==== 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 SIGNALING PROTEIN 10-OCT-05 2B8W . COMPND 2 MOLECULE: INTERFERON-INDUCED GUANYLATE-BINDING PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.GHOSH,G.J.K.PRAEFCKE,L.RENAULT,A.WITTINGHOFER,C.HERRMANN . 578 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24236.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 397 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 62 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 8.0 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 . 2 0.3 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-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 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 185 32.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 0 0 1 3 2 0 0 0 0 2 1 2 3 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 4 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 PARALLEL BRIDGES PER LADDER . 2 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 6 A H 0 0 144 0, 0.0 2,-0.1 0, 0.0 77,-0.1 0.000 360.0 360.0 360.0-146.4 46.4 3.8 15.2 2 7 A M - 0 0 30 75,-0.9 0, 0.0 1,-0.1 0, 0.0 -0.259 360.0-162.5 -63.7 125.4 50.2 3.7 14.3 3 8 A T S S- 0 0 147 -2,-0.1 -1,-0.1 1,-0.1 75,-0.0 0.778 75.7 -2.4 -77.0 -25.1 52.5 3.1 17.3 4 9 A G S S- 0 0 26 73,-0.1 73,-0.2 71,-0.0 -1,-0.1 -0.960 84.4 -86.0-156.2 168.9 55.5 4.3 15.4 5 10 A P - 0 0 24 0, 0.0 2,-0.3 0, 0.0 71,-0.2 -0.282 35.1-161.3 -71.8 166.5 56.5 5.6 11.9 6 11 A M E -A 75 0A 36 69,-2.1 69,-3.0 -2,-0.0 2,-0.3 -0.986 32.1 -87.3-144.2 159.4 57.5 3.5 8.9 7 12 A C E +A 74 0A 22 -2,-0.3 67,-0.3 67,-0.2 15,-0.3 -0.446 37.8 175.9 -63.1 122.7 59.4 4.0 5.6 8 13 A L E S+ 0 0 1 65,-2.7 11,-2.9 1,-0.3 2,-0.5 0.860 75.3 26.0 -88.4 -51.3 57.0 5.2 2.9 9 14 A I E S-AB 73 18A 0 64,-2.1 64,-2.5 9,-0.2 -1,-0.3 -0.981 79.0-149.5-120.5 111.9 59.6 5.7 0.2 10 15 A E E - B 0 17A 64 7,-3.1 7,-2.0 -2,-0.5 2,-0.5 -0.711 2.2-155.6 -73.8 154.3 62.8 3.7 0.3 11 16 A N E + B 0 16A 29 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.870 25.3 158.3-135.5 93.7 66.0 5.2 -1.1 12 17 A T E > - B 0 15A 84 3,-2.3 3,-1.9 -2,-0.5 -2,-0.0 -0.964 68.1 -25.0-124.6 118.9 68.5 2.5 -2.1 13 18 A N T 3 S- 0 0 145 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.880 125.8 -45.3 49.9 50.9 71.3 3.0 -4.6 14 19 A G T 3 S+ 0 0 40 1,-0.2 2,-0.6 89,-0.0 -1,-0.3 0.390 115.1 116.2 80.4 -4.8 69.7 5.9 -6.5 15 20 A R E < -B 12 0A 171 -3,-1.9 -3,-2.3 2,-0.0 2,-0.5 -0.877 49.6-159.8-103.1 123.4 66.4 4.1 -6.7 16 21 A L E +B 11 0A 9 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.845 21.6 172.1 -97.1 128.9 63.3 5.5 -5.0 17 22 A M E -B 10 0A 105 -7,-2.0 -7,-3.1 -2,-0.5 2,-0.2 -1.000 33.6-112.3-139.0 141.7 60.6 2.9 -4.4 18 23 A A E -B 9 0A 10 -2,-0.3 -9,-0.2 -9,-0.2 -10,-0.1 -0.459 30.4-123.1 -72.3 135.8 57.3 2.7 -2.5 19 24 A N >> - 0 0 24 -11,-2.9 4,-2.4 -2,-0.2 3,-0.9 -0.783 15.4-153.3 -78.7 109.7 57.2 0.5 0.6 20 25 A P H 3> S+ 0 0 74 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.774 95.1 56.9 -54.2 -35.4 54.3 -2.0 -0.1 21 26 A E H 3> S+ 0 0 115 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.851 109.1 45.9 -62.5 -40.6 53.8 -2.4 3.6 22 27 A A H <> S+ 0 0 0 -3,-0.9 4,-2.4 -15,-0.3 -1,-0.2 0.908 111.3 51.1 -67.6 -45.6 53.3 1.4 4.0 23 28 A L H X S+ 0 0 17 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.841 106.6 56.2 -55.4 -41.0 50.9 1.5 1.0 24 29 A K H X S+ 0 0 144 -4,-1.8 4,-0.6 -5,-0.2 -1,-0.2 0.939 107.9 47.1 -62.6 -42.0 48.9 -1.3 2.5 25 30 A I H >X S+ 0 0 58 -4,-1.6 3,-1.2 1,-0.2 4,-0.6 0.926 111.1 52.7 -61.2 -42.9 48.4 0.8 5.7 26 31 A L H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.3 -2,-0.2 0.897 102.5 58.6 -59.7 -38.8 47.5 3.8 3.6 27 32 A S H 3< S+ 0 0 55 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.643 101.8 54.7 -74.3 -12.8 44.8 1.8 1.7 28 33 A A H << S+ 0 0 77 -3,-1.2 2,-0.9 -4,-0.6 -1,-0.3 0.636 86.1 92.1 -91.6 -13.0 43.0 1.0 4.9 29 34 A I << + 0 0 4 -3,-1.4 242,-2.2 -4,-0.6 -1,-0.1 -0.696 45.3 173.4 -93.1 103.5 42.6 4.6 6.0 30 35 A T + 0 0 103 -2,-0.9 -1,-0.2 240,-0.2 -3,-0.0 0.623 47.8 98.9 -84.6 -13.9 39.3 6.0 4.7 31 36 A Q S S- 0 0 62 1,-0.1 240,-0.5 239,-0.1 55,-0.1 -0.384 82.9 -96.8 -79.7 152.1 39.5 9.3 6.6 32 37 A P - 0 0 31 0, 0.0 55,-2.6 0, 0.0 2,-0.4 -0.307 45.0-135.3 -66.9 151.5 40.6 12.6 5.0 33 38 A M E -c 87 0A 0 236,-2.6 228,-3.2 228,-0.3 2,-0.6 -0.915 19.2-156.5-120.4 137.2 44.2 13.5 5.6 34 39 A V E -c 88 0A 0 53,-2.7 55,-3.1 -2,-0.4 2,-0.6 -0.939 26.2-158.9 -98.8 120.3 46.3 16.6 6.6 35 40 A V E -c 89 0A 0 -2,-0.6 84,-3.7 224,-0.4 85,-2.4 -0.893 12.7-177.9-111.2 115.8 49.8 15.9 5.3 36 41 A V E -cd 90 120A 0 53,-2.6 55,-2.9 -2,-0.6 2,-0.3 -0.970 6.4-176.4-113.8 116.8 52.8 17.8 6.8 37 42 A A E -cd 91 121A 0 83,-2.1 85,-3.2 -2,-0.5 2,-0.4 -0.855 10.5-152.9-111.0 151.0 56.3 17.2 5.3 38 43 A I E +cd 92 122A 0 53,-1.9 55,-0.5 -2,-0.3 2,-0.3 -0.977 16.2 172.0-124.9 132.2 59.6 18.5 6.5 39 44 A V E + d 0 123A 1 83,-2.6 85,-2.9 -2,-0.4 2,-0.2 -0.904 17.0 113.4-130.4 160.5 62.7 19.1 4.3 40 45 A G E - d 0 124A 0 -2,-0.3 56,-2.6 54,-0.3 85,-0.1 -0.857 65.1 -39.8 162.5 176.1 66.1 20.8 4.9 41 46 A L B S-h 96 0B 46 83,-0.5 3,-0.4 54,-0.3 5,-0.2 -0.187 74.3 -91.6 -57.2 155.6 69.9 20.2 5.1 42 47 A Y S S+ 0 0 6 54,-2.4 -1,-0.1 1,-0.2 376,-0.1 -0.223 105.4 25.7 -76.1 148.6 70.9 17.0 7.0 43 48 A R S S+ 0 0 45 19,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.849 84.1 122.6 68.5 50.6 71.6 17.0 10.7 44 49 A T S S- 0 0 11 -3,-0.4 -1,-0.1 -4,-0.1 -2,-0.1 0.160 86.8 -96.6-133.4 7.0 69.4 20.0 11.3 45 50 A G S > S+ 0 0 30 17,-0.1 4,-1.6 119,-0.1 5,-0.2 0.622 76.8 137.4 87.4 19.0 66.8 18.7 13.8 46 51 A K H > S+ 0 0 11 -5,-0.2 4,-1.8 1,-0.2 3,-0.1 0.925 70.5 47.9 -63.4 -46.3 64.1 17.8 11.4 47 52 A S H > S+ 0 0 10 1,-0.2 4,-1.7 2,-0.2 13,-0.3 0.842 108.6 55.3 -69.5 -33.5 63.1 14.4 12.9 48 53 A Y H > S+ 0 0 8 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.904 107.8 47.9 -63.8 -43.2 63.0 15.8 16.4 49 54 A L H X S+ 0 0 1 -4,-1.6 4,-1.2 1,-0.2 3,-0.5 0.865 108.3 55.5 -68.9 -35.5 60.5 18.5 15.4 50 55 A M H X S+ 0 0 1 -4,-1.8 4,-1.0 1,-0.2 3,-0.2 0.881 102.3 56.2 -62.6 -39.8 58.3 16.0 13.6 51 56 A N H <>S+ 0 0 2 -4,-1.7 5,-2.0 1,-0.2 -1,-0.2 0.750 101.6 58.2 -62.5 -27.7 58.0 13.9 16.8 52 57 A K H ><5S+ 0 0 29 -4,-0.8 3,-1.2 -3,-0.5 -1,-0.2 0.882 100.4 56.0 -74.9 -23.8 56.7 16.9 18.6 53 58 A L H 3<5S+ 0 0 4 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.793 107.7 48.9 -72.5 -29.1 53.9 17.1 16.0 54 59 A A T 3<5S- 0 0 16 -4,-1.0 -1,-0.3 2,-0.2 -2,-0.2 0.361 111.2-125.4 -86.2 -4.1 53.0 13.5 17.0 55 60 A G T < 5S+ 0 0 66 -3,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.714 70.9 120.9 63.2 25.9 53.1 14.5 20.7 56 61 A K < - 0 0 124 -5,-2.0 -1,-0.2 1,-0.1 -2,-0.2 -0.848 64.3-141.6-116.5 154.7 55.6 11.7 21.4 57 62 A K S S+ 0 0 79 -2,-0.3 2,-0.3 1,-0.1 177,-0.1 0.675 93.3 33.2 -77.2 -27.2 59.1 11.8 22.8 58 63 A K S S+ 0 0 141 -7,-0.1 2,-0.1 175,-0.1 -1,-0.1 -0.968 73.6 100.9-140.6 150.8 60.3 9.0 20.5 59 64 A G S S+ 0 0 18 -2,-0.3 2,-0.3 1,-0.3 -11,-0.1 -0.466 73.6 44.4 170.2-119.5 59.2 8.3 16.9 60 65 A F S S- 0 0 4 -13,-0.3 -1,-0.3 -2,-0.1 -9,-0.1 -0.600 94.9-117.5 -57.9 119.4 61.2 9.2 13.9 61 66 A S - 0 0 59 -2,-0.3 -14,-0.1 1,-0.1 9,-0.1 -0.445 23.6-157.2 -76.3 147.3 64.7 8.3 15.1 62 67 A L - 0 0 26 -2,-0.1 8,-0.3 -15,-0.1 7,-0.1 0.931 14.4-146.2 -91.9 -60.6 67.3 11.0 15.4 63 68 A G - 0 0 25 6,-0.1 6,-0.1 166,-0.1 7,-0.1 0.583 5.6-137.2 84.7 135.7 70.8 9.7 15.3 64 69 A S + 0 0 40 395,-0.1 396,-2.8 165,-0.1 2,-0.2 0.343 68.0 72.5-102.5 -15.0 73.7 11.2 17.2 65 70 A T B S-i 460 0C 26 2,-0.3 396,-0.2 394,-0.2 398,-0.1 -0.506 91.9 -91.9-102.8-172.0 76.7 11.4 14.9 66 71 A V S S+ 0 0 2 394,-1.6 2,-0.2 396,-0.5 397,-0.1 0.666 96.7 93.9 -73.8 -17.4 77.9 13.4 11.9 67 72 A Q S S- 0 0 29 395,-0.5 -2,-0.3 1,-0.1 -24,-0.1 -0.556 86.5-101.8 -78.3 151.2 76.3 10.8 9.5 68 73 A S + 0 0 10 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.190 36.7 179.8 -64.3 152.6 72.9 11.1 8.1 69 74 A H + 0 0 83 1,-0.2 2,-0.2 -7,-0.1 -1,-0.1 0.711 55.9 70.7-123.6 -61.5 70.2 9.0 9.7 70 75 A T - 0 0 17 -8,-0.3 25,-0.4 23,-0.2 2,-0.4 -0.532 65.1-169.1 -64.5 124.6 66.8 9.4 8.2 71 76 A K - 0 0 83 -2,-0.2 -62,-0.1 23,-0.1 2,-0.1 -0.974 49.4 -18.6-117.2 138.9 66.8 7.8 4.7 72 77 A G S S- 0 0 0 -2,-0.4 22,-2.0 -62,-0.1 2,-0.4 -0.359 106.6 -42.8 71.2-145.0 64.1 8.1 2.1 73 78 A I E -AE 9 93A 0 -64,-2.5 -65,-2.7 20,-0.2 -64,-2.1 -0.996 54.8-163.4-128.2 122.0 60.7 9.3 3.3 74 79 A W E -AE 7 92A 90 18,-2.9 18,-1.7 -2,-0.4 2,-0.3 -0.847 6.3-153.3-101.8 153.2 59.0 8.0 6.5 75 80 A M E -AE 6 91A 0 -69,-3.0 -69,-2.1 -2,-0.3 2,-0.4 -0.915 11.9-172.2-127.5 148.6 55.4 8.4 7.4 76 81 A W E - E 0 90A 3 14,-1.6 14,-2.7 -2,-0.3 2,-0.7 -0.942 8.9-161.8-141.1 110.4 53.4 8.5 10.7 77 82 A C E + E 0 89A 0 -2,-0.4 -75,-0.9 12,-0.2 12,-0.2 -0.896 23.0 159.4 -96.5 111.4 49.6 8.4 10.7 78 83 A V E - E 0 88A 20 10,-2.6 10,-3.2 -2,-0.7 -2,-0.1 -0.928 48.3 -85.9-126.4 155.5 48.0 9.7 13.9 79 84 A P E - E 0 87A 82 0, 0.0 8,-0.2 0, 0.0 -1,-0.0 -0.293 53.0-104.8 -56.6 135.0 44.6 11.0 14.8 80 85 A H - 0 0 13 6,-2.1 6,-0.2 3,-0.4 5,-0.1 -0.666 25.1-145.4 -66.8 124.5 44.3 14.7 14.2 81 86 A P S S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 174,-0.0 0.737 93.3 22.1 -70.8 -12.9 44.5 16.4 17.6 82 87 A K S S+ 0 0 124 1,-0.2 -2,-0.0 173,-0.1 174,-0.0 0.623 112.9 66.4-127.6 -24.1 42.1 19.2 16.6 83 88 A K S > S- 0 0 55 3,-0.1 3,-1.9 172,-0.0 -3,-0.4 -0.840 75.7-141.3-110.2 103.0 40.1 18.0 13.6 84 89 A P T 3 S+ 0 0 119 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.185 86.7 18.7 -61.3 137.2 37.7 15.1 14.5 85 90 A G T 3 S+ 0 0 56 1,-0.2 2,-0.3 -5,-0.1 -2,-0.0 0.468 104.2 110.8 77.5 4.8 37.5 12.4 11.8 86 91 A H < - 0 0 44 -3,-1.9 -6,-2.1 -6,-0.2 2,-0.4 -0.815 59.9-138.7-103.9 156.0 40.7 13.6 10.2 87 92 A I E -cE 33 79A 3 -55,-2.6 -53,-2.7 -2,-0.3 2,-0.6 -0.912 8.9-144.2-110.0 132.7 44.1 11.8 10.1 88 93 A L E -cE 34 78A 0 -10,-3.2 -10,-2.6 -2,-0.4 2,-0.6 -0.862 16.5-164.6 -94.5 111.0 47.4 13.7 10.6 89 94 A V E -cE 35 77A 0 -55,-3.1 -53,-2.6 -2,-0.6 2,-0.5 -0.928 1.9-160.4 -99.8 116.1 50.1 12.3 8.3 90 95 A L E -cE 36 76A 0 -14,-2.7 -14,-1.6 -2,-0.6 2,-0.6 -0.864 1.8-163.4 -99.8 124.2 53.7 13.3 9.2 91 96 A L E -cE 37 75A 1 -55,-2.9 -53,-1.9 -2,-0.5 2,-0.4 -0.939 4.4-171.5-110.9 107.7 56.3 12.9 6.5 92 97 A D E -cE 38 74A 1 -18,-1.7 -18,-2.9 -2,-0.6 2,-0.3 -0.818 16.5-155.7 -94.5 138.3 59.9 13.0 7.8 93 98 A T E - E 0 73A 1 -55,-0.5 2,-0.3 -2,-0.4 -20,-0.2 -0.793 23.7 -94.6-123.6 152.2 62.6 13.2 5.0 94 99 A E - 0 0 4 -22,-2.0 -54,-0.3 -2,-0.3 -23,-0.1 -0.519 54.8-111.1 -53.3 123.8 66.2 12.3 4.3 95 100 A G - 0 0 5 -25,-0.4 3,-0.4 -2,-0.3 -54,-0.3 -0.268 31.5-112.0 -64.2 151.1 68.3 15.5 4.9 96 101 A L B S+h 41 0B 1 -56,-2.6 -54,-2.4 1,-0.2 -1,-0.1 -0.462 87.9 31.7 -79.3 153.0 69.9 17.4 1.9 97 102 A G + 0 0 0 1,-0.2 324,-3.1 -56,-0.2 2,-0.3 0.716 67.3 173.8 80.0 27.6 73.6 17.7 1.2 98 103 A D > - 0 0 5 -3,-0.4 4,-2.8 322,-0.2 5,-0.3 -0.479 21.4-158.4 -73.1 118.0 74.8 14.4 2.6 99 104 A V T 4 S+ 0 0 4 320,-0.5 -1,-0.2 -2,-0.3 321,-0.1 0.671 91.2 60.7 -74.5 -20.3 78.5 14.1 1.7 100 105 A E T 4 S+ 0 0 68 1,-0.1 -1,-0.2 378,-0.0 -2,-0.1 0.891 115.5 33.6 -67.2 -40.2 78.4 10.3 2.2 101 106 A K T 4 S- 0 0 37 2,-0.0 -2,-0.2 -3,-0.0 -1,-0.1 0.884 81.2-171.5 -81.3 -48.8 75.8 10.1 -0.6 102 107 A G < + 0 0 19 -4,-2.8 2,-0.4 1,-0.1 -3,-0.1 0.850 38.8 127.5 54.6 51.2 77.0 13.0 -2.8 103 108 A D > + 0 0 52 -5,-0.3 4,-1.9 1,-0.1 -1,-0.1 -0.870 32.4 177.6-142.9 90.9 74.0 12.9 -5.1 104 109 A N H > S+ 0 0 68 -2,-0.4 4,-2.0 2,-0.2 -1,-0.1 0.794 83.2 58.0 -63.2 -39.5 72.1 16.2 -5.7 105 110 A Q H > S+ 0 0 126 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.956 106.2 48.3 -58.0 -49.7 69.7 14.7 -8.2 106 111 A N H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.955 109.5 54.5 -53.4 -47.0 68.5 12.2 -5.6 107 112 A D H X S+ 0 0 3 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.861 106.8 51.7 -49.1 -51.1 68.2 15.1 -3.1 108 113 A S H X S+ 0 0 11 -4,-2.0 4,-3.7 1,-0.2 -1,-0.2 0.888 107.5 50.4 -55.3 -51.5 65.9 16.9 -5.6 109 114 A W H X S+ 0 0 32 -4,-2.0 4,-2.3 -3,-0.2 -1,-0.2 0.867 112.4 46.8 -54.8 -50.1 63.6 14.0 -6.1 110 115 A I H X S+ 0 0 1 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.946 114.4 48.6 -58.5 -39.5 63.1 13.6 -2.3 111 116 A F H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.3 3,-0.2 0.974 112.8 47.8 -67.1 -43.5 62.6 17.3 -2.1 112 117 A A H X S+ 0 0 0 -4,-3.7 4,-2.8 1,-0.3 -1,-0.2 0.844 109.5 52.0 -64.6 -42.5 60.1 17.3 -4.9 113 118 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -1,-0.3 0.887 107.0 53.1 -63.4 -46.1 58.1 14.3 -3.5 114 119 A A H X S+ 0 0 0 -4,-2.0 4,-0.8 -3,-0.2 -2,-0.2 0.924 112.3 45.3 -52.9 -45.0 57.8 16.0 -0.1 115 120 A V H >< S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.968 114.5 48.7 -65.3 -42.3 56.3 19.1 -1.9 116 121 A L H 3< S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.722 115.8 41.6 -67.5 -31.3 54.0 17.0 -4.1 117 122 A L H 3< S+ 0 0 0 -4,-1.8 -1,-0.3 -3,-0.2 2,-0.2 0.474 100.7 83.2 -96.9 -13.4 52.6 14.9 -1.3 118 123 A S << - 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0 0 30 -7,-2.6 -7,-0.1 4,-0.0 3,-0.0 -0.962 10.5-140.1-123.3 146.1 86.8 10.1 13.9 469 197 B T > - 0 0 65 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.576 41.4-102.9 -81.0 167.1 89.2 12.9 14.5 470 198 B P H > S+ 0 0 36 0, 0.0 4,-1.9 0, 0.0 38,-0.2 0.916 125.0 51.1 -59.2 -37.3 88.3 16.2 12.9 471 199 B D H > S+ 0 0 48 36,-0.3 4,-2.1 1,-0.2 5,-0.2 0.864 108.1 50.1 -65.3 -45.4 90.9 15.5 10.3 472 200 B E H > S+ 0 0 101 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.840 106.2 58.0 -65.7 -25.6 89.6 12.0 9.5 473 201 B Y H X S+ 0 0 2 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.963 107.4 47.2 -68.9 -39.0 86.1 13.5 9.2 474 202 B L H X S+ 0 0 5 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.900 114.5 44.4 -66.6 -47.1 87.4 15.8 6.4 475 203 B T H >< S+ 0 0 89 -4,-2.1 3,-0.9 1,-0.2 4,-0.3 0.920 109.9 57.4 -71.2 -30.8 89.2 13.0 4.6 476 204 B Y H >< S+ 0 0 27 -4,-3.0 3,-1.0 1,-0.2 -1,-0.2 0.873 104.8 52.3 -52.2 -45.8 86.1 10.9 5.1 477 205 B S H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.708 113.3 43.2 -70.1 -18.2 84.1 13.6 3.3 478 206 B L T << S+ 0 0 4 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.237 84.7 134.3-108.0 10.1 86.5 13.6 0.3 479 207 B K < - 0 0 102 -3,-1.0 2,-0.2 -4,-0.3 16,-0.1 -0.350 53.4-121.3 -70.7 139.7 86.9 9.8 0.0 480 208 B L - 0 0 53 15,-0.1 2,-0.4 -2,-0.1 -1,-0.1 -0.491 15.4-117.5 -81.7 144.3 86.6 8.3 -3.4 481 209 B K - 0 0 66 7,-0.4 11,-0.1 -2,-0.2 -1,-0.1 -0.692 23.0-144.3 -71.0 126.6 84.1 5.7 -4.6 482 210 B K + 0 0 174 -2,-0.4 -1,-0.1 10,-0.0 -2,-0.0 0.799 61.9 109.4 -62.6 -39.6 86.2 2.6 -5.5 483 211 B G - 0 0 26 1,-0.1 -2,-0.1 -3,-0.0 0, 0.0 -0.031 63.0-148.0 -49.1 138.0 84.0 1.5 -8.5 484 212 B T + 0 0 138 4,-0.0 5,-0.2 5,-0.0 -1,-0.1 0.940 66.7 122.9 -51.6 -44.5 84.9 1.7 -12.1 485 213 B S S > S- 0 0 47 3,-0.2 4,-0.5 2,-0.1 0, 0.0 0.545 75.7-110.4 -23.8 156.7 81.1 2.3 -12.6 486 214 B Q H >> S+ 0 0 154 1,-0.2 3,-3.5 2,-0.2 4,-1.0 0.950 114.2 41.5 -56.3 -76.0 80.1 5.6 -14.4 487 215 B K H 3> S+ 0 0 127 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.742 102.0 71.3 -49.4 -35.8 78.6 7.6 -11.6 488 216 B D H 3> S+ 0 0 25 2,-0.2 4,-1.7 3,-0.2 -7,-0.4 0.845 102.5 48.0 -39.9 -25.6 81.4 6.4 -9.4 489 217 B E H X S+ 0 0 20 -4,-1.7 4,-2.9 -5,-0.3 3,-0.6 0.840 96.4 72.8 -70.5 -30.3 84.8 11.1 -7.7 493 221 B L H 3X S+ 0 0 82 -4,-2.1 4,-2.1 1,-0.3 -1,-0.2 0.804 97.0 42.9 -74.1 -44.0 85.8 13.9 -9.9 494 222 B P H 3> S+ 0 0 16 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.790 115.7 52.1 -57.7 -47.5 85.1 17.0 -7.8 495 223 B R H + 0 0 46 -352,-1.4 3,-1.9 -2,-0.3 4,-0.2 0.287 58.2 116.7-101.4 12.8 75.4 36.2 20.6 520 248 B A T 3 S+ 0 0 33 1,-0.3 3,-0.2 -353,-0.3 -1,-0.2 0.669 78.3 40.0 -59.9 -30.5 74.7 40.0 20.7 521 249 B Q T > S+ 0 0 110 -3,-0.3 3,-2.1 1,-0.1 -1,-0.3 0.391 78.7 117.8-102.8 14.2 77.4 40.9 23.2 522 250 B L G X + 0 0 18 -3,-1.9 3,-1.8 1,-0.3 -1,-0.1 0.716 61.5 66.8 -57.5 -44.6 80.2 38.6 21.9 523 251 B E G 3 S+ 0 0 70 1,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.777 107.1 42.8 -49.8 -27.3 82.8 41.2 20.9 524 252 B K G < S+ 0 0 156 -3,-2.1 2,-0.4 2,-0.1 -1,-0.3 -0.007 84.1 109.1-122.1 36.3 83.2 42.2 24.6 525 253 B L < - 0 0 18 -3,-1.8 2,-0.1 2,-0.0 5,-0.0 -0.892 60.0-135.4-110.6 126.2 83.3 38.9 26.6 526 254 B Q >> - 0 0 126 -2,-0.4 3,-1.9 1,-0.1 4,-0.7 -0.460 32.2 -98.9 -74.0 163.8 86.7 37.8 28.1 527 255 B D G >4 S+ 0 0 67 1,-0.3 3,-0.8 2,-0.2 8,-0.2 0.784 122.1 61.7 -53.2 -35.0 87.9 34.2 27.7 528 256 B E G 34 S+ 0 0 166 1,-0.2 -1,-0.3 7,-0.0 7,-0.0 0.826 102.6 50.8 -68.2 -20.3 86.6 33.5 31.3 529 257 B E G <4 S+ 0 0 96 -3,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.623 101.4 79.7 -94.0 -5.9 83.1 34.3 30.2 530 258 B L S << S- 0 0 9 -3,-0.8 -16,-0.2 -4,-0.7 5,-0.0 -0.495 102.1 -77.9 -91.7 167.5 83.3 32.0 27.1 531 259 B D > - 0 0 4 -18,-2.7 4,-2.0 -2,-0.2 3,-0.4 -0.425 43.8-134.5 -64.1 126.1 82.9 28.2 26.9 532 260 B P H > S+ 0 0 95 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.806 102.9 49.4 -66.7 -21.1 86.3 26.8 28.2 533 261 B E H > S+ 0 0 93 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.838 105.8 56.0 -88.9 -25.6 86.7 24.3 25.4 534 262 B F H > S+ 0 0 0 -3,-0.4 4,-2.3 -22,-0.2 5,-0.2 0.941 106.6 52.6 -59.1 -47.1 85.8 26.9 22.8 535 263 B V H X S+ 0 0 40 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.919 112.4 43.9 -54.4 -45.5 88.8 28.9 24.2 536 264 B Q H X S+ 0 0 103 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.884 111.1 53.5 -66.6 -46.7 91.1 25.9 23.9 537 265 B Q H X S+ 0 0 22 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.839 109.7 48.7 -56.5 -43.8 89.8 25.0 20.4 538 266 B V H X S+ 0 0 11 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.890 110.4 51.3 -61.8 -42.5 90.6 28.6 19.3 539 267 B A H X S+ 0 0 47 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.881 110.3 48.4 -59.5 -48.2 94.1 28.4 20.8 540 268 B D H X S+ 0 0 84 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.864 113.6 48.1 -59.8 -42.5 94.9 25.1 19.0 541 269 B F H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.895 113.0 45.8 -62.1 -57.6 93.6 26.6 15.7 542 270 B C H X S+ 0 0 12 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.884 112.3 52.6 -49.7 -48.5 95.6 29.8 16.0 543 271 B S H X S+ 0 0 63 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.877 108.9 49.3 -63.7 -35.7 98.7 27.9 17.0 544 272 B Y H X S+ 0 0 47 -4,-1.8 4,-1.4 2,-0.2 5,-0.4 0.889 112.3 48.1 -64.0 -48.0 98.4 25.6 14.0 545 273 B I H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 3,-0.3 0.936 113.1 48.3 -58.4 -48.0 98.0 28.6 11.6 546 274 B F H < S+ 0 0 33 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.827 119.0 39.2 -58.1 -38.0 101.0 30.4 13.3 547 275 B S H < S+ 0 0 49 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.634 128.2 25.7 -82.9 -29.4 103.2 27.3 13.0 548 276 B N H < S+ 0 0 85 -4,-1.4 -3,-0.2 -3,-0.3 -2,-0.2 0.647 81.0 107.8-120.0 -31.5 102.2 25.9 9.6 549 277 B S < - 0 0 1 -4,-2.0 2,-0.2 -5,-0.4 -139,-0.1 -0.453 63.8-134.8 -62.2 127.1 100.8 28.6 7.2 550 278 B K - 0 0 61 -141,-0.3 -225,-0.4 -2,-0.1 2,-0.2 -0.523 22.5 -89.9 -85.1 158.0 103.5 29.2 4.6 551 279 B T - 0 0 24 -2,-0.2 -227,-0.3 -227,-0.2 -1,-0.1 -0.433 53.2-103.7 -56.9 135.1 104.8 32.4 3.1 552 280 B K - 0 0 9 -229,-3.2 8,-2.8 8,-0.2 2,-0.3 -0.330 46.8-164.2 -66.9 143.1 102.7 33.4 0.1 553 281 B T B -V 559 0J 30 6,-0.3 6,-0.2 -107,-0.2 2,-0.2 -0.919 18.3-134.1-141.0 139.1 104.5 32.7 -3.1 554 282 B L > - 0 0 50 4,-3.4 3,-2.5 -2,-0.3 2,-0.2 -0.580 49.0 -85.2 -84.0 160.4 104.4 33.6 -6.8 555 283 B S T 3 S+ 0 0 90 1,-0.3 3,-0.2 -2,-0.2 -1,-0.1 -0.552 125.1 43.6 -68.2 123.7 104.7 30.9 -9.5 556 284 B G T 3 S- 0 0 85 -2,-0.2 -1,-0.3 -112,-0.1 0, 0.0 0.127 127.9 -90.2 114.3 -25.8 108.5 30.7 -9.9 557 285 B G S < S+ 0 0 37 -3,-2.5 -2,-0.1 1,-0.3 -1,-0.1 0.335 75.2 148.9 108.0 -4.8 108.9 30.7 -6.1 558 286 B I - 0 0 95 -3,-0.2 -4,-3.4 -5,-0.1 -1,-0.3 -0.387 49.3-116.8 -65.6 134.7 109.3 34.4 -5.4 559 287 B Q B -V 553 0J 102 -6,-0.2 2,-0.4 -2,-0.1 -6,-0.3 -0.563 24.2-123.0 -79.9 137.6 107.9 35.5 -2.0 560 288 B V + 0 0 0 -8,-2.8 -237,-2.7 -2,-0.3 -8,-0.2 -0.632 36.7 166.7 -86.4 117.4 105.0 37.9 -1.9 561 289 B N > - 0 0 20 -2,-0.4 4,-2.7 -239,-0.3 5,-0.3 -0.564 55.3 -70.1-107.9-165.9 105.4 41.1 0.0 562 290 B G H > S+ 0 0 0 -243,-2.4 4,-2.8 -241,-0.5 5,-0.2 0.908 130.7 44.2 -53.7 -60.4 103.3 44.2 0.1 563 291 B P H > S+ 0 0 48 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.880 115.1 50.6 -57.2 -32.2 104.0 45.6 -3.4 564 292 B R H > S+ 0 0 108 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.900 110.9 47.3 -79.0 -31.8 103.6 42.1 -4.9 565 293 B L H X S+ 0 0 2 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.928 109.3 54.9 -68.6 -42.5 100.3 41.5 -3.2 566 294 B E H X S+ 0 0 50 -4,-2.8 4,-2.1 -5,-0.3 -2,-0.2 0.938 108.5 49.2 -55.4 -39.2 99.1 44.9 -4.4 567 295 B S H X S+ 0 0 69 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.906 110.9 49.2 -74.9 -32.4 100.0 43.8 -7.9 568 296 B L H X S+ 0 0 20 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.852 107.8 54.3 -64.9 -52.4 98.1 40.5 -7.6 569 297 B V H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.971 113.1 42.6 -46.8 -53.0 95.0 42.2 -6.2 570 298 B L H X S+ 0 0 65 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.891 113.2 51.7 -64.4 -49.9 94.9 44.6 -9.2 571 299 B T H X S+ 0 0 46 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.965 116.0 41.0 -47.7 -50.0 95.6 41.9 -11.8 572 300 B Y H X S+ 0 0 19 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.932 115.0 49.2 -77.0 -35.9 92.8 39.6 -10.4 573 301 B V H X S+ 0 0 6 -4,-3.0 4,-2.3 -5,-0.3 -1,-0.2 0.891 113.0 48.3 -66.2 -43.3 90.3 42.4 -9.9 574 302 B N H X S+ 0 0 94 -4,-2.5 4,-0.6 -5,-0.3 -1,-0.2 0.863 107.7 55.0 -59.8 -46.7 90.9 43.7 -13.5 575 303 B A H X S+ 0 0 8 -4,-2.1 4,-0.6 -5,-0.2 -2,-0.2 0.825 113.8 42.5 -57.7 -30.4 90.6 40.1 -14.8 576 304 B I H < S+ 0 0 18 -4,-1.7 -2,-0.2 1,-0.2 4,-0.2 0.819 104.8 61.9 -81.5 -39.0 87.2 39.9 -13.2 577 305 B S H < S+ 0 0 69 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.599 101.8 61.9 -62.6 -14.7 86.1 43.5 -14.2 578 306 B S H < S- 0 0 83 -4,-0.6 -2,-0.2 -3,-0.2 -3,-0.1 0.936 106.2 -88.7 -74.6 -93.4 86.4 42.3 -17.8 579 307 B G S < S+ 0 0 59 -4,-0.6 -3,-0.1 2,-0.0 -2,-0.1 -0.064 71.9 106.3 164.3 88.6 84.1 39.4 -18.8 580 308 B D 0 0 61 -4,-0.2 -4,-0.1 -5,-0.1 -5,-0.0 0.616 360.0 360.0-122.9 -51.3 84.5 35.6 -18.6 581 309 B L 0 0 72 -5,-0.1 -145,-0.1 -148,-0.1 -144,-0.0 -0.381 360.0 360.0 25.1 360.0 82.6 33.6 -16.0