==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-MAR-05 1Z1J . COMPND 2 MOLECULE: 3C-LIKE PROTEINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SARS CORONAVIRUS; . AUTHOR M.F.HSU . 612 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26869.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 366 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 122 19.9 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 . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 2.3 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 . 1 0.2 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 . 60 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 3 1 4 2 0 2 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 1 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 . 10 3 7 3 2 2 0 2 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 . 1 0 0 0 1 1 0 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 S 0 0 44 0, 0.0 2,-0.2 0, 0.0 445,-0.2 0.000 360.0 360.0 360.0 92.9 47.1 12.0 8.2 2 2 A G - 0 0 19 443,-1.2 2,-0.3 475,-0.1 298,-0.2 -0.784 360.0 -88.8-129.2 172.6 46.2 8.7 6.6 3 3 A F + 0 0 44 -2,-0.2 2,-0.3 296,-0.1 293,-0.1 -0.634 42.2 174.1 -86.2 142.4 43.2 7.0 5.0 4 4 A R - 0 0 41 -2,-0.3 2,-1.1 441,-0.0 295,-0.1 -0.968 38.9-120.5-141.0 150.8 40.7 5.0 7.1 5 5 A K - 0 0 82 -2,-0.3 429,-0.3 429,-0.1 122,-0.2 -0.835 52.3-178.4 -94.2 96.2 37.5 3.4 6.2 6 6 A M - 0 0 11 -2,-1.1 2,-0.3 427,-0.1 427,-0.2 -0.392 20.6-147.4 -94.7 174.1 35.3 5.5 8.6 7 7 A A B -A 432 0A 3 425,-1.9 425,-3.2 -2,-0.1 3,-0.1 -0.968 28.3 -98.6-139.5 152.9 31.7 5.6 9.5 8 8 A F - 0 0 32 -2,-0.3 2,-0.5 423,-0.2 423,-0.2 -0.258 58.6 -81.8 -65.4 155.5 29.3 8.4 10.6 9 9 A P > - 0 0 7 0, 0.0 3,-0.7 0, 0.0 4,-0.4 -0.489 36.5-150.8 -64.8 119.3 28.7 8.7 14.3 10 10 A S T 3> S+ 0 0 0 -2,-0.5 4,-2.2 1,-0.2 308,-0.1 0.462 70.0 107.3 -67.9 0.5 26.1 6.0 15.0 11 11 A G H 3> S+ 0 0 15 306,-0.3 4,-1.0 1,-0.2 3,-0.2 0.907 77.9 41.3 -44.7 -60.4 24.9 8.3 17.9 12 12 A K H X4 S+ 0 0 73 -3,-0.7 3,-0.8 1,-0.2 -1,-0.2 0.911 112.1 54.6 -59.6 -44.6 21.7 9.5 16.3 13 13 A V H >4 S+ 0 0 0 -4,-0.4 3,-1.9 1,-0.2 4,-0.3 0.877 100.7 61.0 -59.3 -37.0 20.7 6.2 14.9 14 14 A E H >< S+ 0 0 37 -4,-2.2 3,-1.5 1,-0.3 -1,-0.2 0.836 93.5 63.7 -59.2 -34.6 21.0 4.5 18.3 15 15 A G T << S+ 0 0 17 -4,-1.0 -1,-0.3 -3,-0.8 82,-0.3 0.379 104.8 49.6 -71.6 7.8 18.3 6.8 19.7 16 16 A C T < S+ 0 0 1 -3,-1.9 15,-3.5 82,-0.1 2,-0.3 0.396 85.1 107.1-123.9 -3.0 16.0 5.1 17.2 17 17 A M E < +I 30 0B 15 -3,-1.5 2,-0.3 -4,-0.3 13,-0.2 -0.616 38.5 157.7 -84.9 137.8 16.7 1.4 17.9 18 18 A V E -I 29 0B 1 11,-1.4 11,-1.3 -2,-0.3 2,-0.5 -0.894 40.4-102.7-146.1 173.0 14.1 -0.7 19.7 19 19 A Q E -IJ 28 69B 27 50,-1.7 50,-1.8 -2,-0.3 2,-0.6 -0.915 26.2-170.9-109.8 122.1 13.2 -4.4 20.1 20 20 A V E -IJ 27 68B 0 7,-1.6 7,-1.9 -2,-0.5 2,-0.5 -0.925 9.5-176.2-113.3 108.8 10.2 -5.8 18.2 21 21 A T E +IJ 26 67B 21 46,-2.6 46,-2.6 -2,-0.6 2,-0.4 -0.906 5.1 177.3-110.9 127.5 9.3 -9.3 19.3 22 22 A C E > -IJ 25 66B 2 3,-3.9 3,-3.9 -2,-0.5 44,-0.1 -0.993 59.4 -42.4-129.0 134.8 6.6 -11.4 17.7 23 23 A G T 3 S- 0 0 71 42,-0.6 20,-0.1 -2,-0.4 44,-0.1 -0.227 124.5 -26.1 49.5-126.0 5.7 -14.9 18.6 24 24 A T T 3 S+ 0 0 136 20,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.029 123.8 96.2-104.3 24.3 9.0 -16.7 19.1 25 25 A T E < +I 22 0B 38 -3,-3.9 -3,-3.9 17,-0.1 2,-0.4 -0.965 47.2 176.9-119.5 129.7 10.7 -14.3 16.7 26 26 A T E +I 21 0B 49 -2,-0.5 -5,-0.2 -5,-0.3 2,-0.2 -0.995 16.2 138.6-134.7 126.6 12.6 -11.2 17.9 27 27 A L E -I 20 0B 4 -7,-1.9 -7,-1.6 -2,-0.4 2,-0.2 -0.625 47.0 -67.8-141.2-159.0 14.5 -8.8 15.6 28 28 A N E -I 19 0B 0 117,-2.5 2,-0.3 -2,-0.2 -9,-0.2 -0.592 32.4-168.3-108.1 166.5 15.0 -5.1 15.3 29 29 A G E -I 18 0B 0 -11,-1.3 -11,-1.4 -2,-0.2 2,-0.6 -0.980 22.6-126.5-154.1 138.2 13.0 -2.0 14.5 30 30 A L E -IK 17 37B 0 7,-2.5 7,-3.3 -2,-0.3 2,-0.8 -0.749 22.7-153.6 -86.9 120.6 13.6 1.7 13.7 31 31 A W E + K 0 36B 24 -15,-3.5 2,-0.5 -2,-0.6 5,-0.2 -0.831 23.7 164.8 -99.7 103.1 11.5 4.0 15.9 32 32 A L E > - K 0 35B 0 3,-1.9 3,-2.1 -2,-0.8 -16,-0.1 -0.980 60.0 -42.6-122.2 124.0 10.9 7.3 14.2 33 33 A D T 3 S- 0 0 63 -2,-0.5 62,-2.1 62,-0.3 60,-0.1 -0.243 120.8 -26.5 55.1-144.4 8.2 9.7 15.5 34 34 A D T 3 S+ 0 0 69 60,-0.3 57,-1.8 61,-0.1 2,-0.3 0.186 126.0 88.1 -86.5 22.5 5.1 7.8 16.4 35 35 A T E < -KL 32 90B 28 -3,-2.1 -3,-1.9 55,-0.2 2,-0.4 -0.905 58.2-161.0-121.2 148.5 6.0 5.1 13.9 36 36 A V E -KL 31 89B 0 53,-2.4 53,-1.9 -2,-0.3 2,-0.4 -0.953 8.8-157.6-133.0 115.1 8.1 1.9 14.3 37 37 A Y E +KL 30 88B 19 -7,-3.3 -7,-2.5 -2,-0.4 51,-0.2 -0.746 21.3 154.5 -96.9 133.7 9.6 0.1 11.3 38 38 A C - 0 0 0 49,-0.9 49,-0.5 -2,-0.4 2,-0.2 -0.987 51.8 -84.0-149.6 155.0 10.7 -3.6 11.2 39 39 A P > - 0 0 0 0, 0.0 3,-1.6 0, 0.0 47,-0.3 -0.449 39.6-133.1 -61.7 127.0 11.1 -6.4 8.6 40 40 A R G > S+ 0 0 41 45,-2.0 3,-1.8 1,-0.3 46,-0.1 0.687 96.4 77.5 -55.2 -24.3 7.7 -8.0 8.1 41 41 A H G > S+ 0 0 39 44,-0.4 3,-1.3 1,-0.3 -1,-0.3 0.454 70.1 89.7 -70.1 5.8 9.0 -11.5 8.3 42 42 A V G < S+ 0 0 0 -3,-1.6 -1,-0.3 1,-0.3 -20,-0.2 0.899 80.5 59.0 -65.9 -35.9 9.1 -10.9 12.1 43 43 A I G < S+ 0 0 5 -3,-1.8 -1,-0.3 -4,-0.1 2,-0.3 0.049 98.6 84.8 -82.1 28.6 5.5 -12.2 12.1 44 44 A C < - 0 0 4 -3,-1.3 2,-0.3 -22,-0.1 -20,-0.1 -0.806 62.5-145.3-126.4 168.1 6.6 -15.5 10.6 45 45 A T > - 0 0 67 -2,-0.3 4,-1.8 -22,-0.1 3,-0.2 -0.894 44.7 -91.9-127.4 157.0 8.0 -18.9 11.8 46 46 A A T 4 S+ 0 0 89 -2,-0.3 4,-0.3 1,-0.2 143,-0.1 0.775 127.9 49.1 -37.9 -37.5 10.5 -21.1 10.0 47 47 A E T >4 S+ 0 0 147 1,-0.2 3,-2.9 2,-0.2 4,-0.4 0.975 102.6 57.5 -71.0 -55.0 7.6 -22.9 8.4 48 48 A D G >4 S+ 0 0 52 1,-0.3 3,-2.0 -3,-0.2 -2,-0.2 0.870 95.4 70.9 -41.1 -45.3 5.7 -19.8 7.2 49 49 A M G 3< S+ 0 0 34 -4,-1.8 140,-3.5 1,-0.3 -1,-0.3 0.670 80.9 70.6 -49.5 -24.7 8.8 -18.9 5.2 50 50 A L G < S- 0 0 102 -3,-2.9 -1,-0.3 -4,-0.3 -2,-0.2 0.818 129.1 -4.7 -67.3 -26.4 8.4 -21.7 2.7 51 51 A N S < S- 0 0 117 -3,-2.0 -1,-0.2 -4,-0.4 -2,-0.2 -0.306 85.9-168.9-161.3 60.8 5.4 -19.9 1.1 52 52 A P - 0 0 19 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.273 15.9-169.6 -62.4 142.7 4.6 -16.8 3.2 53 53 A N >> + 0 0 77 1,-0.1 4,-2.4 2,-0.0 3,-1.2 -0.537 10.8 179.3-128.3 57.9 1.3 -14.9 2.6 54 54 A Y H 3> S+ 0 0 10 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.732 75.2 59.3 -32.4 -43.1 2.1 -11.9 4.7 55 55 A E H 3> S+ 0 0 131 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.957 114.8 33.9 -56.2 -55.1 -1.2 -10.3 3.9 56 56 A D H <> S+ 0 0 60 -3,-1.2 4,-1.1 2,-0.2 -2,-0.2 0.855 120.7 51.3 -68.7 -39.6 -3.3 -13.1 5.4 57 57 A L H >< S+ 0 0 37 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.993 107.5 50.2 -60.6 -62.1 -0.7 -13.8 8.0 58 58 A L H >< S+ 0 0 14 -4,-3.3 3,-1.2 1,-0.3 -1,-0.2 0.781 102.5 64.8 -47.1 -30.6 -0.5 -10.2 9.3 59 59 A I H 3< S+ 0 0 112 -4,-1.1 2,-0.4 -5,-0.3 -1,-0.3 0.906 92.2 61.3 -61.6 -40.4 -4.3 -10.3 9.4 60 60 A R T << S+ 0 0 189 -3,-2.0 2,-0.3 -4,-1.1 -1,-0.3 0.048 99.4 75.3 -74.3 29.0 -4.0 -13.0 12.2 61 61 A K < - 0 0 54 -3,-1.2 19,-0.1 -2,-0.4 2,-0.1 -0.936 61.8-164.2-149.5 124.6 -2.2 -10.4 14.3 62 62 A S > - 0 0 68 -2,-0.3 3,-1.6 17,-0.1 4,-0.3 -0.253 44.6 -80.7 -96.0-176.1 -3.3 -7.3 16.2 63 63 A N G > S+ 0 0 48 1,-0.3 3,-0.8 2,-0.2 14,-0.1 0.866 129.0 43.5 -53.2 -45.2 -1.7 -4.3 17.8 64 64 A H G 3 S+ 0 0 165 1,-0.2 -1,-0.3 12,-0.1 3,-0.1 -0.132 88.5 88.3 -98.3 41.5 -0.5 -6.1 20.9 65 65 A S G < S+ 0 0 42 -3,-1.6 -42,-0.6 1,-0.2 2,-0.5 0.425 84.7 65.1-104.3 -11.2 0.6 -9.1 18.9 66 66 A F E < S-J 22 0B 4 -3,-0.8 2,-0.9 -4,-0.3 11,-0.2 -0.960 75.1-154.9-117.9 112.6 3.9 -7.3 18.7 67 67 A L E -J 21 0B 65 -46,-2.6 -46,-2.6 -2,-0.5 2,-0.4 -0.780 18.9-179.4 -92.7 105.7 5.8 -6.6 21.9 68 68 A V E -JM 20 75B 1 -2,-0.9 7,-2.2 7,-0.6 2,-0.4 -0.876 4.3-176.6-107.3 136.9 8.0 -3.6 21.4 69 69 A Q E -JM 19 74B 54 -50,-1.8 -50,-1.7 -2,-0.4 2,-1.3 -0.971 22.2-151.5-139.0 122.7 10.3 -2.2 24.0 70 70 A A E > S- M 0 73B 26 3,-2.0 3,-1.1 -2,-0.4 2,-0.7 -0.747 82.0 -46.5 -88.4 92.3 12.5 0.9 24.0 71 71 A G T 3 S- 0 0 35 -2,-1.3 -52,-0.1 1,-0.2 -2,-0.0 -0.737 123.4 -23.7 83.5-117.7 15.2 -0.3 26.4 72 72 A N T 3 S+ 0 0 150 -2,-0.7 2,-0.5 2,-0.1 -1,-0.2 0.643 124.6 79.8-102.9 -20.1 13.4 -1.8 29.3 73 73 A V E < S-M 70 0B 100 -3,-1.1 -3,-2.0 -4,-0.0 2,-0.2 -0.806 77.0-135.5 -93.4 125.2 10.1 0.0 29.0 74 74 A Q E -M 69 0B 117 -2,-0.5 -5,-0.3 -5,-0.3 2,-0.2 -0.537 12.5-131.0 -84.5 145.4 7.7 -1.4 26.4 75 75 A L E -M 68 0B 14 -7,-2.2 -7,-0.6 -2,-0.2 2,-0.5 -0.588 18.5-116.1 -92.9 153.4 5.8 0.8 23.9 76 76 A R - 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0 0 86 -2,-1.5 39,-0.2 1,-0.1 -1,-0.1 -0.147 43.0-148.2 -42.1 96.6 52.3 -28.5 13.2 532 1225 B T - 0 0 10 37,-0.4 41,-0.1 -2,-0.3 40,-0.1 0.024 2.7-107.3 -69.3 174.0 55.1 -26.1 14.4 533 1226 B T - 0 0 54 36,-0.1 -1,-0.1 39,-0.1 5,-0.1 0.108 28.8-105.2 -85.5-160.6 56.7 -25.6 17.8 534 1227 B L S S+ 0 0 116 3,-0.1 4,-0.2 2,-0.1 15,-0.2 0.453 115.7 26.0-108.8 -8.6 56.4 -22.9 20.4 535 1228 B N S > S+ 0 0 92 2,-0.1 4,-1.6 3,-0.1 5,-0.2 0.696 111.2 61.8-118.2 -54.4 59.9 -21.4 19.6 536 1229 B D H > S+ 0 0 86 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.802 107.1 53.7 -45.4 -34.1 60.7 -22.2 16.0 537 1230 B F H >> S+ 0 0 11 2,-0.2 4,-1.6 1,-0.2 3,-1.2 0.999 108.6 39.9 -67.4 -71.5 57.6 -20.2 15.1 538 1231 B N H 3> S+ 0 0 24 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.639 109.3 68.5 -55.6 -12.6 58.1 -16.8 16.8 539 1232 B L H 3< S+ 0 0 86 -4,-1.6 3,-0.5 2,-0.2 -1,-0.3 0.942 102.5 40.9 -69.9 -49.9 61.7 -17.3 15.7 540 1233 B V H X< S+ 0 0 24 -4,-1.3 3,-1.9 -3,-1.2 4,-0.4 0.758 103.8 72.1 -68.0 -25.7 60.6 -16.9 12.0 541 1234 B A H ><>S+ 0 0 9 -4,-1.6 3,-2.3 1,-0.3 5,-1.7 0.933 95.0 50.0 -55.5 -46.2 58.3 -14.1 13.2 542 1235 B M T 3<5S+ 0 0 110 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.481 103.2 63.9 -71.1 -0.7 61.4 -12.0 13.8 543 1236 B K T < 5S+ 0 0 122 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.511 116.0 27.4 -95.9 -11.0 62.2 -13.1 10.2 544 1237 B Y T < 5S- 0 0 86 -3,-2.3 -2,-0.2 -4,-0.4 -3,-0.1 0.172 124.1 -93.3-133.7 13.3 59.1 -11.2 9.1 545 1238 B N T 5S+ 0 0 79 -4,-0.4 -39,-1.8 1,-0.2 2,-0.5 0.933 74.7 142.1 74.2 50.6 58.8 -8.5 11.8 546 1239 B Y B < -f 506 0I 23 -5,-1.7 -1,-0.2 -41,-0.2 -39,-0.1 -0.960 49.4-126.3-127.2 115.6 56.5 -10.2 14.3 547 1240 B E - 0 0 91 -41,-1.0 -6,-0.0 -2,-0.5 -42,-0.0 -0.244 38.1-101.0 -57.1 142.3 57.0 -9.7 18.0 548 1241 B P - 0 0 64 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.238 33.8-130.9 -52.6-175.1 57.2 -13.0 20.0 549 1242 B L - 0 0 30 -15,-0.2 2,-0.3 -41,-0.1 -11,-0.1 -0.988 10.6-153.6-144.2 149.5 54.4 -14.6 22.0 550 1243 B T >> - 0 0 64 -2,-0.3 3,-2.3 1,-0.1 4,-0.6 -0.822 34.1-112.3-121.5 162.2 54.0 -16.0 25.5 551 1244 B Q H >> S+ 0 0 95 1,-0.3 4,-2.9 -2,-0.3 3,-0.6 0.775 118.2 70.6 -62.7 -23.2 51.6 -18.6 26.9 552 1245 B D H 34 S+ 0 0 131 1,-0.3 -1,-0.3 2,-0.2 0, 0.0 0.521 102.5 46.7 -69.5 -1.8 50.2 -15.6 28.8 553 1246 B H H <4 S+ 0 0 69 -3,-2.3 -1,-0.3 2,-0.1 -2,-0.2 0.559 113.9 43.6-111.2 -19.8 49.0 -14.8 25.3 554 1247 B V H X< S+ 0 0 17 -3,-0.6 3,-1.0 -4,-0.6 -2,-0.2 0.735 98.9 69.2 -97.3 -29.3 47.6 -18.2 24.3 555 1248 B D T 3< S+ 0 0 112 -4,-2.9 3,-0.3 1,-0.3 -1,-0.1 0.626 99.4 53.2 -64.9 -11.7 45.8 -18.9 27.6 556 1249 B I T 3 S+ 0 0 88 -5,-0.2 4,-0.5 1,-0.2 -1,-0.3 0.678 96.4 65.7 -91.7 -23.5 43.5 -16.1 26.6 557 1250 B L S <> S+ 0 0 7 -3,-1.0 4,-2.2 1,-0.2 5,-0.4 0.325 73.9 107.5 -77.9 8.8 43.0 -17.9 23.2 558 1251 B G H > S+ 0 0 34 -3,-0.3 4,-3.0 1,-0.2 5,-0.2 0.977 82.1 36.3 -49.8 -71.9 41.4 -20.6 25.4 559 1252 B P H > S+ 0 0 74 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.866 110.8 66.9 -51.6 -37.6 37.8 -19.8 24.3 560 1253 B L H >4 S+ 0 0 8 -4,-0.5 3,-1.9 1,-0.2 -2,-0.2 0.959 113.1 27.9 -46.7 -70.2 39.2 -19.2 20.8 561 1254 B S H >X S+ 0 0 30 -4,-2.2 4,-1.1 1,-0.3 3,-0.8 0.913 112.3 68.6 -58.4 -43.1 40.2 -22.8 20.2 562 1255 B A H 3< S+ 0 0 86 -4,-3.0 -1,-0.3 -5,-0.4 -2,-0.2 0.608 97.0 58.2 -52.5 -10.6 37.5 -23.9 22.6 563 1256 B Q T << S+ 0 0 107 -3,-1.9 -1,-0.3 -4,-0.7 -2,-0.1 -0.447 125.9 6.4-118.5 56.0 35.2 -22.7 19.8 564 1257 B T T <4 S- 0 0 66 -3,-0.8 -2,-0.2 -2,-0.1 -3,-0.1 -0.317 87.0-116.0 172.7 -73.5 36.5 -24.9 16.9 565 1258 B G < + 0 0 66 -4,-1.1 2,-0.4 1,-0.4 -3,-0.1 0.305 64.9 140.5 123.0 1.3 39.0 -27.5 18.0 566 1259 B I - 0 0 15 -5,-0.3 -1,-0.4 -6,-0.2 -3,-0.1 -0.620 51.3-121.1 -79.0 127.5 41.8 -25.9 15.9 567 1260 B A - 0 0 39 -2,-0.4 4,-0.2 -40,-0.2 -1,-0.1 0.095 3.8-134.2 -58.8 175.2 45.2 -26.0 17.6 568 1261 B V S > S+ 0 0 37 3,-0.1 4,-2.4 2,-0.1 5,-0.1 0.831 103.9 45.4 -95.9 -52.1 47.3 -22.9 18.4 569 1262 B L H > S+ 0 0 69 2,-0.2 4,-1.9 1,-0.2 -37,-0.4 0.961 113.1 48.0 -55.4 -61.0 50.6 -24.3 17.1 570 1263 B D H > S+ 0 0 48 1,-0.3 4,-1.1 2,-0.2 3,-0.2 0.899 111.2 52.6 -49.1 -45.1 49.2 -25.8 13.9 571 1264 B M H >> S+ 0 0 6 1,-0.2 3,-1.1 2,-0.2 4,-0.7 0.932 105.3 55.2 -56.3 -46.2 47.5 -22.5 13.3 572 1265 B C H >X S+ 0 0 5 -4,-2.4 3,-1.2 1,-0.3 4,-1.2 0.857 101.0 58.6 -54.6 -38.9 50.8 -20.7 13.8 573 1266 B A H 3X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.3 -1,-0.3 0.821 92.9 67.1 -62.5 -30.4 52.3 -22.9 11.1 574 1267 B A H << S+ 0 0 0 -4,-1.1 4,-0.4 -3,-1.1 -1,-0.3 0.813 99.9 52.4 -59.7 -28.6 49.8 -21.5 8.7 575 1268 B L H XX S+ 0 0 3 -3,-1.2 4,-1.3 -4,-0.7 3,-0.7 0.937 102.7 54.6 -72.5 -49.4 51.6 -18.2 9.1 576 1269 B K H >X>S+ 0 0 38 -4,-1.2 4,-2.3 1,-0.3 3,-1.3 0.954 114.5 41.6 -46.8 -55.7 55.1 -19.6 8.3 577 1270 B E H 3<>S+ 0 0 65 -4,-2.0 5,-1.6 1,-0.3 -1,-0.3 0.675 110.5 63.3 -65.3 -18.3 53.6 -21.0 5.0 578 1271 B L H <45S+ 0 0 7 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.669 117.9 19.5 -82.9 -18.4 51.8 -17.6 4.8 579 1272 B L H <<5S+ 0 0 48 -4,-1.3 -2,-0.2 -3,-1.3 -3,-0.2 0.738 123.7 49.1-117.1 -47.2 54.9 -15.4 4.5 580 1273 B Q T <5S+ 0 0 78 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.783 141.6 9.5 -65.6 -25.5 57.8 -17.6 3.4 581 1274 B N T - 0 0 34 -2,-0.4 3,-0.5 -4,-0.1 -1,-0.1 0.218 47.9-179.3-158.1 -5.1 49.0 -16.9 -0.3 584 1277 B N T 3 S+ 0 0 138 -3,-0.2 2,-0.5 1,-0.2 3,-0.1 0.350 72.3 8.7 -12.0 96.6 49.5 -15.4 -3.8 585 1278 B G T 3 S+ 0 0 68 1,-0.2 -1,-0.2 7,-0.0 -2,-0.0 -0.825 114.1 63.9 126.9 -93.0 46.0 -15.7 -5.2 586 1279 B R < - 0 0 143 -3,-0.5 -1,-0.2 -2,-0.5 2,-0.2 -0.267 69.2-158.6 -64.7 155.4 43.4 -16.8 -2.6 587 1280 B T - 0 0 41 -3,-0.1 2,-0.6 0, 0.0 5,-0.1 -0.700 19.3-110.1-129.1 179.9 42.8 -14.4 0.3 588 1281 B I B > S-G 591 0J 1 3,-1.3 3,-0.6 -2,-0.2 -64,-0.0 -0.941 90.9 -31.7-119.7 109.0 41.5 -14.3 3.8 589 1282 B L T 3 S- 0 0 52 -2,-0.6 2,-0.8 1,-0.3 -1,-0.1 0.834 118.8 -59.4 53.0 35.1 38.2 -12.5 4.3 590 1283 B G T 3 S+ 0 0 40 1,-0.2 -1,-0.3 2,-0.0 0, 0.0 -0.412 108.5 105.1 99.3 -61.6 39.1 -10.2 1.4 591 1284 B S B < -G 588 0J 43 -2,-0.8 -3,-1.3 -3,-0.6 -1,-0.2 -0.224 52.3-155.1 -60.4 147.6 42.3 -8.4 2.5 592 1285 B T S S+ 0 0 12 -5,-0.1 -1,-0.1 -3,-0.1 -308,-0.1 0.920 78.4 63.3 -85.0 -54.1 45.6 -9.5 0.9 593 1286 B I S S- 0 0 96 1,-0.1 2,-0.6 -6,-0.0 -5,-0.2 -0.095 99.3 -98.9 -63.6 167.1 47.8 -8.3 3.8 594 1287 B L - 0 0 19 2,-0.0 2,-0.3 1,-0.0 -1,-0.1 -0.838 37.6-129.8 -94.9 123.6 47.5 -10.0 7.2 595 1288 B E + 0 0 49 -2,-0.6 -81,-0.2 -84,-0.2 3,-0.1 -0.563 29.4 173.9 -78.1 131.9 45.4 -7.9 9.6 596 1289 B D + 0 0 21 -2,-0.3 2,-1.1 1,-0.1 -85,-0.2 0.390 60.6 87.2-113.0 -4.4 46.8 -7.1 13.0 597 1290 B E + 0 0 6 -87,-0.1 2,-0.1 1,-0.1 -1,-0.1 -0.560 68.7 88.8 -99.0 69.5 44.1 -4.8 14.3 598 1291 B F - 0 0 11 -2,-1.1 -85,-0.1 -182,-0.2 -1,-0.1 -0.614 60.1-159.3-163.6 93.0 41.8 -7.5 15.7 599 1292 B T > - 0 0 8 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.307 36.1-104.5 -73.7 162.0 42.3 -8.7 19.3 600 1293 B P H > S+ 0 0 16 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.849 124.4 48.2 -55.8 -34.7 40.9 -12.0 20.5 601 1294 B F H > S+ 0 0 114 2,-0.2 4,-4.6 1,-0.2 5,-0.3 0.931 106.7 55.2 -72.7 -43.9 38.1 -10.2 22.2 602 1295 B D H > S+ 0 0 4 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.904 110.4 48.1 -52.5 -41.3 37.3 -8.1 19.2 603 1296 B V H X S+ 0 0 1 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.867 118.5 37.7 -69.3 -37.3 36.9 -11.3 17.3 604 1297 B V H X S+ 0 0 36 -4,-1.7 4,-2.8 -5,-0.2 5,-0.4 0.931 111.4 59.5 -79.1 -44.5 34.7 -12.9 19.8 605 1298 B R H X>S+ 0 0 3 -4,-4.6 4,-0.9 2,-0.2 5,-0.5 0.840 115.7 37.0 -48.4 -36.9 32.9 -9.7 20.6 606 1299 B Q H ><5S+ 0 0 16 -4,-1.6 3,-0.5 -5,-0.3 -2,-0.2 0.972 117.6 45.6 -80.3 -65.4 31.9 -9.6 16.9 607 1300 B C H 3<5S+ 0 0 35 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.693 116.5 49.1 -52.9 -22.3 31.3 -13.3 16.1 608 1301 B S H 3<5S- 0 0 75 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.827 103.6-126.7 -89.6 -36.4 29.3 -13.6 19.3 609 1302 B G T <<5 - 0 0 11 -4,-0.9 -3,-0.1 -3,-0.5 -4,-0.1 0.525 33.6-177.1 102.8 7.2 27.0 -10.6 19.0 610 1303 B V < - 0 0 30 -5,-0.5 -1,-0.2 -6,-0.3 -149,-0.1 -0.126 6.1-171.1 -45.6 108.6 27.6 -8.9 22.3 611 1304 B T - 0 0 23 1,-0.1 -150,-0.3 -494,-0.0 2,-0.2 0.259 4.1-152.5 -80.2-149.4 25.3 -5.9 22.5 612 1305 B F 0 0 13 -151,-0.1 -1,-0.1 -152,-0.1 -489,-0.1 -0.540 360.0 360.0-153.8-138.9 25.5 -3.2 25.2 613 1306 B Q 0 0 108 -2,-0.2 -151,-1.0 -492,-0.0 -150,-0.3 -0.663 360.0 360.0 150.1 360.0 23.4 -0.6 27.1