77.2 23.3 250 112 B Y H < S- 0 0 120 -4,-2.5 -3,-0.2 2,-0.1 -2,-0.2 0.424 98.8-111.5-119.9 -2.8 52.8 80.0 25.3 251 113 B G S < S+ 0 0 54 -4,-2.5 2,-0.3 -5,-0.3 -4,-0.2 -0.180 98.5 43.9 97.0 -41.0 56.5 79.3 24.8 252 114 B E S S- 0 0 102 -6,-0.4 2,-0.3 -2,-0.1 -2,-0.1 -0.972 98.2 -95.3-135.1 149.0 57.1 78.3 28.5 253 115 B S - 0 0 36 -2,-0.3 66,-2.4 -4,-0.1 2,-0.4 -0.485 48.1-174.8 -66.9 125.8 55.0 76.0 30.7 254 116 B I E -M 318 0D 45 64,-0.3 2,-0.4 -2,-0.3 62,-0.1 -0.965 15.4-155.5-127.8 142.1 52.6 78.2 32.8 255 117 B Y E -M 317 0D 62 62,-2.4 62,-3.1 -2,-0.4 2,-0.5 -0.950 12.8-140.9-117.1 137.5 50.3 77.3 35.7 256 118 B A E -M 316 0D 41 -2,-0.4 2,-0.4 60,-0.2 60,-0.2 -0.852 15.9-171.8-100.1 129.0 47.2 79.4 36.6 257 119 B I E -M 315 0D 1 58,-1.9 58,-2.8 -2,-0.5 5,-0.1 -0.988 32.5-108.3-121.7 127.1 46.3 79.9 40.3 258 120 B L E >> -M 314 0D 53 -2,-0.4 3,-0.9 56,-0.2 4,-0.7 -0.285 21.0-139.9 -54.1 127.5 43.0 81.5 41.3 259 121 B S H >> S+ 0 0 1 54,-3.0 4,-2.2 1,-0.2 3,-1.1 0.860 99.3 63.0 -57.6 -40.7 43.7 85.0 42.7 260 122 B V H 3> S+ 0 0 71 53,-0.4 4,-2.6 1,-0.3 -1,-0.2 0.809 94.2 62.3 -56.8 -32.8 41.1 84.6 45.5 261 123 B K H <> S+ 0 0 38 -3,-0.9 4,-1.1 1,-0.2 -1,-0.3 0.840 109.4 40.9 -61.3 -35.3 43.1 81.7 46.9 262 124 B V H S+ 0 0 0 -4,-1.1 5,-2.9 2,-0.2 4,-0.3 0.888 113.6 45.7 -60.5 -41.4 45.8 83.6 52.5 266 128 B K H ><5S+ 0 0 125 -4,-2.3 3,-0.9 3,-0.2 -2,-0.2 0.925 110.9 53.3 -65.3 -47.1 46.5 87.4 52.8 267 129 B K H 3<5S+ 0 0 172 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.890 116.1 38.0 -55.3 -46.1 43.2 88.0 54.6 268 130 B Y T 3<5S- 0 0 80 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.401 111.0-121.8 -88.7 0.7 43.9 85.3 57.2 269 131 B D T < 5S+ 0 0 134 -3,-0.9 -3,-0.2 -4,-0.3 -4,-0.1 0.926 77.9 119.5 58.0 50.5 47.6 86.2 57.4 270 132 B V >>< + 0 0 1 -5,-2.9 3,-1.1 -6,-0.1 4,-0.7 -0.169 20.7 135.0-132.3 38.9 48.9 82.7 56.4 271 133 B L T 34 S+ 0 0 25 -6,-0.3 21,-2.1 1,-0.3 20,-0.8 0.852 76.7 44.7 -60.5 -39.9 50.7 83.6 53.2 272 134 B G T 34 S+ 0 0 17 19,-0.2 -1,-0.3 1,-0.2 -2,-0.0 0.540 112.9 52.8 -80.6 -8.8 53.8 81.5 54.1 273 135 B R T <4 S+ 0 0 9 -3,-1.1 -34,-2.6 -8,-0.1 2,-0.6 0.416 90.5 83.5-106.8 -2.8 51.6 78.5 55.2 274 136 B V E < -j 239 0C 0 -4,-0.7 17,-2.3 -3,-0.5 2,-0.3 -0.921 61.6-175.3-107.1 115.8 49.4 78.2 52.0 275 137 B F E -jK 240 290C 4 -36,-3.0 -34,-2.7 -2,-0.6 2,-0.4 -0.856 18.5-151.7-115.7 145.1 51.1 76.2 49.3 276 138 B F E -jK 241 289C 0 13,-2.9 13,-1.9 -2,-0.3 2,-0.4 -0.932 21.8-170.9-111.1 139.6 50.1 75.4 45.7 277 139 B I E +jK 242 288C 0 -36,-2.6 -34,-3.1 -2,-0.4 2,-0.3 -0.989 13.8 173.0-137.5 138.8 51.4 72.1 44.2 278 140 B H E - K 0 287C 2 9,-1.9 9,-2.8 -2,-0.4 2,-0.6 -0.959 33.5-114.1-136.0 160.0 51.5 70.4 40.8 279 141 B Y E - K 0 286C 33 -36,-0.4 2,-0.7 -2,-0.3 7,-0.2 -0.850 21.5-147.8 -95.8 119.9 53.1 67.2 39.5 280 142 B N E >> - K 0 285C 14 5,-3.1 5,-1.7 -2,-0.6 4,-1.0 -0.803 11.7-171.0 -87.5 113.2 55.8 67.7 36.9 281 143 B D T 45S+ 0 0 82 -2,-0.7 -1,-0.2 3,-0.2 5,-0.0 0.864 81.6 49.7 -76.5 -39.0 55.7 64.7 34.6 282 144 B T T 45S+ 0 0 140 1,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.946 121.5 34.1 -64.0 -50.8 58.9 65.4 32.6 283 145 B E T 45S- 0 0 98 2,-0.2 -1,-0.2 1,-0.0 -2,-0.2 0.662 102.6-134.6 -76.6 -18.6 61.0 65.9 35.8 284 146 B D T <5 + 0 0 95 -4,-1.0 2,-0.3 1,-0.2 -3,-0.2 0.929 65.8 111.8 59.3 49.0 59.0 63.3 37.7 285 147 B K E -K 275 0C 6 -2,-0.3 4,-1.9 -15,-0.2 -15,-0.2 -0.509 22.3-119.9 -86.9 158.8 53.7 79.6 48.6 291 153 B A H > S+ 0 0 0 -17,-2.3 4,-2.2 -20,-0.8 -19,-0.2 0.877 117.5 56.5 -60.3 -38.5 51.1 82.4 48.5 292 154 B L H > S+ 0 0 75 -21,-2.1 4,-2.0 -18,-0.3 -1,-0.2 0.930 106.6 48.0 -56.2 -49.7 53.8 84.6 50.0 293 155 B Q H > S+ 0 0 29 -22,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.869 108.6 54.9 -61.9 -39.4 56.1 83.8 47.1 294 156 B I H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.952 109.2 45.9 -60.1 -51.9 53.4 84.5 44.6 295 157 B L H X S+ 0 0 12 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.866 111.4 53.8 -58.9 -38.6 52.7 88.0 46.0 296 158 B N H X S+ 0 0 64 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.913 108.6 48.4 -61.9 -44.8 56.5 88.7 46.1 297 159 B L H <>S+ 0 0 18 -4,-2.3 5,-2.9 1,-0.2 6,-0.7 0.869 109.5 53.7 -62.2 -39.3 56.9 87.8 42.4 298 160 B E H ><5S+ 0 0 62 -4,-2.1 3,-1.0 3,-0.2 -2,-0.2 0.902 108.2 48.8 -62.1 -43.9 53.9 90.1 41.6 299 161 B R H 3<5S+ 0 0 160 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.852 110.6 50.9 -64.2 -36.4 55.5 93.1 43.4 300 162 B Q T 3<5S- 0 0 117 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.448 114.3-121.3 -79.2 -2.2 58.8 92.4 41.5 301 163 B N T < 5S+ 0 0 107 -3,-1.0 -3,-0.2 -4,-0.2 -2,-0.1 0.805 76.9 126.1 65.2 33.1 56.8 92.3 38.2 302 164 B K S > -M 254 0D 8 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.303 26.4-115.9 -58.6 147.3 55.8 79.8 34.8 319 183 B T G >4 S+ 0 0 26 -66,-2.4 3,-0.9 1,-0.3 -65,-0.1 0.745 110.8 67.2 -59.2 -28.8 57.1 76.4 36.0 320 184 B S G 34 S+ 0 0 90 -67,-0.3 -1,-0.3 1,-0.2 -66,-0.1 0.779 95.8 55.7 -64.6 -28.3 60.6 77.8 36.6 321 185 B Y G <4 S+ 0 0 74 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.668 92.7 89.0 -77.7 -17.9 59.3 80.0 39.4 322 186 B W << - 0 0 11 -3,-0.9 2,-0.3 -4,-0.5 -33,-0.2 -0.417 68.8-150.0 -74.4 157.6 57.9 76.9 41.2 323 187 B K E -L 288 0C 93 -35,-3.1 -35,-4.0 -2,-0.1 -2,-0.1 -0.868 18.3 -92.8-131.2 160.4 60.3 75.1 43.6 324 188 B N E > -L 287 0C 77 -2,-0.3 3,-1.7 -37,-0.2 4,-0.3 -0.239 48.5 -94.7 -71.5 165.0 60.8 71.6 44.9 325 189 B L T 3> S+ 0 0 15 -39,-0.7 4,-2.3 1,-0.3 5,-0.2 0.502 108.8 87.6 -65.4 -6.7 59.1 70.3 48.0 326 190 B T H 3> S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.891 86.3 57.0 -54.1 -40.7 62.2 71.1 50.2 327 191 B E H <> S+ 0 0 70 -3,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.918 108.3 45.1 -54.1 -48.9 60.5 74.5 50.6 328 192 B L H > S+ 0 0 0 -4,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.869 111.5 53.1 -65.3 -39.5 57.4 72.9 52.0 329 193 B R H X S+ 0 0 53 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.900 109.7 47.5 -62.7 -44.9 59.4 70.6 54.3 330 194 B I H X S+ 0 0 98 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.899 113.5 48.3 -63.3 -43.8 61.3 73.6 55.8 331 195 B A H X S+ 0 0 15 -4,-2.0 4,-2.7 -5,-0.2 5,-0.3 0.903 108.9 54.2 -61.3 -43.9 58.0 75.5 56.3 332 196 B L H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.923 114.2 40.2 -58.6 -47.6 56.4 72.5 57.9 333 197 B R H X S+ 0 0 83 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.900 116.4 50.0 -67.3 -44.5 59.2 72.1 60.5 334 198 B G H X S+ 0 0 36 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.927 114.0 42.3 -62.9 -49.8 59.6 75.9 61.1 335 199 B F H X S+ 0 0 61 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.790 110.8 58.3 -70.7 -28.5 55.9 76.6 61.7 336 200 B Y H X S+ 0 0 52 -4,-1.4 4,-1.9 -5,-0.3 -2,-0.2 0.939 109.5 44.0 -61.0 -48.1 55.6 73.4 63.8 337 201 B Q H < S+ 0 0 147 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.826 112.0 54.8 -65.4 -34.3 58.3 74.8 66.1 338 202 B S H < S+ 0 0 83 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.925 114.8 36.6 -65.3 -47.6 56.7 78.2 66.1 339 203 B F H < 0 0 81 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.704 360.0 360.0 -85.5 -20.2 53.2 77.0 67.2 340 204 B K < 0 0 180 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.862 360.0 360.0 -65.7 360.0 54.7 74.3 69.5