==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 26-FEB-12 4DWQ . COMPND 2 MOLECULE: TRNA-SPLICING LIGASE RTCB; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR C.OKADA,S.XIA,M.ENGLERT,M.YAO,D.SOLL,J.WANG . 962 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33348.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 705 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 177 18.4 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 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 . 64 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 115 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 258 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.0 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 2 0 8 4 3 1 2 4 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 2 0 2 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 . 7 4 4 4 6 4 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 0 2 2 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 1 A M 0 0 102 0, 0.0 2,-0.5 0, 0.0 44,-0.1 0.000 360.0 360.0 360.0 98.9 -6.4 -9.1 -17.6 2 2 A V - 0 0 134 42,-0.0 0, 0.0 43,-0.0 0, 0.0 -0.921 360.0-131.4 -97.4 134.6 -8.1 -7.8 -14.4 3 3 A V - 0 0 21 -2,-0.5 2,-0.1 36,-0.1 42,-0.1 -0.772 10.9-146.5-102.7 112.3 -7.0 -4.2 -13.9 4 4 A P - 0 0 52 0, 0.0 2,-0.4 0, 0.0 14,-0.1 -0.419 17.5-154.1 -70.9 146.0 -5.8 -3.0 -10.5 5 5 A L - 0 0 40 10,-0.2 2,-0.5 -2,-0.1 10,-0.2 -0.975 16.6-165.5-125.1 139.9 -6.6 0.6 -9.5 6 6 A K E -A 14 0A 138 8,-3.0 8,-2.3 -2,-0.4 2,-0.2 -0.943 23.7-140.7-117.9 104.6 -4.9 3.2 -7.1 7 7 A R E -A 13 0A 109 -2,-0.5 6,-0.3 6,-0.2 3,-0.1 -0.480 16.6-173.0 -67.6 130.9 -7.2 6.1 -6.5 8 8 A I - 0 0 77 4,-2.5 2,-0.2 1,-0.3 5,-0.2 0.815 66.0 -31.9 -92.1 -42.5 -5.2 9.4 -6.4 9 9 A D S S- 0 0 56 3,-1.8 -1,-0.3 0, 0.0 3,-0.3 -0.877 86.6 -60.7-156.9-163.5 -8.1 11.6 -5.3 10 10 A K S S+ 0 0 160 -2,-0.2 22,-0.2 1,-0.2 3,-0.0 0.797 134.1 19.4 -61.4 -28.4 -11.9 11.8 -5.6 11 11 A I S S+ 0 0 6 20,-0.1 19,-2.4 452,-0.1 2,-0.4 0.387 112.8 76.6-124.9 -0.2 -11.8 12.2 -9.4 12 12 A R E - B 0 29A 38 -3,-0.3 -4,-2.5 17,-0.2 -3,-1.8 -0.947 51.7-178.9-119.2 137.2 -8.3 10.8 -10.4 13 13 A W E -AB 7 28A 24 15,-2.4 15,-2.8 -2,-0.4 2,-0.4 -0.972 13.4-147.8-133.9 147.3 -7.3 7.2 -10.6 14 14 A E E -AB 6 27A 64 -8,-2.3 -8,-3.0 -2,-0.4 13,-0.2 -0.935 6.7-152.9-115.4 134.5 -4.0 5.5 -11.5 15 15 A I E - B 0 26A 0 11,-1.9 11,-2.3 -2,-0.4 -10,-0.2 -0.951 32.4-141.2 -94.0 108.3 -3.5 2.2 -13.2 16 16 A P - 0 0 37 0, 0.0 2,-2.5 0, 0.0 3,-0.3 -0.250 28.2 -91.7 -68.2 164.1 -0.1 1.2 -11.8 17 17 A K + 0 0 123 1,-0.2 31,-0.0 6,-0.1 3,-0.0 -0.477 68.7 147.2 -73.0 72.7 2.5 -0.5 -14.0 18 18 A F + 0 0 78 -2,-2.5 2,-0.5 -14,-0.1 -1,-0.2 0.619 57.8 65.3 -86.0 -13.9 1.2 -4.0 -13.0 19 19 A D S > S- 0 0 26 -3,-0.3 3,-2.4 1,-0.1 -1,-0.1 -0.957 82.3-136.6-116.0 126.1 2.1 -5.3 -16.4 20 20 A K T 3 S+ 0 0 206 -2,-0.5 -1,-0.1 1,-0.3 -3,-0.0 0.667 100.6 64.8 -58.4 -19.1 5.8 -5.4 -17.4 21 21 A R T 3 S+ 0 0 111 2,-0.0 -1,-0.3 -3,-0.0 2,-0.1 0.727 78.2 102.6 -73.5 -23.4 5.0 -4.1 -20.9 22 22 A M < - 0 0 10 -3,-2.4 30,-0.3 1,-0.2 27,-0.1 -0.392 48.7-171.2 -66.6 133.8 3.7 -0.7 -19.6 23 23 A R S S+ 0 0 129 28,-3.1 -1,-0.2 1,-0.2 29,-0.2 0.626 76.6 12.2 -96.0 -17.5 6.1 2.2 -20.0 24 24 A V S S- 0 0 17 27,-0.8 35,-0.2 33,-0.1 -1,-0.2 -0.910 86.7 -99.6-146.4 164.5 3.9 4.5 -18.0 25 25 A P - 0 0 25 0, 0.0 35,-1.5 0, 0.0 2,-0.3 -0.278 39.0-106.8 -76.3 174.6 0.9 4.2 -15.7 26 26 A G E -Bc 15 60A 0 -11,-2.3 -11,-1.9 33,-0.2 2,-0.4 -0.737 25.7-154.2 -93.2 154.1 -2.7 4.8 -16.8 27 27 A R E -Bc 14 61A 34 33,-3.0 35,-2.5 -2,-0.3 2,-0.4 -0.991 9.9-170.6-132.1 123.4 -4.5 7.9 -15.6 28 28 A V E -Bc 13 62A 0 -15,-2.8 -15,-2.4 -2,-0.4 2,-0.7 -0.956 13.6-152.3-118.6 130.5 -8.4 7.9 -15.3 29 29 A Y E +B 12 0A 0 33,-2.9 2,-0.3 -2,-0.4 37,-0.3 -0.909 51.3 105.8-101.0 111.3 -10.6 11.0 -14.7 30 30 A A - 0 0 0 -19,-2.4 2,-0.1 -2,-0.7 -2,-0.1 -0.929 61.2-121.3-175.9 147.8 -13.7 9.8 -13.0 31 31 A D > - 0 0 13 -2,-0.3 4,-2.6 33,-0.1 5,-0.2 -0.323 54.7 -87.8 -84.2-175.7 -15.6 9.6 -9.7 32 32 A E H > S+ 0 0 101 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.777 127.4 53.6 -70.0 -27.3 -16.6 6.1 -8.4 33 33 A V H > S+ 0 0 72 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.967 113.4 40.8 -71.5 -52.7 -19.9 6.1 -10.3 34 34 A L H > S+ 0 0 10 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.919 115.1 53.8 -59.2 -41.5 -18.2 6.8 -13.7 35 35 A L H >X S+ 0 0 3 -4,-2.6 4,-0.8 1,-0.2 3,-0.6 0.914 100.7 58.5 -62.1 -43.4 -15.3 4.5 -12.9 36 36 A E H >X S+ 0 0 107 -4,-1.8 3,-1.0 1,-0.3 4,-0.5 0.890 104.4 52.1 -57.5 -40.1 -17.6 1.5 -12.0 37 37 A K H >< S+ 0 0 103 -4,-1.4 3,-0.9 1,-0.2 4,-0.5 0.830 102.3 58.5 -63.5 -34.3 -19.1 1.6 -15.6 38 38 A M H << S+ 0 0 2 -4,-1.3 6,-0.8 -3,-0.6 5,-0.3 0.666 99.5 61.2 -67.0 -16.6 -15.6 1.6 -17.2 39 39 A K H << S+ 0 0 103 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 0.708 93.7 63.6 -80.6 -23.3 -15.0 -1.7 -15.3 40 40 A N S << S+ 0 0 131 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.644 110.3 31.8 -79.2 -20.0 -17.9 -3.4 -17.2 41 41 A D S S- 0 0 44 -4,-0.5 3,-0.3 -3,-0.2 4,-0.2 -0.408 105.0 -84.8-117.3-158.0 -16.3 -3.1 -20.6 42 42 A R S > S+ 0 0 146 1,-0.2 4,-2.7 -2,-0.2 3,-0.4 0.301 84.3 119.1 -99.1 17.5 -12.7 -3.2 -21.7 43 43 A T H > S+ 0 0 0 -5,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.881 78.1 41.8 -42.5 -54.8 -11.9 0.5 -21.1 44 44 A L H > S+ 0 0 6 -6,-0.8 4,-1.9 -3,-0.3 -1,-0.2 0.824 113.3 52.8 -73.4 -30.2 -9.2 0.0 -18.4 45 45 A E H > S+ 0 0 44 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.910 109.0 50.6 -68.4 -43.6 -7.6 -2.9 -20.3 46 46 A Q H X S+ 0 0 10 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.891 109.6 49.5 -59.9 -43.7 -7.4 -0.7 -23.5 47 47 A A H X S+ 0 0 2 -4,-2.0 4,-1.8 -5,-0.3 -1,-0.2 0.884 109.5 53.3 -67.2 -35.4 -5.8 2.2 -21.5 48 48 A T H < S+ 0 0 0 -4,-1.9 -2,-0.2 2,-0.2 4,-0.2 0.945 109.9 47.9 -57.4 -47.4 -3.3 -0.4 -20.1 49 49 A N H >< S+ 0 0 17 -4,-2.5 3,-2.2 1,-0.2 4,-0.4 0.915 107.1 55.3 -60.9 -43.6 -2.5 -1.4 -23.7 50 50 A V H >< S+ 0 0 2 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.893 98.4 63.8 -58.3 -37.9 -2.1 2.2 -24.7 51 51 A A T 3< S+ 0 0 0 -4,-1.8 -28,-3.1 1,-0.3 -27,-0.8 0.536 95.1 61.5 -65.8 -7.2 0.5 2.6 -21.9 52 52 A M T < S+ 0 0 0 -3,-2.2 -1,-0.3 -30,-0.3 -2,-0.2 0.549 77.9 109.0 -91.1 -12.1 2.7 -0.1 -23.7 53 53 A L S X S- 0 0 0 -3,-1.9 3,-1.1 -4,-0.4 -30,-0.1 -0.467 77.1-101.6 -78.4 140.3 3.2 2.0 -26.9 54 54 A P T 3 S+ 0 0 15 0, 0.0 32,-0.9 0, 0.0 -1,-0.1 -0.228 97.7 17.6 -64.4 141.7 6.7 3.5 -27.6 55 55 A G T 3 S+ 0 0 22 1,-0.3 26,-2.6 30,-0.2 30,-0.2 0.454 82.3 151.2 83.3 2.7 7.5 7.1 -26.9 56 56 A I B < -D 80 0A 14 -3,-1.1 2,-0.4 24,-0.2 -1,-0.3 -0.417 34.6-142.5 -66.3 137.2 4.5 7.7 -24.7 57 57 A Y - 0 0 45 22,-2.2 2,-2.4 2,-0.2 22,-0.4 -0.872 58.3 -26.5-106.0 141.1 4.9 10.5 -22.0 58 58 A K S S- 0 0 85 -2,-0.4 2,-0.3 -35,-0.1 -2,-0.1 -0.299 114.0 -29.1 68.8 -65.4 3.5 10.5 -18.4 59 59 A Y - 0 0 18 -2,-2.4 2,-0.4 -35,-0.2 20,-0.3 -0.949 57.6 -99.2-171.0 156.7 0.5 8.2 -18.7 60 60 A S E -c 26 0A 3 -35,-1.5 -33,-3.0 -2,-0.3 2,-0.4 -0.741 49.8-139.9 -82.1 144.6 -2.3 7.0 -21.0 61 61 A I E -cE 27 77A 3 16,-2.7 16,-2.0 -2,-0.4 2,-0.5 -0.883 21.8-169.8-119.4 133.5 -5.4 9.0 -20.2 62 62 A V E -cE 28 76A 0 -35,-2.5 -33,-2.9 -2,-0.4 14,-0.2 -0.991 19.1-148.1-116.4 122.6 -9.1 8.1 -19.9 63 63 A M E > - 0 0 0 12,-3.8 3,-2.4 -2,-0.5 339,-0.0 -0.331 33.5 -96.5 -81.8 168.3 -11.5 11.0 -19.7 64 64 A P E 3 S+ 0 0 0 0, 0.0 -33,-0.1 0, 0.0 -1,-0.1 0.743 124.6 55.9 -67.3 -20.0 -14.7 10.8 -17.7 65 65 A D E 3 S+ 0 0 0 287,-0.2 343,-0.1 10,-0.1 387,-0.1 0.314 85.6 143.3 -84.1 10.1 -16.8 10.0 -20.8 66 66 A G E < + 0 0 2 -3,-2.4 2,-0.3 -37,-0.3 9,-0.2 -0.107 14.2 144.9 -57.1 142.9 -14.5 7.0 -21.4 67 67 A H E - E 0 74A 31 7,-2.2 7,-2.4 -24,-0.1 9,-0.1 -0.956 53.0 -55.6-164.3 177.2 -15.7 3.6 -22.7 68 68 A Q + 0 0 73 -2,-0.3 2,-0.2 5,-0.2 4,-0.1 -0.268 59.7 155.7 -65.8 136.6 -14.6 0.8 -24.9 69 69 A G - 0 0 15 3,-0.1 2,-0.8 2,-0.1 -27,-0.1 -0.624 54.0 -55.1-133.9-159.0 -13.5 1.6 -28.5 70 70 A Y S S- 0 0 48 -2,-0.2 2,-2.0 20,-0.1 23,-0.1 -0.788 108.3 -39.9 -87.3 106.3 -11.4 0.2 -31.2 71 71 A G S S+ 0 0 2 -2,-0.8 197,-0.2 20,-0.1 -21,-0.2 -0.472 138.0 49.7 77.2 -77.2 -7.9 -0.2 -29.7 72 72 A F S S- 0 0 1 -2,-2.0 -3,-0.1 18,-0.7 2,-0.1 -0.619 99.5-106.3 -82.7 155.9 -7.8 3.0 -27.6 73 73 A P > - 0 0 2 0, 0.0 3,-1.0 0, 0.0 2,-0.3 -0.489 33.7-105.7 -75.3 156.0 -10.8 3.7 -25.5 74 74 A I E 3 S+E 67 0A 44 -7,-2.4 -7,-2.2 1,-0.2 278,-0.2 -0.664 115.4 40.9 -69.1 139.1 -13.3 6.4 -26.6 75 75 A G E 3 S+ 0 0 0 276,-2.3 -12,-3.8 1,-0.3 2,-0.3 0.591 94.8 136.2 89.6 14.4 -12.5 9.2 -24.2 76 76 A G E < -EF 62 351A 1 275,-1.3 275,-2.4 -3,-1.0 2,-0.4 -0.709 33.6-176.3-107.5 149.6 -8.7 8.5 -24.5 77 77 A V E +EF 61 350A 2 -16,-2.0 -16,-2.7 -2,-0.3 2,-0.3 -0.994 7.5 168.1-138.1 133.5 -5.7 10.8 -24.9 78 78 A A E - F 0 349A 0 271,-1.7 271,-3.2 -2,-0.4 2,-0.5 -0.956 17.3-154.9-147.7 137.9 -2.1 9.7 -25.3 79 79 A A E - F 0 348A 0 -22,-0.4 -22,-2.2 -20,-0.3 2,-0.4 -0.952 12.2-171.2-115.6 125.3 0.9 11.8 -26.3 80 80 A F E -DF 56 347A 0 267,-2.1 267,-3.1 -2,-0.5 -24,-0.2 -0.888 35.0 -96.5-117.6 144.6 3.9 10.3 -28.0 81 81 A D E > - F 0 346A 23 -26,-2.6 4,-2.0 -2,-0.4 265,-0.3 -0.293 30.6-133.2 -53.9 133.8 7.2 11.9 -28.8 82 82 A V T 4 S+ 0 0 23 263,-2.5 -1,-0.1 2,-0.2 264,-0.1 0.776 103.5 34.5 -64.5 -24.6 7.3 13.1 -32.4 83 83 A K T 4 S+ 0 0 156 262,-0.3 191,-0.3 190,-0.1 -1,-0.2 0.900 132.6 24.8 -94.7 -48.8 10.7 11.5 -33.0 84 84 A E T 4 S+ 0 0 136 -29,-0.1 -2,-0.2 189,-0.1 2,-0.1 0.380 108.4 84.7-102.9 3.1 10.6 8.4 -30.9 85 85 A G < - 0 0 1 -4,-2.0 188,-2.8 -30,-0.2 189,-0.4 -0.386 66.8-118.9-103.2 179.7 6.9 7.7 -30.7 86 86 A V E -H 272 0B 2 -32,-0.9 2,-0.4 186,-0.3 -6,-0.2 -0.611 7.5-137.2-112.0 168.8 4.1 6.1 -32.7 87 87 A I E -H 271 0B 0 184,-2.3 184,-1.6 -2,-0.2 3,-0.1 -1.000 19.3-169.5-126.1 132.0 0.9 7.0 -34.5 88 88 A S > - 0 0 0 -2,-0.4 3,-2.4 182,-0.2 4,-0.3 -0.970 20.4-152.2-126.6 115.0 -2.0 4.7 -34.1 89 89 A P G >> S+ 0 0 1 0, 0.0 4,-3.1 0, 0.0 3,-1.3 0.818 100.8 61.3 -52.6 -33.6 -5.2 5.1 -36.3 90 90 A G G 34 S+ 0 0 3 179,-0.5 -18,-0.7 1,-0.3 -20,-0.1 0.666 97.2 58.6 -66.7 -19.3 -7.2 3.5 -33.4 91 91 A G G <4 S+ 0 0 0 -3,-2.4 240,-0.3 -20,-0.1 -1,-0.3 0.490 115.5 35.3 -84.3 -4.1 -6.0 6.4 -31.1 92 92 A I T <4 S- 0 0 0 -3,-1.3 260,-0.2 -4,-0.3 -2,-0.2 0.726 107.9-135.1-117.6 -43.5 -7.7 8.8 -33.5 93 93 A G < - 0 0 6 -4,-3.1 3,-0.2 1,-0.1 -2,-0.1 -0.186 19.6 -82.9 110.4 162.1 -10.8 6.9 -34.6 94 94 A Y S S+ 0 0 56 1,-0.2 2,-1.9 -4,-0.1 151,-0.3 0.943 117.8 59.7 -67.9 -47.8 -12.8 6.0 -37.6 95 95 A D S > S- 0 0 19 146,-0.1 3,-1.8 147,-0.1 -1,-0.2 -0.507 85.9-159.8 -84.5 75.2 -14.9 9.2 -37.6 96 96 A I T 3 S+ 0 0 0 -2,-1.9 141,-0.5 1,-0.3 235,-0.2 -0.318 71.0 3.7 -63.3 130.9 -11.9 11.5 -38.1 97 97 A N T 3 S+ 0 0 0 233,-3.5 2,-0.3 1,-0.2 -1,-0.3 0.851 76.2 168.3 49.4 38.2 -12.6 15.1 -37.0 98 98 A C < + 0 0 3 -3,-1.8 231,-3.0 138,-0.2 232,-0.7 -0.631 28.7 159.3 -56.8 136.2 -16.0 14.3 -35.8 99 99 A G E -IJ 235 328C 0 136,-1.4 136,-1.6 -2,-0.3 2,-0.4 -0.962 41.1-114.5-163.7 174.6 -16.5 17.6 -34.1 100 100 A V E -IJ 234 327C 0 227,-2.5 227,-2.3 -2,-0.3 2,-0.4 -0.975 18.4-170.1-130.5 132.2 -18.8 20.2 -32.6 101 101 A R E -IJ 233 326C 0 132,-2.5 132,-2.8 -2,-0.4 2,-0.5 -0.984 8.2-155.5-123.7 139.7 -19.5 23.8 -33.8 102 102 A L E -IJ 232 325C 0 223,-2.4 222,-3.1 -2,-0.4 223,-0.8 -0.957 6.0-166.7-115.7 124.6 -21.5 26.4 -31.8 103 103 A I E -IJ 231 323C 0 128,-3.2 128,-2.4 -2,-0.5 220,-0.2 -0.952 12.1-148.3-112.6 131.3 -23.2 29.3 -33.6 104 104 A R - 0 0 38 218,-2.8 2,-0.3 -2,-0.5 126,-0.2 -0.490 13.3-166.9 -93.8 164.3 -24.5 32.2 -31.5 105 105 A T - 0 0 0 124,-0.5 215,-0.2 118,-0.2 124,-0.1 -0.960 33.5-123.9-141.9 169.9 -27.5 34.4 -32.3 106 106 A N S S+ 0 0 70 213,-1.9 2,-0.2 -2,-0.3 214,-0.1 0.264 81.2 104.3 -89.7 9.7 -29.2 37.6 -31.2 107 107 A L - 0 0 5 122,-0.4 122,-2.9 212,-0.2 2,-0.3 -0.630 58.3-147.5 -99.1 150.5 -32.4 35.7 -30.4 108 108 A T B >> -Q 228 0D 38 120,-0.3 4,-1.2 -2,-0.2 3,-0.8 -0.722 33.1-103.0-107.7 164.1 -33.9 34.7 -27.1 109 109 A E H >> S+ 0 0 44 118,-2.1 4,-2.9 -2,-0.3 3,-1.0 0.901 120.0 56.3 -50.6 -46.8 -36.0 31.7 -26.3 110 110 A K H 34 S+ 0 0 164 1,-0.3 -1,-0.2 2,-0.2 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0 0 74 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.813 114.2 50.4 -70.9 -32.2 -23.9 10.0 -59.4 608 126 B N H < S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.688 110.0 48.7 -84.4 -17.9 -27.0 10.7 -61.5 609 127 B V S < S- 0 0 2 -4,-1.3 -1,-0.2 -5,-0.1 70,-0.1 -0.909 81.6-135.5-130.5 104.5 -29.7 9.5 -59.0 610 128 B P + 0 0 17 0, 0.0 70,-2.6 0, 0.0 2,-0.3 -0.185 33.6 170.8 -54.3 145.6 -29.5 10.7 -55.4 611 129 B S + 0 0 1 68,-0.2 71,-0.2 -479,-0.2 2,-0.1 -0.947 22.9 73.1-154.3 169.0 -30.1 7.9 -52.9 612 130 B G S > S- 0 0 0 69,-2.7 3,-1.7 -2,-0.3 69,-0.3 -0.132 88.7 -50.9 101.4 156.0 -29.9 7.4 -49.1 613 131 B V T 3 S+ 0 0 40 -482,-2.2 3,-0.1 1,-0.3 -2,-0.1 -0.440 128.7 8.4 -62.7 126.8 -32.1 8.5 -46.2 614 132 B G T 3 S+ 0 0 14 1,-0.3 2,-0.4 -2,-0.2 -1,-0.3 0.404 89.9 138.6 81.3 -4.0 -32.5 12.3 -46.5 615 133 B S < - 0 0 0 -3,-1.7 -1,-0.3 -487,-0.1 66,-0.2 -0.632 42.5-146.3 -79.3 133.0 -30.9 12.6 -49.9 616 134 B Q - 0 0 33 -2,-0.4 60,-0.3 -482,-0.4 2,-0.1 -0.478 14.7 -96.1-101.8 163.8 -32.9 15.0 -52.0 617 135 B G - 0 0 2 58,-2.1 62,-0.2 -2,-0.1 61,-0.2 -0.461 30.0-122.5 -74.9 151.8 -33.8 15.3 -55.7 618 136 B R S S+ 0 0 92 60,-0.5 -1,-0.1 -2,-0.1 60,-0.1 0.800 87.2 90.2 -60.6 -37.8 -31.7 17.7 -57.9 619 137 B I S S- 0 0 33 58,-0.3 2,-0.8 1,-0.1 -2,-0.1 -0.287 76.5-132.5 -66.4 150.3 -34.8 19.7 -58.9 620 138 B K + 0 0 143 2,-0.0 2,-0.5 0, 0.0 -1,-0.1 -0.847 40.0 156.6-109.4 89.6 -35.9 22.7 -56.9 621 139 B L - 0 0 34 -2,-0.8 2,-0.1 53,-0.3 56,-0.1 -0.983 33.6-139.6-113.4 123.4 -39.6 22.4 -56.2 622 140 B H > - 0 0 88 -2,-0.5 3,-2.6 1,-0.1 4,-0.1 -0.456 29.4-108.3 -73.3 154.3 -41.1 24.2 -53.3 623 141 B W G > S+ 0 0 70 1,-0.3 3,-0.7 2,-0.2 4,-0.1 0.759 119.8 58.4 -57.3 -24.5 -43.7 22.4 -51.3 624 142 B T G 3 S+ 0 0 80 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.337 100.5 59.8 -85.4 5.1 -46.4 24.7 -52.7 625 143 B Q G < S+ 0 0 105 -3,-2.6 -1,-0.2 1,-0.1 3,-0.2 0.214 81.0 79.5-119.5 16.6 -45.5 23.7 -56.2 626 144 B I X> + 0 0 0 -3,-0.7 4,-2.3 1,-0.1 3,-0.9 0.516 57.4 97.8-101.2 -2.5 -46.1 19.9 -56.3 627 145 B D H 3> S+ 0 0 56 1,-0.3 4,-1.8 2,-0.2 5,-0.2 0.861 85.2 54.2 -53.6 -37.3 -49.9 19.8 -56.7 628 146 B D H 3> S+ 0 0 103 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.870 107.9 49.0 -62.0 -39.1 -49.3 19.3 -60.5 629 147 B V H <> S+ 0 0 0 -3,-0.9 4,-2.4 1,-0.2 -2,-0.2 0.921 110.9 51.5 -64.6 -41.5 -47.1 16.3 -59.7 630 148 B L H < S+ 0 0 0 -4,-2.3 142,-0.2 1,-0.2 -2,-0.2 0.796 116.5 39.7 -69.5 -29.1 -49.8 14.9 -57.3 631 149 B V H < S+ 0 0 48 -4,-1.8 29,-0.2 -5,-0.2 -1,-0.2 0.888 126.4 29.6 -84.5 -44.0 -52.5 15.2 -60.0 632 150 B D H >< S- 0 0 37 -4,-2.7 3,-2.0 1,-0.2 4,-0.4 0.600 77.9-177.6-104.8 -12.3 -50.6 14.1 -63.1 633 151 B G T >X S+ 0 0 0 -4,-2.4 4,-1.4 -5,-0.3 3,-0.6 -0.212 75.7 0.7 58.9-132.4 -48.0 11.6 -61.8 634 152 B A H 3> S+ 0 0 0 21,-2.7 4,-2.8 1,-0.2 -1,-0.3 0.755 130.4 63.7 -62.8 -23.4 -45.8 10.3 -64.7 635 153 B K H <> S+ 0 0 81 -3,-2.0 4,-3.3 20,-0.4 -1,-0.2 0.929 101.1 51.7 -66.5 -42.7 -47.7 12.5 -67.2 636 154 B W H <> S+ 0 0 26 -3,-0.6 4,-1.2 -4,-0.4 -2,-0.2 0.908 110.7 47.8 -52.6 -49.3 -46.4 15.5 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1,-0.2 -1,-0.2 0.889 105.6 50.5 -58.8 -37.0 -46.4 18.3 -43.7 669 187 B A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.936 112.6 45.6 -67.9 -44.0 -46.5 15.6 -46.4 670 188 B K H X S+ 0 0 17 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.822 112.2 51.8 -65.1 -32.9 -45.8 18.1 -49.2 671 189 B Q H < S+ 0 0 59 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.825 114.9 42.9 -74.7 -33.7 -42.9 19.7 -47.2 672 190 B R H < S+ 0 0 55 -4,-1.7 49,-0.3 -5,-0.2 4,-0.3 0.896 122.3 38.5 -76.5 -42.2 -41.4 16.4 -46.6 673 191 B G H >X S+ 0 0 0 -4,-2.8 3,-1.7 48,-0.2 4,-1.1 0.873 99.1 69.2 -80.0 -43.6 -42.0 15.2 -50.2 674 192 B A G >< S+ 0 0 0 -4,-2.8 3,-0.7 1,-0.3 -53,-0.3 0.862 102.1 46.5 -50.6 -47.5 -41.3 18.2 -52.4 675 193 B P G 34 S+ 0 0 22 0, 0.0 -58,-2.1 0, 0.0 -1,-0.3 0.693 112.8 53.6 -66.6 -18.4 -37.5 18.3 -51.7 676 194 B Q G <4 S+ 0 0 24 -3,-1.7 3,-0.4 -60,-0.3 -2,-0.2 0.617 73.0 119.5 -94.8 -15.9 -37.3 14.5 -52.3 677 195 B L S << S+ 0 0 0 -4,-1.1 -58,-0.3 -3,-0.7 -56,-0.1 -0.298 77.2 31.3 -51.8 123.6 -39.0 14.3 -55.7 678 196 B G S S+ 0 0 0 1,-0.3 -60,-0.5 -61,-0.2 2,-0.3 0.835 98.7 101.6 90.7 40.4 -36.3 12.7 -58.0 679 197 B S - 0 0 0 -3,-0.4 -1,-0.3 -62,-0.2 -68,-0.2 -0.983 67.0-131.8-150.6 155.5 -34.4 10.5 -55.6 680 198 B L - 0 0 2 -70,-2.6 38,-0.3 -2,-0.3 -69,-0.2 0.733 35.0-162.0 -78.4 -30.0 -34.3 6.7 -54.7 681 199 B G - 0 0 0 -69,-0.3 -69,-2.7 -66,-0.2 2,-0.3 -0.501 28.0 -79.3 75.5-147.0 -34.5 7.0 -50.9 682 200 B S S S+ 0 0 29 -71,-0.2 4,-0.1 1,-0.2 38,-0.1 -0.907 81.0 68.0-146.1 170.2 -33.5 3.9 -48.9 683 201 B G S S- 0 0 16 280,-1.0 -1,-0.2 -2,-0.3 3,-0.1 0.974 118.5 -11.2 78.4 85.2 -34.5 0.4 -47.8 684 202 B N S S+ 0 0 50 1,-0.3 2,-0.4 279,-0.2 -1,-0.1 0.515 105.1 131.3 71.9 4.3 -34.9 -2.2 -50.6 685 203 B H + 0 0 9 278,-0.4 278,-1.1 2,-0.0 2,-0.3 -0.767 27.9 137.5 -93.9 139.2 -34.6 0.7 -53.0 686 204 B F E -EF 716 962I 17 30,-1.5 30,-2.7 -2,-0.4 2,-0.5 -0.987 52.7-128.6-166.5 159.5 -32.2 0.4 -55.8 687 205 B L E -EF 715 961I 1 274,-2.6 274,-2.7 -2,-0.3 2,-0.5 -0.993 40.2-169.6-115.0 116.9 -31.2 0.8 -59.5 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-790,-0.1 -1,-0.2 -0.991 61.1-136.2-149.0 150.9 -24.1 3.5 -46.8 922 440 B M H > S+ 0 0 29 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.797 106.8 62.9 -72.0 -29.7 -22.3 0.3 -45.7 923 441 B R H > S+ 0 0 61 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 98.6 50.3 -63.4 -44.8 -25.1 -0.1 -43.2 924 442 B V H > S+ 0 0 1 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.898 105.9 59.3 -61.9 -34.5 -27.9 -0.4 -45.8 925 443 B V H < S+ 0 0 0 -4,-1.0 3,-0.4 1,-0.2 -1,-0.2 0.911 107.4 45.9 -58.0 -43.3 -25.7 -3.1 -47.5 926 444 B A H >< S+ 0 0 3 -4,-1.5 3,-1.0 1,-0.2 -1,-0.2 0.883 111.4 51.1 -65.1 -42.9 -25.8 -5.1 -44.2 927 445 B E H 3< S+ 0 0 15 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.690 115.0 44.1 -67.1 -20.5 -29.5 -4.7 -43.8 928 446 B E T 3< S+ 0 0 2 -4,-1.2 -65,-0.4 -3,-0.4 -1,-0.2 0.139 78.9 141.4-118.1 15.6 -30.1 -5.9 -47.3 929 447 B A X - 0 0 1 -3,-1.0 3,-2.3 1,-0.1 4,-0.4 -0.212 67.5-108.8 -51.1 144.3 -27.7 -8.8 -47.5 930 448 B P G > S+ 0 0 39 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.850 117.8 61.1 -48.2 -36.2 -29.1 -11.8 -49.4 931 449 B G G 3 S+ 0 0 37 1,-0.3 -2,-0.1 -34,-0.1 4,-0.1 0.586 90.1 67.3 -72.1 -11.6 -29.5 -13.7 -46.1 932 450 B A G < S+ 0 0 0 -3,-2.3 -41,-3.9 -41,-0.1 -40,-2.4 0.662 100.3 60.4 -78.4 -15.5 -32.0 -11.2 -44.7 933 451 B Y B < S-M 890 0M 31 -3,-1.5 -43,-0.2 -4,-0.4 -44,-0.1 -0.734 89.8-102.0-112.3 159.3 -34.6 -12.2 -47.3 934 452 B K - 0 0 19 -45,-2.5 2,-0.8 -2,-0.3 -1,-0.1 -0.202 54.8 -81.0 -67.1 165.7 -36.4 -15.5 -48.3 935 453 B N >> - 0 0 78 1,-0.2 4,-1.9 -47,-0.1 3,-0.9 -0.631 39.1-157.6 -73.4 111.0 -35.3 -17.5 -51.2 936 454 B V H 3> S+ 0 0 2 -2,-0.8 4,-2.8 1,-0.3 5,-0.3 0.843 90.1 62.2 -62.7 -34.9 -36.9 -15.7 -54.2 937 455 B D H 3> S+ 0 0 70 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.886 107.4 45.0 -54.3 -39.3 -36.7 -18.9 -56.3 938 456 B N H <> S+ 0 0 58 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.899 111.2 51.0 -75.1 -41.0 -39.0 -20.6 -53.8 939 457 B V H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.930 114.4 44.8 -58.6 -45.3 -41.4 -17.6 -53.5 940 458 B V H X S+ 0 0 2 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.880 108.7 56.9 -69.1 -38.9 -41.7 -17.6 -57.3 941 459 B K H X S+ 0 0 75 -4,-1.9 4,-3.2 -5,-0.3 5,-0.3 0.936 105.3 52.9 -57.0 -46.0 -42.0 -21.4 -57.5 942 460 B V H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.936 111.4 43.3 -58.5 -48.8 -45.0 -21.2 -55.2 943 461 B V H X>S+ 0 0 0 -4,-1.7 5,-1.8 2,-0.2 6,-0.9 0.874 115.5 49.7 -69.7 -32.8 -46.9 -18.6 -57.3 944 462 B S H ><5S+ 0 0 42 -4,-2.4 3,-0.7 2,-0.2 -2,-0.2 0.945 113.0 46.3 -62.7 -52.0 -46.0 -20.5 -60.5 945 463 B E H 3<5S+ 0 0 125 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.881 110.9 53.0 -57.2 -41.3 -47.2 -23.8 -59.1 946 464 B A H 3<5S- 0 0 8 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.729 109.3-128.3 -69.6 -20.8 -50.4 -22.1 -57.8 947 465 B G T <<5S+ 0 0 31 -4,-0.8 -71,-0.5 -3,-0.7 -72,-0.4 0.623 75.5 120.6 83.3 14.7 -51.0 -20.8 -61.4 948 466 B I S