==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/RNA 14-JUN-11 3B0V . COMPND 2 MOLECULE: TRNA; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR F.YU,Y.TANAKA,K.YAMASHITA,A.NAKAMURA,M.YAO,I.TANAKA . 630 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27895.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 453 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 81 12.9 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 . 42 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 226 35.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.1 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 4 4 0 2 0 4 2 1 6 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 5 4 4 4 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 2 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 1 C X 0 0 125 0, 0.0 2,-0.3 0, 0.0 318,-0.1 0.000 360.0 360.0 360.0 113.5 -33.8 -35.5 -19.2 2 2 C L - 0 0 27 57,-0.0 29,-0.0 29,-0.0 84,-0.0 -0.824 360.0-119.6-114.3 153.0 -30.0 -34.8 -19.3 3 3 C D + 0 0 31 -2,-0.3 3,-0.4 1,-0.1 28,-0.2 -0.813 32.7 170.8 -93.8 105.9 -28.1 -31.7 -20.2 4 4 C P + 0 0 10 0, 0.0 218,-0.3 0, 0.0 -1,-0.1 0.446 47.6 104.6 -93.2 -1.4 -25.9 -32.6 -23.2 5 5 C R S S+ 0 0 56 216,-0.2 217,-1.1 1,-0.1 2,-0.3 0.715 91.6 6.8 -57.1 -26.3 -24.8 -29.0 -24.0 6 6 C L E +a 222 0A 0 -3,-0.4 25,-2.5 215,-0.2 2,-0.3 -0.971 67.5 159.2-161.2 140.3 -21.3 -29.4 -22.5 7 7 C S E -ab 223 31A 2 215,-1.4 217,-2.5 -2,-0.3 2,-0.7 -0.991 39.9-110.9-160.1 155.9 -19.2 -32.2 -21.1 8 8 C V E -ab 224 32A 3 23,-2.3 25,-0.7 -2,-0.3 217,-0.2 -0.854 46.9-115.8 -94.9 116.5 -15.6 -33.3 -20.4 9 9 C A - 0 0 6 215,-1.1 2,-0.4 -2,-0.7 24,-0.2 -0.039 29.6-101.1 -51.6 146.8 -14.6 -36.1 -22.7 10 10 C P - 0 0 18 0, 0.0 2,-0.4 0, 0.0 25,-0.2 -0.597 46.2-178.6 -69.0 124.3 -13.8 -39.6 -21.3 11 11 C X >> - 0 0 28 -2,-0.4 4,-2.2 22,-0.3 3,-1.7 -0.933 26.2-126.2-136.6 110.1 -10.0 -39.9 -21.2 12 12 C V T 34 S+ 0 0 84 -2,-0.4 4,-0.0 1,-0.3 25,-0.0 -0.226 98.3 10.9 -50.2 134.2 -8.2 -43.1 -20.0 13 13 C D T 34 S+ 0 0 79 1,-0.1 -1,-0.3 2,-0.0 0, 0.0 0.750 128.7 62.7 66.0 24.9 -5.7 -42.3 -17.2 14 14 C R T <4 S+ 0 0 95 -3,-1.7 2,-1.1 264,-0.0 5,-0.3 0.492 88.7 52.8-137.4 -60.1 -7.2 -38.8 -16.9 15 15 C T < + 0 0 2 -4,-2.2 20,-0.4 4,-0.1 2,-0.1 -0.304 69.2 146.3 -91.1 51.5 -10.8 -38.7 -15.9 16 16 C D S >> S- 0 0 24 -2,-1.1 4,-2.2 18,-0.1 3,-0.5 -0.358 71.7 -87.8 -76.1 169.2 -10.7 -40.8 -12.7 17 17 C R H 3> S+ 0 0 72 1,-0.2 4,-1.1 2,-0.2 37,-0.2 0.673 127.4 57.4 -57.0 -17.4 -13.0 -39.9 -9.9 18 18 C H H 3> S+ 0 0 16 2,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.937 108.8 40.4 -78.6 -50.1 -10.4 -37.5 -8.6 19 19 C F H <> S+ 0 0 2 -3,-0.5 4,-2.4 -5,-0.3 -2,-0.2 0.838 112.6 57.7 -67.3 -33.2 -10.0 -35.3 -11.7 20 20 C R H X S+ 0 0 12 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.896 105.1 50.0 -64.0 -40.8 -13.8 -35.4 -12.2 21 21 C F H X S+ 0 0 0 -4,-1.1 4,-0.9 -5,-0.2 -1,-0.2 0.877 109.3 53.4 -63.0 -37.6 -14.3 -34.0 -8.7 22 22 C L H >X S+ 0 0 1 -4,-1.5 3,-1.0 1,-0.2 4,-0.8 0.938 108.4 47.6 -62.6 -48.9 -11.8 -31.3 -9.6 23 23 C V H 3X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.3 3,-0.4 0.804 105.2 61.5 -62.2 -29.9 -13.7 -30.3 -12.8 24 24 C R H 3< S+ 0 0 9 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.760 99.1 55.4 -70.2 -24.7 -16.9 -30.3 -10.8 25 25 C Q H << S+ 0 0 34 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.744 112.4 43.5 -76.1 -25.1 -15.4 -27.5 -8.6 26 26 C V H < S+ 0 0 1 -4,-0.8 2,-0.4 -3,-0.4 213,-0.3 0.886 128.2 20.2 -84.5 -45.5 -14.8 -25.4 -11.8 27 27 C S < - 0 0 0 -4,-2.7 -1,-0.3 1,-0.1 209,-0.1 -0.992 55.9-169.1-132.9 126.2 -18.1 -26.1 -13.5 28 28 C L S S+ 0 0 90 -2,-0.4 -1,-0.1 -3,-0.2 -4,-0.1 0.833 89.8 39.8 -79.0 -34.8 -21.3 -27.3 -11.8 29 29 C G S S+ 0 0 16 2,-0.1 -23,-0.2 -22,-0.0 -1,-0.1 0.752 81.9 112.5 -91.8 -27.4 -23.3 -28.1 -15.0 30 30 C V S S- 0 0 0 -7,-0.1 2,-0.4 1,-0.1 -23,-0.3 -0.208 70.1-121.4 -54.6 132.8 -20.6 -29.7 -17.2 31 31 C R E -b 7 0A 8 -25,-2.5 -23,-2.3 -28,-0.2 2,-0.3 -0.629 26.7-146.6 -81.9 130.3 -21.4 -33.4 -17.8 32 32 C L E -bc 8 60A 2 27,-1.7 29,-2.0 -2,-0.4 2,-0.4 -0.691 8.5-159.0-101.3 149.9 -18.6 -35.8 -16.7 33 33 C Y E - c 0 61A 5 -25,-0.7 -22,-0.3 -2,-0.3 29,-0.2 -0.987 14.5-129.6-128.3 137.4 -17.6 -39.1 -18.2 34 34 C T - 0 0 4 27,-2.2 -18,-0.1 -2,-0.4 -22,-0.1 -0.207 40.7 -86.8 -70.7 170.2 -15.7 -42.0 -16.7 35 35 C E - 0 0 51 -20,-0.4 28,-0.4 -25,-0.2 2,-0.3 -0.349 62.3 -75.5 -70.6 161.0 -12.7 -43.5 -18.4 36 36 C X - 0 0 36 -3,-0.1 2,-0.6 26,-0.1 28,-0.2 -0.462 55.9-166.1 -60.6 120.5 -13.3 -46.3 -20.9 37 37 C T E -d 64 0A 17 26,-1.9 28,-1.4 -2,-0.3 53,-0.1 -0.934 14.7-132.8-119.7 111.1 -14.2 -49.3 -18.7 38 38 C V E >> -d 65 0A 44 -2,-0.6 4,-1.0 26,-0.2 3,-0.5 -0.247 15.7-127.1 -61.2 146.2 -14.2 -52.7 -20.4 39 39 C D H 3> S+ 0 0 7 26,-2.4 4,-1.5 1,-0.2 3,-0.2 0.833 107.6 57.9 -65.7 -33.9 -17.2 -54.9 -19.6 40 40 C Q H 3> S+ 0 0 75 25,-0.2 4,-1.8 1,-0.2 5,-0.4 0.801 103.0 53.8 -68.2 -29.2 -15.0 -57.9 -18.4 41 41 C A H <> S+ 0 0 39 -3,-0.5 4,-0.9 1,-0.2 -1,-0.2 0.784 109.7 48.6 -74.1 -28.0 -13.3 -55.7 -15.8 42 42 C V H < S+ 0 0 0 -4,-1.0 -2,-0.2 -3,-0.2 -1,-0.2 0.782 115.5 43.8 -79.1 -29.0 -16.8 -54.8 -14.5 43 43 C L H < S+ 0 0 34 -4,-1.5 -2,-0.2 1,-0.1 -3,-0.2 0.802 131.4 16.6 -88.0 -32.0 -17.9 -58.4 -14.3 44 44 C R H < S+ 0 0 216 -4,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.592 110.6 77.8-119.1 -18.2 -14.9 -60.1 -12.9 45 45 C G S < S- 0 0 33 -4,-0.9 2,-0.7 -5,-0.4 3,-0.1 -0.255 100.7 -65.4 -89.9 177.7 -12.8 -57.3 -11.3 46 46 C N > - 0 0 88 1,-0.2 4,-1.6 2,-0.1 -1,-0.1 -0.523 49.2-166.9 -64.9 107.1 -13.1 -55.3 -8.1 47 47 C R H >>S+ 0 0 102 -2,-0.7 4,-2.0 1,-0.2 5,-0.5 0.764 81.1 55.2 -74.5 -27.3 -16.3 -53.5 -8.8 48 48 C E H >5S+ 0 0 125 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.881 109.0 47.9 -72.4 -38.2 -16.0 -51.0 -5.9 49 49 C R H 45S+ 0 0 205 1,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.883 117.5 42.1 -67.8 -39.7 -12.6 -49.8 -7.1 50 50 C L H <5S+ 0 0 73 -4,-1.6 -2,-0.2 -9,-0.1 -3,-0.1 0.950 128.2 18.5 -73.3 -52.1 -13.8 -49.4 -10.7 51 51 C L H <5S+ 0 0 0 -4,-2.0 -3,-0.2 -5,-0.1 -2,-0.1 0.673 86.8 112.2-105.3 -22.1 -17.2 -47.8 -10.5 52 52 C A << + 0 0 26 -4,-1.1 2,-0.3 -5,-0.5 -35,-0.2 -0.354 42.7 161.7 -60.6 127.9 -17.6 -46.2 -7.0 53 53 C F - 0 0 32 29,-0.3 -2,-0.1 -2,-0.1 -35,-0.0 -0.891 39.7 -88.6-141.6 170.8 -17.7 -42.4 -7.3 54 54 C R > - 0 0 27 -2,-0.3 3,-1.3 -37,-0.2 4,-0.1 -0.564 27.9-127.9 -85.2 148.4 -18.7 -39.4 -5.3 55 55 C P G > S+ 0 0 91 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.636 105.3 69.1 -68.9 -15.6 -22.2 -37.9 -5.4 56 56 C E G 3 S+ 0 0 82 1,-0.2 -2,-0.0 3,-0.0 0, 0.0 0.741 85.1 70.7 -72.1 -22.5 -20.8 -34.5 -6.2 57 57 C E G < S+ 0 0 0 -3,-1.3 -25,-0.4 -26,-0.0 -1,-0.2 0.532 80.8 154.2 -75.8 -6.0 -19.8 -35.8 -9.6 58 58 C H < + 0 0 69 -3,-1.0 2,-0.1 -4,-0.1 26,-0.0 -0.488 49.3 51.6 -65.8 136.6 -23.4 -35.9 -10.7 59 59 C P S S+ 0 0 36 0, 0.0 -27,-1.7 0, 0.0 2,-0.3 0.487 84.5 146.9 -79.9 145.1 -24.3 -35.8 -13.5 60 60 C I E -c 32 0A 0 -29,-0.2 25,-1.8 23,-0.2 26,-0.7 -0.998 32.7-150.1-147.7 142.8 -21.9 -38.5 -14.6 61 61 C A E -ce 33 86A 0 -29,-2.0 -27,-2.2 -2,-0.3 2,-0.6 -0.955 11.9-138.3-122.0 129.0 -22.0 -41.3 -17.2 62 62 C L E - e 0 87A 0 24,-2.0 26,-1.2 -2,-0.4 2,-0.5 -0.746 19.0-153.6 -84.3 117.2 -20.3 -44.7 -17.1 63 63 C Q E - e 0 88A 3 -2,-0.6 -26,-1.9 -28,-0.4 2,-0.3 -0.805 12.3-165.1 -94.1 127.7 -18.7 -45.5 -20.5 64 64 C L E -de 37 89A 0 24,-2.4 26,-2.6 -2,-0.5 2,-0.4 -0.847 8.3-153.7-114.3 148.5 -18.4 -49.3 -21.3 65 65 C A E +d 38 0A 0 -28,-1.4 -26,-2.4 -2,-0.3 2,-0.3 -0.952 37.4 106.9-119.6 141.0 -16.4 -51.1 -23.9 66 66 C G - 0 0 2 24,-0.4 38,-0.4 -2,-0.4 51,-0.0 -0.990 49.4-140.2 174.4-177.9 -17.3 -54.5 -25.3 67 67 C S S S+ 0 0 31 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.514 74.7 87.1-138.1 -32.4 -18.6 -56.7 -28.1 68 68 C D > - 0 0 65 1,-0.1 4,-1.9 2,-0.0 3,-0.3 -0.688 65.3-148.9 -80.6 119.8 -20.7 -59.4 -26.5 69 69 C P H > S+ 0 0 16 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.880 96.0 48.1 -53.8 -46.2 -24.3 -58.1 -26.1 70 70 C K H > S+ 0 0 167 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.823 111.0 51.5 -67.9 -32.2 -25.1 -60.2 -23.0 71 71 C S H > S+ 0 0 19 -3,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.846 111.3 46.3 -73.6 -35.1 -21.8 -59.1 -21.3 72 72 C L H X S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.741 109.6 54.8 -78.9 -24.9 -22.5 -55.4 -21.9 73 73 C A H X S+ 0 0 14 -4,-1.5 4,-1.2 -5,-0.2 -2,-0.2 0.828 110.9 45.2 -75.4 -33.3 -26.0 -55.7 -20.7 74 74 C E H X S+ 0 0 70 -4,-1.3 4,-1.2 2,-0.2 -2,-0.2 0.821 113.5 50.2 -75.8 -33.1 -24.8 -57.2 -17.4 75 75 C A H X S+ 0 0 0 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.780 110.6 49.2 -76.0 -28.3 -22.1 -54.5 -17.2 76 76 C A H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.793 107.5 55.3 -78.6 -30.4 -24.7 -51.8 -17.8 77 77 C R H X S+ 0 0 133 -4,-1.2 4,-0.8 2,-0.2 -2,-0.2 0.836 110.8 45.8 -68.2 -33.6 -26.9 -53.3 -15.1 78 78 C I H X S+ 0 0 13 -4,-1.2 4,-1.3 2,-0.2 -2,-0.2 0.876 111.1 50.9 -77.2 -40.3 -24.0 -53.1 -12.7 79 79 C G H <>S+ 0 0 0 -4,-1.7 5,-1.4 1,-0.2 4,-0.4 0.896 105.5 56.3 -64.2 -41.2 -23.1 -49.5 -13.6 80 80 C E H ><5S+ 0 0 60 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.831 103.5 56.0 -59.7 -33.4 -26.6 -48.3 -13.2 81 81 C A H 3<5S+ 0 0 82 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.2 0.876 96.8 60.7 -69.6 -38.7 -26.6 -49.6 -9.6 82 82 C F T 3<5S- 0 0 54 -4,-1.3 -29,-0.3 -3,-0.3 -1,-0.3 0.601 126.0-104.0 -66.0 -9.5 -23.5 -47.6 -8.7 83 83 C G T < 5 + 0 0 30 -3,-0.8 -3,-0.2 -4,-0.4 -23,-0.2 0.496 61.5 163.3 105.0 7.1 -25.8 -44.7 -9.5 84 84 C Y < - 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0 0 13 -5,-2.2 -1,-0.3 -6,-0.2 5,-0.1 -0.740 57.2-118.6 -87.2 119.0 -6.0 -42.5 -0.9 271 271 C P >> - 0 0 81 0, 0.0 3,-1.3 0, 0.0 4,-0.6 -0.308 20.1-129.9 -52.9 133.8 -2.5 -42.0 -2.2 272 272 C P H >> S+ 0 0 45 0, 0.0 4,-1.9 0, 0.0 3,-0.5 0.757 106.1 57.1 -61.7 -25.8 -1.7 -38.3 -2.2 273 273 C W H 3> S+ 0 0 62 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.695 92.4 68.8 -79.7 -20.0 -0.4 -38.4 -5.8 274 274 C A H <4 S+ 0 0 25 -3,-1.3 -1,-0.2 1,-0.2 -256,-0.1 0.788 115.0 27.9 -65.8 -27.2 -3.7 -39.9 -7.0 275 275 C V H X< S+ 0 0 1 -4,-0.6 3,-0.7 -3,-0.5 -2,-0.2 0.735 120.6 53.3-102.2 -32.2 -5.3 -36.5 -6.3 276 276 C L H >< S+ 0 0 0 -4,-1.9 3,-1.1 1,-0.2 -3,-0.2 0.734 95.9 65.9 -80.4 -23.8 -2.3 -34.2 -6.7 277 277 C R T 3< S+ 0 0 60 -4,-1.7 -1,-0.2 1,-0.2 -3,-0.1 0.528 102.7 50.0 -78.4 -4.0 -1.3 -35.4 -10.2 278 278 C H T < S+ 0 0 4 -3,-0.7 -1,-0.2 1,-0.1 3,-0.2 0.362 101.6 61.7-110.1 0.8 -4.5 -33.9 -11.5 279 279 C X S X S+ 0 0 0 -3,-1.1 3,-1.1 1,-0.1 4,-0.2 0.293 75.0 94.1-106.4 6.7 -4.1 -30.5 -9.9 280 280 C L T 3 S+ 0 0 19 1,-0.2 3,-0.5 -4,-0.2 -1,-0.1 0.768 83.9 50.5 -72.5 -26.0 -0.9 -29.6 -11.7 281 281 C N T > S+ 0 0 14 1,-0.2 3,-1.3 -3,-0.2 -48,-0.3 0.263 78.4 100.5 -96.4 11.0 -2.7 -27.7 -14.5 282 282 C L T < S+ 0 0 0 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.810 94.9 31.6 -66.1 -29.7 -4.8 -25.6 -12.1 283 283 C F T > S+ 0 0 14 -3,-0.5 3,-1.5 -4,-0.2 2,-0.3 -0.151 83.8 151.3-120.4 36.9 -2.4 -22.7 -12.7 284 284 C R T < S+ 0 0 105 -3,-1.3 -51,-0.1 1,-0.3 -3,-0.1 -0.543 76.4 8.3 -68.6 128.3 -1.4 -23.4 -16.3 285 285 C G T 3 S+ 0 0 81 -2,-0.3 -1,-0.3 1,-0.3 -4,-0.0 0.726 108.4 117.5 71.8 22.1 -0.5 -20.2 -18.0 286 286 C R S X S- 0 0 124 -3,-1.5 3,-1.9 1,-0.1 -1,-0.3 -0.831 77.5 -75.8-118.2 158.1 -0.7 -18.2 -14.7 287 287 C P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 28,-0.1 -0.256 116.6 0.2 -51.8 129.5 1.9 -16.3 -12.8 288 288 C K T 3> S+ 0 0 127 1,-0.1 4,-1.2 3,-0.1 5,-0.1 0.771 86.9 140.4 60.6 28.0 4.3 -18.6 -10.9 289 289 C G H <> + 0 0 12 -3,-1.9 4,-2.1 1,-0.2 5,-0.2 0.850 64.4 61.5 -68.0 -35.6 2.5 -21.6 -12.3 290 290 C R H > S+ 0 0 199 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.929 104.4 46.2 -53.3 -51.2 5.8 -23.4 -12.8 291 291 C L H > S+ 0 0 76 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.806 110.5 53.9 -67.7 -30.3 6.6 -23.3 -9.1 292 292 C W H X S+ 0 0 0 -4,-1.2 4,-1.2 2,-0.2 -1,-0.2 0.891 112.5 43.9 -66.3 -39.9 3.1 -24.5 -8.2 293 293 C R H X S+ 0 0 60 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.761 113.8 50.9 -77.8 -27.5 3.5 -27.5 -10.5 294 294 C R H X S+ 0 0 160 -4,-1.9 4,-1.2 -5,-0.2 5,-0.3 0.916 105.7 55.1 -74.3 -46.2 7.1 -28.2 -9.3 295 295 C L H X S+ 0 0 41 -4,-2.2 4,-2.1 1,-0.2 5,-0.5 0.869 112.5 41.7 -55.4 -42.7 6.1 -28.2 -5.6 296 296 C L H X S+ 0 0 0 -4,-1.2 4,-0.7 1,-0.2 -1,-0.2 0.831 113.4 51.1 -79.0 -33.5 3.4 -30.8 -6.0 297 297 C S H < S+ 0 0 40 -4,-1.2 -1,-0.2 1,-0.1 -2,-0.2 0.615 118.1 39.9 -80.1 -12.6 5.4 -33.1 -8.4 298 298 C E H < S+ 0 0 133 -4,-1.2 -2,-0.2 -3,-0.1 -3,-0.2 0.841 126.0 29.4 -99.7 -49.6 8.3 -33.1 -6.0 299 299 C G H < S- 0 0 39 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.1 0.953 74.3-170.4 -77.6 -53.8 6.7 -33.3 -2.6 300 300 C R < + 0 0 118 -4,-0.7 2,-0.3 -5,-0.5 -27,-0.2 0.961 47.3 105.5 57.8 55.6 3.6 -35.2 -3.4 301 301 C S S > S- 0 0 39 -29,-0.1 4,-1.6 1,-0.1 -1,-0.2 -0.982 82.8-109.3-156.7 161.2 2.0 -34.7 0.1 302 302 C L H > S+ 0 0 40 -2,-0.3 4,-1.4 1,-0.2 5,-0.1 0.890 119.6 53.8 -60.4 -40.6 -0.7 -32.7 1.8 303 303 C Q H > S+ 0 0 128 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.857 106.3 52.6 -63.4 -35.7 2.0 -30.6 3.6 304 304 C A H > S+ 0 0 4 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.854 107.9 50.7 -67.9 -35.9 3.6 -29.8 0.2 305 305 C L H X S+ 0 0 0 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.757 105.3 57.9 -72.4 -25.4 0.2 -28.6 -1.1 306 306 C D H X S+ 0 0 39 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.855 109.0 43.9 -72.5 -35.9 -0.1 -26.4 2.0 307 307 C R H X S+ 0 0 138 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.809 113.0 51.8 -77.5 -31.4 3.1 -24.6 1.3 308 308 C A H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.843 111.2 47.5 -73.0 -34.6 2.3 -24.2 -2.4 309 309 C L H X S+ 0 0 12 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.870 108.9 54.3 -71.5 -38.1 -1.1 -22.7 -1.5 310 310 C R H X S+ 0 0 148 -4,-1.5 4,-1.5 1,-0.2 -2,-0.2 0.866 108.6 49.2 -64.6 -36.5 0.5 -20.3 0.9 311 311 C L H X S+ 0 0 21 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.925 108.0 52.9 -68.8 -44.6 2.8 -19.1 -1.8 312 312 C X H < S+ 0 0 17 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.849 107.9 52.2 -59.7 -35.3 0.0 -18.6 -4.3 313 313 C E H < S+ 0 0 102 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.874 107.4 52.0 -67.7 -37.7 -1.8 -16.5 -1.7 314 314 C E H < 0 0 156 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.818 360.0 360.0 -66.2 -31.2 1.3 -14.3 -1.2 315 315 C E < 0 0 108 -4,-1.7 -3,-0.1 -5,-0.1 -27,-0.1 0.318 360.0 360.0 -96.4 360.0 1.4 -13.8 -5.0 316 !* 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 0.0 317 1 D X 0 0 117 0, 0.0 2,-0.3 0, 0.0 -314,-0.0 0.000 360.0 360.0 360.0 175.1 -32.4 -26.3 -19.5 318 2 D L - 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0 0 13 -5,-2.1 -1,-0.3 -6,-0.2 -2,-0.1 -0.372 59.8-116.0 -63.3 125.5 -58.3 -21.6 2.3 587 271 D P > - 0 0 83 0, 0.0 3,-1.0 0, 0.0 4,-0.4 -0.377 21.1-128.5 -58.0 138.6 -61.9 -22.2 1.5 588 272 D P T >> S+ 0 0 40 0, 0.0 4,-1.9 0, 0.0 3,-1.0 0.806 105.6 57.2 -63.1 -31.5 -62.6 -25.9 1.2 589 273 D W H 3> S+ 0 0 57 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.704 91.3 70.7 -74.7 -20.2 -64.3 -25.6 -2.2 590 274 D A H <4 S+ 0 0 27 -3,-1.0 -1,-0.3 1,-0.2 -256,-0.1 0.738 113.7 28.8 -65.7 -21.8 -61.3 -23.9 -3.7 591 275 D V H X4 S+ 0 0 1 -3,-1.0 3,-0.8 -4,-0.4 -2,-0.2 0.719 118.8 54.9-105.2 -32.7 -59.6 -27.3 -3.5 592 276 D L H >< S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 4,-0.4 0.747 94.5 66.3 -78.8 -25.3 -62.6 -29.6 -3.9 593 277 D R T 3< S+ 0 0 65 -4,-1.8 -1,-0.2 1,-0.3 -3,-0.1 0.542 103.1 49.3 -76.5 -4.8 -63.9 -28.2 -7.1 594 278 D H T < S+ 0 0 2 -3,-0.8 -1,-0.3 -5,-0.1 3,-0.2 0.442 103.9 59.0-107.5 -5.7 -60.8 -29.4 -8.9 595 279 D X S X S+ 0 0 0 -3,-1.0 3,-1.6 -4,-0.2 4,-0.2 0.419 77.5 92.8 -99.5 -2.0 -61.0 -33.0 -7.4 596 280 D L G > S+ 0 0 20 -4,-0.4 3,-0.5 1,-0.3 -1,-0.1 0.814 86.5 48.8 -62.3 -30.8 -64.5 -33.6 -8.9 597 281 D N G > S+ 0 0 13 -3,-0.2 3,-1.3 1,-0.2 -48,-0.3 0.214 77.5 103.6 -96.5 14.4 -62.9 -35.2 -12.0 598 282 D L G < S+ 0 0 0 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.726 93.5 33.3 -68.3 -21.5 -60.6 -37.5 -10.0 599 283 D F G X S+ 0 0 14 -3,-0.5 3,-1.5 -4,-0.2 2,-0.4 -0.223 81.9 159.5-127.0 42.7 -62.9 -40.4 -10.8 600 284 D R T < S+ 0 0 103 -3,-1.3 -3,-0.1 1,-0.3 -51,-0.1 -0.544 76.2 3.0 -69.5 120.3 -64.2 -39.4 -14.2 601 285 D G T 3 S+ 0 0 82 -2,-0.4 -1,-0.3 1,-0.3 -4,-0.0 0.792 107.0 122.0 74.4 29.2 -65.6 -42.5 -16.0 602 286 D R S X S- 0 0 123 -3,-1.5 3,-2.0 1,-0.1 4,-0.3 -0.815 73.7 -76.4-119.2 161.4 -65.0 -44.7 -13.0 603 287 D P T 3 S+ 0 0 91 0, 0.0 28,-0.1 0, 0.0 -1,-0.1 -0.319 118.3 2.3 -55.2 131.1 -67.3 -47.0 -10.9 604 288 D K T 3> S+ 0 0 110 1,-0.1 4,-1.2 3,-0.1 5,-0.1 0.741 91.2 135.0 61.0 24.2 -69.3 -44.9 -8.4 605 289 D G H <> + 0 0 8 -3,-2.0 4,-2.4 2,-0.2 5,-0.2 0.901 64.0 58.5 -68.7 -43.2 -67.8 -41.8 -9.9 606 290 D R H > S+ 0 0 188 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.929 106.9 46.7 -47.6 -53.2 -71.1 -40.0 -10.1 607 291 D L H > S+ 0 0 79 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.788 110.2 54.2 -66.7 -28.6 -71.6 -40.4 -6.3 608 292 D W H X S+ 0 0 0 -4,-1.2 4,-1.4 -3,-0.2 -1,-0.2 0.922 112.6 42.4 -67.1 -45.2 -68.0 -39.2 -5.7 609 293 D R H X S+ 0 0 62 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.776 114.9 51.6 -73.2 -28.5 -68.6 -36.0 -7.7 610 294 D R H X S+ 0 0 149 -4,-2.0 4,-0.9 -5,-0.2 5,-0.2 0.900 106.1 53.9 -74.3 -43.2 -72.1 -35.5 -6.2 611 295 D L H X>S+ 0 0 32 -4,-2.0 4,-2.3 1,-0.2 5,-0.5 0.893 110.8 44.3 -59.0 -45.0 -70.8 -35.8 -2.6 612 296 D L H X5S+ 0 0 0 -4,-1.4 4,-0.9 1,-0.2 -1,-0.2 0.826 115.0 47.3 -74.4 -32.5 -68.1 -33.1 -2.9 613 297 D S H <5S+ 0 0 37 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.560 116.5 45.9 -84.6 -9.0 -70.3 -30.7 -4.8 614 298 D E H <5S+ 0 0 132 -4,-0.9 -2,-0.2 -3,-0.3 -3,-0.2 0.823 125.8 24.3 -99.5 -43.2 -73.2 -31.2 -2.3 615 299 D G H <5S- 0 0 34 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.1 0.871 79.2-165.0 -90.1 -44.8 -71.4 -31.0 1.1 616 300 D R << + 0 0 122 -4,-0.9 2,-0.3 -5,-0.5 -27,-0.2 0.979 48.8 97.1 54.2 67.3 -68.3 -28.9 0.1 617 301 D S S > S- 0 0 30 -29,-0.2 4,-2.0 1,-0.1 -1,-0.2 -0.975 86.8-102.8-170.1 163.0 -66.2 -29.6 3.1 618 302 D L H > S+ 0 0 39 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.887 121.8 58.1 -61.0 -39.5 -63.4 -31.8 4.5 619 303 D Q H > S+ 0 0 134 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.871 107.2 47.5 -56.9 -38.8 -66.1 -33.8 6.3 620 304 D A H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.880 107.4 54.4 -71.9 -39.9 -67.7 -34.5 3.0 621 305 D L H X S+ 0 0 0 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.817 105.5 55.7 -63.7 -30.7 -64.4 -35.6 1.3 622 306 D D H X S+ 0 0 31 -4,-1.8 4,-1.7 2,-0.2 3,-0.3 0.933 106.5 48.7 -66.6 -46.6 -64.0 -38.1 4.1 623 307 D R H X S+ 0 0 99 -4,-1.5 4,-1.3 1,-0.2 -2,-0.2 0.886 110.4 51.9 -59.1 -40.2 -67.3 -39.7 3.5 624 308 D A H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.785 107.6 53.4 -68.4 -27.5 -66.5 -39.9 -0.2 625 309 D L H X S+ 0 0 21 -4,-1.2 4,-1.7 -3,-0.3 -1,-0.2 0.830 107.5 48.7 -77.2 -34.1 -63.2 -41.6 0.6 626 310 D R H X S+ 0 0 141 -4,-1.7 4,-0.9 2,-0.2 -2,-0.2 0.720 111.1 51.5 -79.8 -21.6 -64.8 -44.3 2.7 627 311 D L H X S+ 0 0 27 -4,-1.3 4,-1.7 -5,-0.2 -2,-0.2 0.909 110.2 48.5 -74.7 -45.2 -67.3 -45.0 -0.0 628 312 D X H < S+ 0 0 13 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.1 0.891 108.6 52.7 -63.0 -41.9 -64.6 -45.4 -2.7 629 313 D E H < S+ 0 0 118 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.858 109.0 51.1 -63.0 -34.8 -62.5 -47.7 -0.6 630 314 D E H < 0 0 148 -4,-0.9 -1,-0.2 -5,-0.1 -2,-0.2 0.851 360.0 360.0 -68.6 -35.1 -65.6 -49.9 -0.1 631 315 D E < 0 0 136 -4,-1.7 -3,-0.1 -28,-0.1 -27,-0.1 0.037 360.0 360.0-102.7 360.0 -66.1 -49.9 -3.9