==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-DEC-10 3PUP . COMPND 2 MOLECULE: GLYCOGEN SYNTHASE KINASE-3 BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.FILIPPAKOPOULOS,K.KRALING,L.O.ESSEN,E.MEGGERS,S.KNAPP . 693 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30960.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 428 61.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 16.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 2 0.3 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 . 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 . 33 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 9 2 0 3 1 0 4 0 2 0 0 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 3 6 0 2 0 6 4 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 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 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 35 A S 0 0 140 0, 0.0 2,-0.4 0, 0.0 22,-0.0 0.000 360.0 360.0 360.0 -37.5 22.3 -40.4 -12.7 2 36 A K - 0 0 149 23,-0.0 2,-0.6 2,-0.0 22,-0.5 -0.783 360.0-165.6-109.0 127.4 25.6 -38.4 -12.8 3 37 A V E -A 23 0A 87 -2,-0.4 2,-0.4 20,-0.1 20,-0.2 -0.891 7.6-166.1-109.7 105.0 28.1 -37.6 -10.0 4 38 A T E -A 22 0A 42 18,-2.4 18,-2.5 -2,-0.6 2,-0.4 -0.771 5.9-166.1 -89.0 132.7 30.6 -34.9 -10.7 5 39 A T E +A 21 0A 70 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.972 13.7 165.4-123.4 132.7 33.6 -34.7 -8.3 6 40 A V E -A 20 0A 29 14,-2.5 14,-2.2 -2,-0.4 2,-0.6 -0.900 39.4-117.5-142.7 164.8 35.9 -31.8 -8.0 7 41 A V E +A 19 0A 101 -2,-0.3 2,-0.4 12,-0.2 76,-0.3 -0.927 44.0 179.7-111.3 106.9 38.6 -30.3 -5.8 8 42 A A E -A 18 0A 1 10,-2.0 10,-1.9 -2,-0.6 74,-0.2 -0.890 27.9-131.2-119.9 135.5 37.3 -26.9 -4.6 9 43 A T E -B 81 0A 21 72,-1.6 72,-2.2 -2,-0.4 2,-0.2 -0.571 36.6-112.1 -73.1 141.6 38.7 -24.2 -2.3 10 44 A P E -B 80 0A 21 0, 0.0 70,-0.3 0, 0.0 69,-0.1 -0.522 18.4-121.8 -79.9 149.9 36.2 -22.9 0.3 11 45 A G S S+ 0 0 1 68,-1.6 2,-0.2 67,-0.3 68,-0.1 0.904 90.1 14.7 -55.6 -52.7 34.8 -19.4 0.1 12 46 A Q S S+ 0 0 47 66,-0.3 57,-0.1 67,-0.2 56,-0.0 -0.544 102.2 43.4-117.9 178.3 36.0 -18.2 3.4 13 47 A G S S- 0 0 60 -2,-0.2 2,-0.0 55,-0.2 0, 0.0 -0.230 101.1 -18.9 78.3-169.2 38.5 -19.5 6.0 14 48 A P S S- 0 0 107 0, 0.0 2,-1.8 0, 0.0 -2,-0.0 -0.236 74.4 -98.2 -72.0 160.3 42.0 -20.8 5.2 15 49 A D S S+ 0 0 102 -6,-0.1 -2,-0.1 1,-0.1 -6,-0.1 -0.473 70.5 136.2 -84.0 74.4 42.9 -22.0 1.7 16 50 A R - 0 0 60 -2,-1.8 -8,-0.1 -6,-0.1 -1,-0.1 -0.852 41.5-149.2-131.3 89.9 42.4 -25.8 2.2 17 51 A P - 0 0 68 0, 0.0 2,-0.3 0, 0.0 -8,-0.2 -0.221 15.0-171.0 -67.4 151.0 40.6 -27.5 -0.8 18 52 A Q E -A 8 0A 93 -10,-1.9 -10,-2.0 -12,-0.0 2,-0.7 -0.846 33.3 -88.7-138.5 168.7 38.4 -30.6 -0.4 19 53 A E E -A 7 0A 148 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.733 43.5-175.7 -83.5 109.7 36.6 -33.1 -2.5 20 54 A V E -A 6 0A 10 -14,-2.2 -14,-2.5 -2,-0.7 2,-0.3 -0.847 2.1-169.9-102.1 146.0 33.1 -31.8 -3.3 21 55 A S E +A 5 0A 24 -2,-0.4 21,-2.7 -16,-0.2 22,-0.4 -0.997 8.9 168.9-141.5 134.6 30.7 -34.1 -5.1 22 56 A Y E -AC 4 41A 23 -18,-2.5 -18,-2.4 -2,-0.3 2,-0.3 -0.941 10.0-174.0-147.2 164.8 27.3 -33.2 -6.7 23 57 A T E +AC 3 40A 24 17,-1.6 17,-2.1 -2,-0.3 -20,-0.1 -0.911 55.2 58.1-153.5 170.4 24.5 -34.5 -9.0 24 58 A D E - 0 0 73 -22,-0.5 2,-0.7 -2,-0.3 -1,-0.2 0.989 65.7-166.1 63.4 63.4 21.3 -33.6 -10.7 25 59 A T E + 0 0 60 -23,-0.1 2,-0.3 14,-0.1 14,-0.2 -0.734 12.9 171.6 -92.6 111.2 22.8 -30.7 -12.6 26 60 A K E - C 0 38A 126 12,-2.0 12,-2.9 -2,-0.7 2,-0.4 -0.897 35.0-116.5-116.8 144.1 20.1 -28.3 -14.1 27 61 A V E - C 0 37A 91 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.647 23.9-177.3 -73.6 130.7 20.5 -25.0 -15.8 28 62 A I E - 0 0 86 8,-3.0 2,-0.3 1,-0.4 9,-0.2 0.722 63.7 -54.5 -91.4 -35.4 18.7 -22.3 -13.9 29 63 A G E - C 0 36A 26 7,-1.7 7,-3.0 -3,-0.1 -1,-0.4 -0.954 46.7-142.9 175.2 172.8 19.6 -19.7 -16.5 30 64 A N E + C 0 35A 115 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.979 28.7 128.0-156.5 154.6 22.2 -17.9 -18.6 31 65 A G E > S- C 0 34A 29 3,-1.7 3,-1.7 -2,-0.3 -2,-0.0 -0.747 77.8 -30.2-168.3-146.9 23.1 -14.5 -20.0 32 66 A S T 3 S+ 0 0 38 1,-0.3 3,-0.1 -2,-0.2 542,-0.0 0.857 130.2 64.6 -57.7 -36.9 26.0 -11.9 -20.0 33 67 A F T 3 S- 0 0 76 1,-0.2 2,-0.5 20,-0.1 -1,-0.3 0.568 112.3-119.3 -60.0 -15.1 26.9 -13.4 -16.7 34 68 A G E < -C 31 0A 23 -3,-1.7 -3,-1.7 19,-0.1 2,-0.3 -0.944 57.6 -31.5 107.0-129.1 27.7 -16.8 -18.2 35 69 A V E -CD 30 52A 37 17,-1.7 17,-2.9 -2,-0.5 2,-0.4 -0.991 46.1-157.5-133.6 142.7 25.6 -19.8 -16.9 36 70 A V E -CD 29 51A 33 -7,-3.0 -8,-3.0 -2,-0.3 -7,-1.7 -0.978 16.8-173.8-121.3 127.9 24.0 -20.6 -13.6 37 71 A Y E -CD 27 50A 57 13,-2.3 13,-1.7 -2,-0.4 2,-0.4 -0.664 18.4-138.5-112.3 165.9 23.2 -24.2 -12.6 38 72 A Q E +CD 26 49A 32 -12,-2.9 -12,-2.0 -2,-0.2 2,-0.3 -0.931 31.8 159.6-114.8 150.9 21.4 -25.9 -9.8 39 73 A A E - D 0 48A 1 9,-1.9 9,-2.4 -2,-0.4 2,-0.5 -0.946 35.1-115.8-159.5 175.7 22.8 -29.1 -8.2 40 74 A K E -CD 23 47A 90 -17,-2.1 -17,-1.6 -2,-0.3 2,-0.3 -0.977 25.4-125.9-127.8 118.9 22.6 -31.2 -5.1 41 75 A L E > -C 22 0A 13 5,-3.0 4,-2.5 -2,-0.5 5,-0.3 -0.541 16.8-140.6 -68.1 125.3 25.6 -31.8 -2.8 42 76 A C T 4 S+ 0 0 59 -21,-2.7 -1,-0.2 -2,-0.3 -20,-0.1 0.791 94.8 50.5 -56.0 -35.0 26.0 -35.6 -2.4 43 77 A D T 4 S+ 0 0 141 -22,-0.4 -1,-0.2 1,-0.1 -21,-0.0 1.000 125.9 17.3 -67.7 -69.7 26.9 -35.3 1.3 44 78 A S T 4 S- 0 0 74 2,-0.1 -2,-0.2 1,-0.1 -1,-0.1 0.694 91.4-129.1 -78.7 -21.3 24.1 -33.2 2.8 45 79 A G < + 0 0 31 -4,-2.5 2,-0.2 1,-0.3 -3,-0.1 0.570 61.4 149.8 75.1 12.0 21.6 -33.6 -0.1 46 80 A E - 0 0 83 -5,-0.3 -5,-3.0 -6,-0.1 -1,-0.3 -0.548 47.7-118.4 -87.1 139.0 21.5 -29.9 0.1 47 81 A L E +D 40 0A 74 -2,-0.2 53,-0.7 -7,-0.2 2,-0.3 -0.427 35.0 175.7 -79.1 150.7 20.9 -27.8 -2.9 48 82 A V E -DE 39 99A 2 -9,-2.4 -9,-1.9 51,-0.2 2,-0.4 -0.935 25.4-124.7-145.9 166.1 23.4 -25.3 -4.3 49 83 A A E -DE 38 98A 10 49,-2.5 49,-3.1 -2,-0.3 2,-0.4 -0.905 15.8-156.5-112.3 144.4 23.9 -22.9 -7.2 50 84 A I E -DE 37 97A 5 -13,-1.7 -13,-2.3 -2,-0.4 2,-0.6 -0.956 3.3-164.4-121.7 113.0 26.9 -22.9 -9.6 51 85 A K E -DE 36 96A 13 45,-2.6 45,-2.7 -2,-0.4 2,-0.6 -0.867 9.5-164.7 -98.0 120.5 27.9 -19.8 -11.5 52 86 A K E +DE 35 95A 40 -17,-2.9 -17,-1.7 -2,-0.6 2,-0.3 -0.907 14.1 166.6-112.3 112.7 30.2 -20.4 -14.4 53 87 A V E - E 0 94A 23 41,-1.6 41,-2.4 -2,-0.6 2,-0.1 -0.927 41.0-102.4-119.0 152.0 32.2 -17.6 -16.0 54 88 A L E - E 0 93A 70 -2,-0.3 2,-0.7 39,-0.3 39,-0.3 -0.446 41.1-125.1 -63.8 137.8 35.1 -17.7 -18.4 55 89 A Q - 0 0 30 37,-3.7 37,-0.4 -2,-0.1 -1,-0.1 -0.838 13.6-127.2-104.9 118.1 38.4 -16.8 -16.7 56 90 A D - 0 0 61 -2,-0.7 5,-0.1 1,-0.1 -1,-0.0 -0.182 4.4-150.3 -42.8 126.8 40.7 -14.0 -17.8 57 91 A K S S+ 0 0 111 1,-0.1 -1,-0.1 553,-0.1 -2,-0.0 0.955 95.7 50.5 -60.7 -52.8 44.4 -15.0 -18.4 58 92 A R S S+ 0 0 85 552,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.830 112.4 29.2 -53.7 -51.0 45.4 -11.4 -17.5 59 93 A F S S- 0 0 74 1,-0.0 2,-0.2 0, 0.0 -3,-0.1 -0.788 74.1-108.4-130.2 158.1 43.7 -10.7 -14.2 60 94 A K - 0 0 71 -2,-0.3 2,-0.4 1,-0.1 -3,-0.0 -0.556 56.5 -91.7 -80.1 147.8 42.3 -12.3 -11.0 61 95 A N > - 0 0 26 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.506 30.2-157.0 -74.9 123.5 38.5 -12.4 -10.9 62 96 A R H > S+ 0 0 117 -2,-0.4 4,-2.3 2,-0.2 5,-0.2 0.908 92.4 50.9 -63.1 -50.0 36.9 -9.3 -9.2 63 97 A E H > S+ 0 0 16 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.931 111.3 50.6 -54.4 -48.8 33.6 -10.9 -8.3 64 98 A L H > S+ 0 0 10 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.924 108.7 50.6 -52.9 -51.0 35.5 -13.9 -6.7 65 99 A Q H X S+ 0 0 119 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.897 114.1 44.4 -61.9 -39.0 37.7 -11.6 -4.6 66 100 A I H >< S+ 0 0 16 -4,-2.3 3,-1.8 1,-0.2 4,-0.5 0.976 109.0 55.4 -66.2 -54.5 34.8 -9.7 -3.3 67 101 A M H >< S+ 0 0 4 -4,-3.1 3,-0.8 1,-0.3 11,-0.4 0.764 103.2 57.9 -49.5 -30.6 32.7 -12.8 -2.6 68 102 A R H 3< S+ 0 0 82 -4,-1.6 -1,-0.3 1,-0.2 -55,-0.2 0.778 103.7 51.2 -73.7 -25.8 35.5 -14.2 -0.4 69 103 A K T << S+ 0 0 136 -3,-1.8 2,-0.4 -4,-0.7 -1,-0.2 0.449 97.9 89.6 -86.2 -5.2 35.5 -11.2 1.9 70 104 A L < + 0 0 6 -3,-0.8 8,-0.3 -4,-0.5 2,-0.3 -0.837 36.5 155.2-108.0 133.5 31.7 -11.4 2.5 71 105 A D + 0 0 105 -2,-0.4 2,-0.3 6,-0.1 5,-0.1 -0.842 23.9 128.3-151.2 108.8 29.7 -13.3 5.1 72 106 A H > - 0 0 15 3,-0.4 3,-1.4 -2,-0.3 -2,-0.0 -0.945 60.2-119.1-167.8 139.6 26.3 -12.0 6.0 73 107 A C T 3 S+ 0 0 46 1,-0.3 4,-0.1 -2,-0.3 -1,-0.0 0.708 109.6 55.0 -71.2 -18.3 22.9 -13.7 6.2 74 108 A N T 3 S+ 0 0 2 89,-0.1 90,-2.4 56,-0.1 2,-0.3 -0.037 99.5 71.3 -97.3 35.4 21.3 -11.5 3.6 75 109 A I B < S-g 164 0B 3 -3,-1.4 -3,-0.4 88,-0.3 90,-0.2 -0.984 93.5-100.8-151.8 127.0 23.9 -12.2 0.8 76 110 A V - 0 0 8 88,-2.2 2,-0.4 -2,-0.3 -2,-0.1 -0.272 43.4-128.8 -55.0 131.4 24.4 -15.5 -1.1 77 111 A R - 0 0 91 -4,-0.1 22,-1.0 -6,-0.1 2,-0.8 -0.728 5.5-130.5 -92.2 131.7 27.3 -17.2 0.5 78 112 A L E + F 0 98A 1 -2,-0.4 -67,-0.3 -11,-0.4 -66,-0.3 -0.667 28.6 177.5 -74.3 108.4 30.2 -18.5 -1.6 79 113 A R E - 0 0 34 18,-2.7 -68,-1.6 -2,-0.8 2,-0.3 0.931 61.2 -18.9 -80.4 -46.9 30.6 -22.0 -0.4 80 114 A Y E -BF 10 97A 46 17,-1.5 17,-3.5 -70,-0.3 2,-0.3 -0.955 55.1-155.3-149.0 166.2 33.4 -23.1 -2.8 81 115 A F E +BF 9 96A 10 -72,-2.2 -72,-1.6 -2,-0.3 2,-0.3 -0.987 15.7 169.3-144.7 150.9 35.0 -22.2 -6.0 82 116 A F E - 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0 0 12 -2,-0.4 55,-0.1 1,-0.1 54,-0.1 -0.983 19.2-147.1-138.1 124.0 17.5 -19.7 -3.1 102 136 A P + 0 0 49 0, 0.0 2,-0.2 0, 0.0 54,-0.2 0.624 67.5 33.6 -80.0 -19.8 14.4 -20.8 -4.9 103 137 A E E -H 155 0B 50 52,-2.0 52,-1.9 4,-0.0 2,-0.3 -0.740 60.7-143.1-125.4 176.1 12.5 -17.6 -5.8 104 138 A T E > -H 154 0B 24 50,-0.3 4,-2.2 -2,-0.2 50,-0.2 -0.975 26.4-120.8-134.7 153.2 13.2 -14.0 -6.7 105 139 A V H > S+ 0 0 3 48,-2.7 4,-3.4 45,-0.6 5,-0.3 0.868 112.5 61.7 -58.7 -36.9 11.4 -10.8 -5.8 106 140 A Y H > S+ 0 0 95 44,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.940 107.2 42.4 -54.2 -52.9 10.9 -10.2 -9.5 107 141 A R H > S+ 0 0 112 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.929 116.8 46.6 -63.3 -47.1 8.8 -13.4 -10.0 108 142 A V H X S+ 0 0 25 -4,-2.2 4,-2.2 2,-0.2 3,-0.3 0.980 112.8 49.3 -59.4 -56.1 6.9 -12.9 -6.8 109 143 A A H X S+ 0 0 27 -4,-3.4 4,-2.1 1,-0.2 -1,-0.2 0.851 113.0 48.8 -45.9 -42.5 6.1 -9.3 -7.6 110 144 A R H X S+ 0 0 130 -4,-2.2 4,-3.2 -5,-0.3 5,-0.3 0.871 106.7 56.1 -70.1 -38.8 5.0 -10.3 -11.1 111 145 A H H X S+ 0 0 126 -4,-2.4 4,-1.4 -3,-0.3 -2,-0.2 0.940 109.6 45.2 -58.7 -46.2 2.8 -13.1 -9.6 112 146 A Y H <>S+ 0 0 72 -4,-2.2 5,-2.0 2,-0.2 -2,-0.2 0.928 115.1 49.3 -65.7 -39.5 1.0 -10.6 -7.5 113 147 A S H ><5S+ 0 0 56 -4,-2.1 3,-2.6 -5,-0.3 -2,-0.2 0.951 106.2 52.5 -63.7 -54.0 0.7 -8.2 -10.5 114 148 A R H 3<5S+ 0 0 115 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.813 110.6 52.3 -51.3 -31.5 -0.6 -10.8 -13.0 115 149 A A T 3<5S- 0 0 57 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.174 114.5-119.1 -88.8 16.1 -3.3 -11.6 -10.4 116 150 A K T < 5S+ 0 0 97 -3,-2.6 2,-0.3 1,-0.2 -3,-0.2 0.890 79.5 106.6 41.1 51.0 -4.3 -7.8 -10.1 117 151 A Q < - 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0 0 13 -21,-0.2 2,-0.2 -3,-0.1 50,-0.0 -0.186 36.2-150.3 -73.0 169.5 29.3 8.7 -8.1 201 235 A T > - 0 0 71 -26,-0.0 3,-1.6 -28,-0.0 4,-0.3 -0.625 40.2 -75.6-126.5-173.7 29.1 7.0 -4.6 202 236 A S T >> S+ 0 0 25 1,-0.3 3,-1.0 -2,-0.2 4,-0.8 0.679 109.2 89.8 -63.3 -15.0 27.4 4.0 -2.9 203 237 A S H 3> S+ 0 0 17 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.643 72.7 71.5 -60.2 -11.9 24.2 6.2 -2.8 204 238 A I H <> S+ 0 0 0 -3,-1.6 4,-2.2 2,-0.2 -1,-0.3 0.967 91.1 56.2 -64.1 -48.8 23.4 4.7 -6.2 205 239 A D H <> S+ 0 0 0 -3,-1.0 4,-1.9 -4,-0.3 -1,-0.2 0.830 109.0 49.4 -51.4 -32.6 22.6 1.4 -4.6 206 240 A V H X S+ 0 0 3 -4,-0.8 4,-3.1 2,-0.2 5,-0.3 0.931 103.1 55.6 -74.8 -49.2 20.1 3.2 -2.4 207 241 A W H X S+ 0 0 1 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.927 109.7 51.4 -49.6 -39.8 18.3 5.1 -5.1 208 242 A S H >X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 3,-1.0 0.968 106.9 49.9 -62.9 -52.8 17.8 1.6 -6.6 209 243 A A H 3X S+ 0 0 0 -4,-1.9 4,-2.9 1,-0.3 -1,-0.2 0.945 107.5 56.3 -50.4 -45.7 16.3 0.1 -3.4 210 244 A G H 3X S+ 0 0 0 -4,-3.1 4,-1.7 1,-0.2 -1,-0.3 0.819 107.7 48.5 -58.7 -29.7 14.0 3.2 -3.3 211 245 A C H X S+ 0 0 0 -4,-2.9 4,-2.1 -5,-0.2 3,-0.6 0.991 111.0 45.3 -63.7 -57.2 10.2 -0.2 -2.8 214 248 A A H 3X S+ 0 0 0 -4,-1.7 4,-2.9 1,-0.3 6,-0.3 0.900 110.9 56.0 -53.3 -40.8 8.0 2.0 -4.9 215 249 A E H 3X S+ 0 0 24 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.913 108.5 46.5 -58.1 -41.9 7.7 -0.9 -7.4 216 250 A L H << S+ 0 0 12 -4,-1.8 -97,-0.3 -3,-0.6 -1,-0.2 0.861 116.8 43.5 -71.9 -35.5 6.4 -3.2 -4.7 217 251 A L H < S+ 0 0 18 -4,-2.1 55,-0.3 1,-0.2 -1,-0.2 0.816 121.0 40.5 -75.8 -34.8 3.9 -0.7 -3.3 218 252 A L H < S- 0 0 51 -4,-2.9 -2,-0.2 -5,-0.3 -3,-0.2 0.781 97.2-131.1 -84.6 -31.9 2.8 0.4 -6.8 219 253 A G S < S+ 0 0 28 -4,-2.5 -3,-0.1 -5,-0.3 -4,-0.1 0.369 85.2 55.2 85.2 -3.2 2.6 -3.0 -8.6 220 254 A Q S S- 0 0 130 -6,-0.3 -2,-0.2 -5,-0.3 -1,-0.1 -0.983 103.2 -73.0-151.0 159.0 4.6 -1.5 -11.5 221 255 A P - 0 0 36 0, 0.0 -9,-0.1 0, 0.0 -33,-0.0 -0.161 33.4-148.4 -48.8 138.0 7.9 0.2 -12.0 222 256 A I S S+ 0 0 16 -11,-0.3 -10,-0.0 1,-0.2 -11,-0.0 0.920 90.0 30.0 -77.7 -43.1 7.9 3.8 -10.8 223 257 A F S S+ 0 0 5 -36,-0.4 -1,-0.2 -12,-0.1 12,-0.1 -0.391 81.9 162.7-117.8 61.8 10.4 5.3 -13.3 224 258 A P + 0 0 43 0, 0.0 10,-0.3 0, 0.0 2,-0.2 0.023 9.0 122.9 -70.1 179.7 10.1 3.3 -16.5 225 259 A G - 0 0 14 8,-0.1 -2,-0.0 9,-0.1 155,-0.0 -0.386 54.3-127.1 136.9 148.0 11.2 4.2 -20.0 226 260 A D S S+ 0 0 81 -2,-0.2 309,-1.2 -39,-0.0 2,-0.3 0.573 92.8 50.8 -97.9 -9.2 13.5 2.7 -22.6 227 261 A S B > S-L 534 0E 3 307,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.865 87.2-116.3-120.8 160.1 15.7 5.8 -23.1 228 262 A G H > S+ 0 0 11 303,-0.7 4,-3.3 305,-0.6 5,-0.2 0.954 117.1 56.4 -54.8 -50.1 17.4 8.0 -20.6 229 263 A V H > S+ 0 0 41 302,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.908 107.6 47.3 -47.5 -51.5 15.2 10.8 -21.6 230 264 A D H > S+ 0 0 41 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.940 111.8 48.7 -60.1 -48.6 12.0 8.8 -20.8 231 265 A Q H X S+ 0 0 16 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.958 111.2 52.7 -57.1 -46.2 13.3 7.7 -17.5 232 266 A L H X S+ 0 0 7 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.841 107.0 50.8 -59.6 -37.1 14.2 11.3 -16.7 233 267 A V H X S+ 0 0 44 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.889 109.6 50.2 -68.2 -39.0 10.7 12.6 -17.6 234 268 A E H X S+ 0 0 46 -4,-2.3 4,-1.1 -10,-0.3 -2,-0.2 0.909 112.5 48.7 -64.9 -38.2 9.1 10.0 -15.3 235 269 A I H >X S+ 0 0 2 -4,-2.3 4,-3.0 -5,-0.2 3,-0.8 0.946 111.4 47.2 -64.2 -49.9 11.5 11.1 -12.5 236 270 A I H 3X S+ 0 0 8 -4,-2.5 4,-2.0 1,-0.3 -1,-0.2 0.845 104.4 62.8 -63.6 -33.3 10.8 14.8 -13.0 237 271 A K H 3< S+ 0 0 103 -4,-2.0 28,-1.0 -5,-0.2 -1,-0.3 0.868 116.5 30.3 -58.2 -35.4 7.1 14.1 -13.1 238 272 A V H << S+ 0 0 19 -4,-1.1 27,-0.3 -3,-0.8 -2,-0.2 0.937 130.2 33.2 -91.7 -51.3 7.4 12.8 -9.5 239 273 A L H < S- 0 0 32 -4,-3.0 25,-0.2 1,-0.2 -3,-0.2 0.544 103.9-129.9 -82.1 -8.6 10.3 14.8 -8.0 240 274 A G < - 0 0 4 -4,-2.0 23,-0.2 -5,-0.4 -1,-0.2 -0.050 52.6 -30.6 77.4 170.6 9.6 18.0 -10.0 241 275 A T - 0 0 48 21,-2.4 23,-0.1 -4,-0.1 2,-0.1 -0.376 70.0-123.2 -59.3 126.4 12.2 20.0 -11.9 242 276 A P - 0 0 8 0, 0.0 17,-0.1 0, 0.0 -1,-0.1 -0.438 28.4-121.9 -69.2 147.2 15.6 19.6 -10.3 243 277 A T > - 0 0 74 -2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.229 22.8-103.4 -78.8 173.2 17.3 22.9 -9.3 244 278 A R H > S+ 0 0 77 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.951 124.2 51.5 -58.2 -53.2 20.6 24.2 -10.5 245 279 A E H > S+ 0 0 72 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.883 109.7 51.5 -54.6 -39.3 22.2 23.3 -7.1 246 280 A Q H > S+ 0 0 42 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.891 108.2 50.5 -65.0 -41.3 20.8 19.8 -7.5 247 281 A I H X S+ 0 0 16 -4,-1.9 4,-3.2 2,-0.2 7,-0.2 0.900 108.3 51.5 -65.9 -40.7 22.2 19.3 -11.0 248 282 A R H < S+ 0 0 47 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.926 107.4 54.0 -61.4 -43.5 25.7 20.4 -9.9 249 283 A E H < S+ 0 0 67 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.838 118.5 35.6 -60.2 -35.1 25.6 17.8 -7.1 250 284 A M H < S- 0 0 1 -4,-1.5 -51,-0.2 1,-0.2 -2,-0.2 0.952 139.7 -7.9 -82.0 -61.2 24.7 15.0 -9.6 251 285 A N >< - 0 0 17 -4,-3.2 3,-1.2 -5,-0.1 -1,-0.2 -0.836 54.3-162.6-148.6 107.4 26.8 16.0 -12.7 252 286 A P G > S+ 0 0 82 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.784 86.4 66.4 -53.5 -40.5 28.7 19.4 -13.0 253 287 A N G 3 S+ 0 0 93 1,-0.2 -5,-0.1 2,-0.1 -56,-0.0 0.715 101.8 49.5 -60.7 -21.0 29.2 19.2 -16.8 254 288 A Y G < 0 0 23 -3,-1.2 -1,-0.2 -7,-0.2 -6,-0.1 0.340 360.0 360.0 -98.7 3.3 25.4 19.6 -17.4 255 289 A T < 0 0 86 -3,-1.5 -2,-0.1 -4,-0.1 -10,-0.0 0.918 360.0 360.0 -77.2 360.0 24.6 22.7 -15.1 256 ! 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 0.0 257 291 A F 0 0 62 0, 0.0 2,-0.3 0, 0.0 271,-0.0 0.000 360.0 360.0 360.0 157.9 20.8 20.9 -21.0 258 292 A K - 0 0 98 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.671 360.0-144.9 -94.8 168.2 17.8 23.1 -19.8 259 293 A F - 0 0 41 -2,-0.3 2,-0.2 -17,-0.1 -18,-0.0 -0.913 22.8 -82.4-136.1 159.5 14.7 21.1 -18.6 260 294 A P - 0 0 65 0, 0.0 2,-1.8 0, 0.0 -19,-0.0 -0.448 44.1-123.2 -62.8 129.0 10.9 21.2 -18.6 261 295 A Q + 0 0 92 -2,-0.2 2,-0.4 -20,-0.1 146,-0.0 -0.495 48.6 165.2 -77.1 79.5 9.6 23.5 -15.7 262 296 A I - 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0 0 40 -3,-1.1 16,-0.0 -4,-0.2 -42,-0.0 -0.633 57.2-122.8 -86.6 139.2 22.7 2.8 -28.7 539 224 B A >> - 0 0 0 -2,-0.3 3,-1.9 1,-0.1 4,-1.7 -0.520 25.5-114.9 -81.1 146.9 26.1 3.4 -30.3 540 225 B P H >> S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 3,-0.6 0.901 115.3 60.9 -55.7 -45.8 29.0 2.6 -28.1 541 226 B E H 34>S+ 0 0 3 1,-0.3 5,-2.7 97,-0.2 7,-0.1 0.840 108.6 46.9 -43.8 -37.6 30.2 6.2 -27.9 542 227 B L H X45S+ 0 0 2 -3,-1.9 3,-1.9 3,-0.2 -1,-0.3 0.861 107.0 54.4 -72.1 -39.2 26.8 6.8 -26.3 543 228 B I H <<5S+ 0 0 8 -4,-1.7 -2,-0.2 -3,-0.6 -1,-0.2 0.951 107.6 52.0 -60.1 -46.4 27.1 3.9 -23.9 544 229 B F T 3<5S- 0 0 3 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.284 120.2-114.5 -71.5 5.5 30.4 5.3 -22.8 545 230 B G T < 5 + 0 0 20 -3,-1.9 -3,-0.2 -5,-0.2 -15,-0.1 0.764 52.7 168.3 70.2 28.2 28.6 8.7 -22.2 546 231 B A < - 0 0 5 -5,-2.7 -1,-0.2 -6,-0.2 3,-0.1 -0.385 21.6-168.1 -69.4 152.4 30.4 10.8 -24.9 547 232 B T S S+ 0 0 54 1,-0.1 -19,-1.8 -2,-0.1 -1,-0.1 0.161 77.2 68.3-129.0 14.9 29.0 14.2 -25.7 548 233 B D S S+ 0 0 97 51,-0.2 -1,-0.1 -21,-0.2 -2,-0.1 -0.176 72.8 141.7-120.4 27.9 30.8 15.1 -28.9 549 234 B Y - 0 0 12 -21,-0.2 2,-0.2 -3,-0.1 50,-0.0 -0.226 36.1-150.0 -70.8 168.0 29.0 12.4 -30.8 550 235 B T > - 0 0 73 -26,-0.0 3,-1.8 -28,-0.0 4,-0.2 -0.666 39.2 -75.1-128.4-176.5 27.9 12.9 -34.4 551 236 B S T >> S+ 0 0 26 1,-0.3 3,-1.3 -2,-0.2 4,-0.9 0.650 109.0 89.5 -59.1 -14.7 25.1 11.7 -36.8 552 237 B S H 3> S+ 0 0 16 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.680 72.3 71.9 -60.8 -15.5 26.9 8.3 -37.1 553 238 B I H <> S+ 0 0 0 -3,-1.8 4,-2.3 1,-0.2 -1,-0.3 0.941 91.1 56.4 -62.6 -44.8 24.9 7.2 -34.1 554 239 B D H <> S+ 0 0 0 -3,-1.3 4,-2.1 -4,-0.2 -1,-0.2 0.902 108.5 49.4 -53.7 -37.5 21.8 7.1 -36.3 555 240 B V H X S+ 0 0 3 -4,-0.9 4,-2.8 2,-0.2 -1,-0.2 0.905 103.8 55.4 -71.0 -44.1 23.7 4.8 -38.5 556 241 B W H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.936 109.7 51.4 -51.7 -41.2 24.8 2.4 -35.8 557 242 B S H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.955 106.6 50.1 -64.7 -50.5 21.2 2.1 -34.9 558 243 B A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.950 108.4 54.9 -48.9 -51.3 20.1 1.3 -38.4 559 244 B G H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.3 -1,-0.2 0.889 107.0 50.4 -51.1 -41.8 22.8 -1.4 -38.4 560 245 B C H X S+ 0 0 2 -4,-2.2 4,-2.5 -5,-0.2 11,-0.3 0.935 109.1 51.7 -62.1 -41.9 21.2 -2.8 -35.3 561 246 B V H X S+ 0 0 2 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.886 109.5 50.6 -60.5 -39.5 17.8 -2.8 -37.1 562 247 B L H >X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 3,-0.9 0.993 111.1 45.8 -63.2 -58.2 19.2 -4.7 -40.0 563 248 B A H 3X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.3 6,-0.3 0.890 111.4 55.4 -53.9 -38.4 20.8 -7.4 -37.9 564 249 B E H 3X S+ 0 0 26 -4,-2.5 4,-1.9 1,-0.2 -1,-0.3 0.882 108.7 46.0 -62.7 -38.5 17.6 -7.6 -35.9 565 250 B L H << S+ 0 0 13 -4,-1.8 -97,-0.4 -3,-0.9 -1,-0.2 0.848 117.4 43.2 -72.7 -35.7 15.6 -8.2 -39.1 566 251 B L H < S+ 0 0 19 -4,-2.3 55,-0.2 1,-0.2 -2,-0.2 0.838 121.2 40.8 -74.5 -36.1 18.1 -10.8 -40.4 567 252 B L H < S- 0 0 52 -4,-3.1 -2,-0.2 -5,-0.3 -3,-0.2 0.722 96.7-132.6 -86.2 -26.5 18.5 -12.5 -37.0 568 253 B G S < S+ 0 0 27 -4,-1.9 -3,-0.1 -5,-0.3 -4,-0.1 0.298 84.9 57.1 84.5 -10.3 14.9 -12.4 -35.8 569 254 B Q S S- 0 0 129 -6,-0.3 -2,-0.2 -5,-0.1 -1,-0.1 -0.987 102.6 -76.9-145.5 156.5 16.1 -11.1 -32.5 570 255 B P - 0 0 36 0, 0.0 -9,-0.1 0, 0.0 -33,-0.0 -0.157 33.0-147.3 -49.8 142.0 18.0 -8.1 -31.3 571 256 B I S S+ 0 0 16 -11,-0.3 -10,-0.0 1,-0.2 -11,-0.0 0.883 89.9 32.2 -81.9 -41.4 21.7 -8.4 -31.9 572 257 B F S S+ 0 0 5 -36,-0.4 -1,-0.2 -12,-0.1 12,-0.1 -0.428 80.8 162.7-118.5 63.7 23.0 -6.4 -28.9 573 258 B P + 0 0 43 0, 0.0 10,-0.3 0, 0.0 2,-0.2 -0.033 9.4 124.2 -71.5 177.3 20.5 -7.0 -26.0 574 259 B G - 0 0 12 1,-0.1 -2,-0.0 8,-0.1 3,-0.0 -0.431 53.7-129.7 139.2 145.8 21.1 -6.3 -22.4 575 260 B D S S+ 0 0 80 -2,-0.2 -389,-1.3 -39,-0.0 2,-0.3 0.611 91.6 52.1 -96.6 -13.7 19.4 -4.3 -19.7 576 261 B S B > S-K 185 0D 2 -391,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.855 86.7-117.1-118.0 157.2 22.6 -2.6 -18.5 577 262 B G H > S+ 0 0 12 -393,-0.6 4,-3.1 -2,-0.3 5,-0.2 0.965 118.1 54.5 -50.6 -52.9 25.3 -0.7 -20.4 578 263 B V H > S+ 0 0 37 -396,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.883 107.7 48.7 -46.1 -49.9 27.7 -3.4 -19.3 579 264 B D H > S+ 0 0 28 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.897 111.7 47.5 -65.4 -43.8 25.5 -6.2 -20.7 580 265 B Q H X S+ 0 0 15 -4,-2.3 4,-2.3 1,-0.2 3,-0.3 0.959 111.2 53.3 -60.0 -47.5 25.1 -4.5 -24.1 581 266 B L H X S+ 0 0 7 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.869 106.8 51.0 -56.7 -39.5 28.8 -3.8 -24.2 582 267 B V H X S+ 0 0 45 -4,-2.3 4,-1.6 -5,-0.2 -1,-0.2 0.872 109.4 49.9 -67.9 -37.1 29.6 -7.5 -23.6 583 268 B E H X S+ 0 0 42 -4,-1.8 4,-0.9 -10,-0.3 -1,-0.2 0.876 112.7 49.5 -66.4 -35.4 27.3 -8.6 -26.4 584 269 B I H >X S+ 0 0 2 -4,-2.3 4,-3.1 1,-0.2 3,-0.8 0.939 111.2 46.4 -64.8 -50.5 29.0 -6.0 -28.6 585 270 B I H 3X S+ 0 0 8 -4,-2.5 4,-1.8 1,-0.3 -1,-0.2 0.804 104.1 63.2 -66.6 -30.0 32.5 -7.1 -27.8 586 271 B K H 3< S+ 0 0 98 -4,-1.6 28,-1.0 -5,-0.2 -1,-0.3 0.878 116.3 31.3 -58.3 -36.4 31.4 -10.7 -28.3 587 272 B V H << S+ 0 0 19 -4,-0.9 27,-0.3 -3,-0.8 -2,-0.2 0.943 130.0 31.8 -91.2 -52.1 30.8 -9.8 -31.9 588 273 B L H < S- 0 0 29 -4,-3.1 25,-0.2 1,-0.2 -3,-0.2 0.596 104.1-130.2 -82.2 -11.8 33.3 -7.0 -32.8 589 274 B G < - 0 0 3 -4,-1.8 23,-0.2 -5,-0.4 -1,-0.2 -0.135 53.4 -28.2 80.4 173.6 36.1 -8.3 -30.5 590 275 B T S S- 0 0 49 21,-2.5 2,-0.2 -4,-0.1 23,-0.1 -0.398 70.3-124.1 -58.6 127.9 37.9 -6.2 -28.0 591 276 B P - 0 0 7 0, 0.0 17,-0.1 0, 0.0 -1,-0.1 -0.523 28.8-121.5 -69.5 144.6 38.1 -2.6 -29.1 592 277 B T > - 0 0 74 -2,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.201 21.9-104.3 -77.2 172.9 41.6 -1.3 -29.4 593 278 B R H > S+ 0 0 73 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.962 124.2 51.6 -57.5 -55.4 43.1 1.7 -27.5 594 279 B E H > S+ 0 0 93 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.836 110.3 50.6 -56.7 -33.7 42.9 3.8 -30.8 595 280 B Q H > S+ 0 0 44 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.922 108.0 51.5 -67.8 -43.8 39.2 2.8 -31.1 596 281 B I H X S+ 0 0 14 -4,-2.2 4,-3.2 1,-0.2 -2,-0.2 0.892 108.4 51.0 -62.0 -42.0 38.3 3.8 -27.5 597 282 B R H < S+ 0 0 48 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.898 107.1 54.4 -62.5 -41.1 39.9 7.3 -27.9 598 283 B E H < S+ 0 0 111 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.859 117.8 36.3 -61.9 -35.0 37.9 7.8 -31.0 599 284 B M H < S- 0 0 1 -4,-1.5 -51,-0.2 1,-0.2 -2,-0.2 0.945 139.5 -8.2 -82.1 -58.6 34.6 6.9 -29.1 600 285 B N >< - 0 0 16 -4,-3.2 3,-1.4 -5,-0.1 -1,-0.2 -0.791 55.0-161.5-149.4 104.3 35.3 8.5 -25.6 601 286 B P G > S+ 0 0 82 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.796 86.9 64.8 -49.6 -41.9 38.7 10.0 -24.6 602 287 B N G 3 S+ 0 0 95 1,-0.2 -5,-0.1 2,-0.1 -56,-0.0 0.719 101.9 51.6 -61.2 -19.5 38.2 10.0 -20.8 603 288 B Y G < 0 0 23 -3,-1.4 -1,-0.2 -7,-0.2 -6,-0.1 0.306 360.0 360.0 -99.6 6.1 38.0 6.1 -20.7 604 289 B T < 0 0 87 -3,-1.5 -2,-0.1 -4,-0.1 -10,-0.0 0.895 360.0 360.0 -79.4 360.0 41.2 5.3 -22.6 605 ! 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 0.0 606 291 B F 0 0 64 0, 0.0 2,-0.3 0, 0.0 -427,-0.0 0.000 360.0 360.0 360.0 158.6 38.3 0.9 -17.7 607 292 B K - 0 0 98 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.681 360.0-144.6 -94.8 168.0 40.3 -2.1 -19.0 608 293 B F - 0 0 40 -2,-0.3 2,-0.2 -17,-0.1 -18,-0.0 -0.912 23.2 -82.8-136.0 160.6 38.2 -4.7 -20.9 609 294 B P - 0 0 63 0, 0.0 2,-1.8 0, 0.0 0, 0.0 -0.461 43.7-123.5 -64.4 129.0 38.0 -8.5 -21.4 610 295 B Q + 0 0 85 -2,-0.2 2,-0.3 -20,-0.1 -553,-0.1 -0.502 49.2 163.8 -77.7 78.5 40.5 -9.7 -24.1 611 296 B I - 0 0 64 -2,-1.8 -21,-2.5 -26,-0.0 2,-0.2 -0.784 33.5-130.9-103.4 137.7 38.0 -11.4 -26.5 612 297 B K - 0 0 86 -2,-0.3 2,-0.4 -23,-0.2 -23,-0.3 -0.506 36.2 -96.8 -81.0 152.1 38.6 -12.4 -30.2 613 298 B A - 0 0 64 -25,-0.2 -26,-0.2 -2,-0.2 -25,-0.1 -0.587 24.4-137.1 -77.6 126.0 36.1 -11.5 -32.9 614 299 B H - 0 0 64 -28,-1.0 5,-0.1 -2,-0.4 -1,-0.1 -0.760 42.8-107.8 -79.7 109.1 33.5 -14.2 -33.9 615 300 B P >> - 0 0 86 0, 0.0 3,-1.5 0, 0.0 4,-0.6 -0.013 20.4-119.4 -53.4 138.5 33.6 -13.7 -37.7 616 301 B W H >> S+ 0 0 47 1,-0.2 3,-1.3 2,-0.2 4,-1.1 0.804 111.6 63.0 -44.2 -38.4 30.5 -12.1 -39.0 617 302 B T H 34 S+ 0 0 79 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.866 102.5 50.6 -56.7 -37.6 29.7 -15.2 -41.2 618 303 B K H <4 S+ 0 0 74 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.507 102.3 64.4 -79.8 -6.9 29.4 -17.4 -38.0 619 304 B V H << S+ 0 0 37 -3,-1.3 -1,-0.2 -4,-0.6 2,-0.2 0.834 96.1 61.2 -79.0 -39.1 26.9 -14.8 -36.5 620 305 B F S < S- 0 0 13 -4,-1.1 4,-0.1 -3,-0.3 -53,-0.1 -0.546 96.8 -84.2-100.3 160.0 24.1 -15.2 -39.0 621 306 B R > - 0 0 59 -55,-0.2 3,-1.6 -2,-0.2 -1,-0.1 -0.214 50.7-110.0 -56.4 146.3 21.8 -18.0 -40.2 622 307 B P T 3 S+ 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.846 113.1 51.7 -56.8 -42.0 23.6 -20.1 -42.9 623 308 B R T 3 S+ 0 0 241 2,-0.1 -2,-0.1 3,-0.0 0, 0.0 0.124 80.7 127.6 -87.4 26.9 21.4 -19.0 -45.9 624 309 B T < - 0 0 22 -3,-1.6 -4,-0.0 -7,-0.1 -58,-0.0 -0.609 69.5-107.0 -75.9 141.0 21.9 -15.4 -45.1 625 310 B P >> - 0 0 30 0, 0.0 4,-1.5 0, 0.0 3,-1.1 -0.562 18.2-136.4 -72.4 130.0 23.2 -13.3 -48.1 626 311 B P H 3> S+ 0 0 89 0, 0.0 4,-2.3 0, 0.0 28,-0.1 0.677 105.0 58.7 -62.1 -19.7 26.9 -12.3 -47.8 627 312 B E H 3> S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 27,-0.3 0.817 102.5 54.7 -77.2 -32.3 26.1 -8.8 -49.0 628 313 B A H <> S+ 0 0 0 -3,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.937 113.9 41.2 -55.4 -49.3 23.6 -8.5 -46.0 629 314 B I H X S+ 0 0 25 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.892 109.7 57.9 -67.2 -44.2 26.5 -9.4 -43.8 630 315 B A H X S+ 0 0 38 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.946 108.1 48.0 -50.7 -49.3 29.0 -7.2 -45.6 631 316 B L H >X S+ 0 0 0 -4,-2.0 4,-1.3 1,-0.2 3,-1.1 0.941 108.0 53.4 -60.9 -53.6 26.8 -4.2 -45.0 632 317 B C H >X S+ 0 0 0 -4,-2.0 4,-3.3 1,-0.3 3,-1.6 0.924 104.5 55.5 -44.7 -55.4 26.3 -4.9 -41.3 633 318 B S H 3< S+ 0 0 28 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.795 111.1 44.6 -53.0 -33.0 30.0 -5.1 -40.7 634 319 B R H << S+ 0 0 92 -4,-1.2 10,-1.8 -3,-1.1 -1,-0.3 0.543 115.8 47.6 -91.5 -14.6 30.5 -1.6 -42.2 635 320 B L H << S+ 0 0 0 -3,-1.6 2,-1.2 -4,-1.3 -2,-0.2 0.804 107.3 55.0 -88.2 -39.5 27.6 -0.2 -40.3 636 321 B L S < S+ 0 0 1 -4,-3.3 2,-0.4 -5,-0.2 -1,-0.2 -0.692 77.2 145.9 -98.2 80.3 28.4 -1.6 -36.9 637 322 B E - 0 0 57 -2,-1.2 6,-0.1 -3,-0.2 5,-0.1 -0.952 52.0-136.9-118.1 137.4 32.0 -0.2 -36.5 638 323 B Y S S+ 0 0 6 -2,-0.4 -97,-0.2 -50,-0.1 -1,-0.1 0.937 92.7 68.5 -53.5 -50.6 33.6 0.9 -33.3 639 324 B T S >> S- 0 0 21 1,-0.2 3,-1.7 -3,-0.1 4,-0.5 -0.635 76.3-150.2 -80.2 116.5 35.1 4.0 -34.9 640 325 B P G >4 S+ 0 0 19 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.854 94.0 53.7 -55.4 -40.6 32.3 6.4 -35.8 641 326 B T G 34 S+ 0 0 119 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.693 102.5 60.8 -69.6 -16.0 34.1 8.0 -38.8 642 327 B A G <4 S+ 0 0 41 -3,-1.7 -1,-0.3 -5,-0.1 2,-0.2 0.632 82.3 101.0 -83.4 -10.6 34.6 4.5 -40.3 643 328 B R S << S- 0 0 8 -3,-1.3 -8,-0.2 -4,-0.5 -9,-0.1 -0.517 84.2-103.4 -77.7 141.7 30.9 3.8 -40.5 644 329 B L - 0 0 16 -10,-1.8 -1,-0.1 -2,-0.2 -7,-0.1 -0.123 33.7-118.1 -52.1 154.8 29.3 4.2 -43.9 645 330 B T > - 0 0 49 1,-0.1 4,-1.1 -3,-0.1 5,-0.1 -0.452 30.7-105.3 -83.8 167.5 27.3 7.3 -44.4 646 331 B P H > S+ 0 0 11 0, 0.0 4,-2.0 0, 0.0 3,-0.2 0.916 121.6 47.9 -61.8 -38.8 23.6 6.7 -45.1 647 332 B L H > S+ 0 0 1 1,-0.3 4,-1.6 2,-0.2 5,-0.1 0.920 107.5 53.9 -70.2 -43.5 24.0 7.5 -48.8 648 333 B E H 4 S+ 0 0 74 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.757 108.8 53.7 -59.1 -26.2 27.1 5.3 -49.2 649 334 B A H >< S+ 0 0 0 -4,-1.1 3,-2.7 -3,-0.2 6,-0.3 0.933 101.1 54.7 -73.7 -50.6 24.7 2.6 -47.7 650 335 B C H 3< S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.853 108.8 51.7 -51.1 -35.2 22.0 3.1 -50.3 651 336 B A T 3< S+ 0 0 16 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.307 86.5 119.1 -85.6 8.7 24.6 2.5 -53.0 652 337 B H S X S- 0 0 32 -3,-2.7 3,-1.9 -5,-0.1 -3,-0.1 -0.450 77.5-113.2 -78.0 150.4 25.8 -0.7 -51.3 653 338 B S G > S+ 0 0 62 1,-0.3 3,-3.1 2,-0.2 4,-0.4 0.824 110.2 73.0 -48.9 -42.4 25.6 -4.0 -53.2 654 339 B F G 3 S+ 0 0 0 -27,-0.3 3,-0.5 1,-0.3 -1,-0.3 0.861 98.4 51.4 -44.9 -35.6 23.0 -5.5 -50.9 655 340 B F G X> S+ 0 0 0 -3,-1.9 4,-0.6 -6,-0.3 3,-0.5 0.249 76.6 101.7 -92.5 17.3 20.6 -3.0 -52.6 656 341 B D H X> S+ 0 0 84 -3,-3.1 3,-2.2 1,-0.2 4,-0.6 0.955 73.6 62.8 -64.2 -43.9 21.3 -4.0 -56.2 657 342 B E H >4 S+ 0 0 88 -3,-0.5 3,-1.1 -4,-0.4 -1,-0.2 0.824 97.8 57.7 -51.6 -31.1 18.1 -6.1 -56.5 658 343 B L H <4 S+ 0 0 1 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.757 104.3 52.1 -72.7 -23.0 16.1 -2.9 -55.9 659 344 B R H << S+ 0 0 25 -3,-2.2 -1,-0.2 -4,-0.6 37,-0.2 0.364 81.6 111.7 -90.5 -1.0 17.7 -1.3 -58.9 660 345 B D S X< S- 0 0 71 -3,-1.1 3,-1.5 -4,-0.6 -3,-0.0 -0.620 72.0-135.3 -70.0 130.7 16.9 -4.2 -61.2 661 346 B P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.727 101.0 55.2 -62.4 -20.7 14.3 -3.0 -63.7 662 347 B N T 3 S+ 0 0 134 -5,-0.1 2,-0.2 2,-0.0 -4,-0.1 0.246 75.8 127.9 -97.9 7.8 12.2 -6.1 -63.2 663 348 B V < + 0 0 22 -3,-1.5 8,-0.5 -6,-0.2 2,-0.3 -0.491 29.7 165.7 -68.0 129.5 11.8 -5.9 -59.4 664 349 B K B -W 670 0I 92 -2,-0.2 6,-0.2 6,-0.2 5,-0.1 -0.915 40.6 -95.4-133.2 166.2 8.2 -6.2 -58.1 665 350 B L > - 0 0 9 4,-3.2 3,-2.4 -2,-0.3 6,-0.1 -0.508 38.6-113.5 -74.0 151.1 6.6 -6.8 -54.7 666 351 B P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.756 118.7 61.4 -54.0 -29.1 5.5 -10.4 -54.0 667 352 B N T 3 S- 0 0 76 -160,-0.1 3,-0.1 2,-0.1 -2,-0.0 0.287 122.9-105.6 -82.5 4.8 1.9 -9.2 -54.2 668 353 B G S < S+ 0 0 57 -3,-2.4 2,-0.1 1,-0.3 -1,-0.0 0.200 80.1 122.2 94.0 -13.3 2.4 -8.1 -57.8 669 354 B R - 0 0 127 -162,-0.2 -4,-3.2 1,-0.1 -1,-0.3 -0.348 65.6 -99.3 -82.7 162.4 2.6 -4.3 -57.3 670 355 B D B -W 664 0I 116 -6,-0.2 -6,-0.2 1,-0.1 -1,-0.1 -0.283 42.7 -95.8 -72.7 162.9 5.5 -2.1 -58.3 671 356 B T - 0 0 30 -8,-0.5 3,-0.1 1,-0.1 -1,-0.1 -0.553 45.4-109.1 -73.9 146.9 8.1 -0.9 -55.9 672 357 B P - 0 0 23 0, 0.0 -1,-0.1 0, 0.0 -163,-0.0 -0.221 59.7 -50.8 -72.8 165.7 7.5 2.5 -54.3 673 358 B A + 0 0 51 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.059 68.4 151.7 -36.7 124.2 9.6 5.7 -55.1 674 359 B L + 0 0 3 -3,-0.1 -1,-0.2 -16,-0.0 -16,-0.0 0.399 67.5 40.2-132.7 -7.9 13.2 4.6 -54.7 675 360 B F + 0 0 33 1,-0.1 2,-2.8 18,-0.1 -2,-0.1 0.414 69.8 112.5-137.2 -10.0 15.0 6.9 -57.1 676 361 B N + 0 0 85 17,-0.0 2,-0.1 2,-0.0 -1,-0.1 -0.345 49.5 172.6 -73.9 62.7 13.5 10.4 -56.9 677 362 B F - 0 0 26 -2,-2.8 2,-0.2 12,-0.1 -2,-0.1 -0.417 19.3-149.6 -73.2 146.4 16.6 11.9 -55.4 678 363 B T > - 0 0 68 -2,-0.1 4,-1.5 1,-0.1 5,-0.1 -0.713 29.4-108.0-105.9 166.8 17.0 15.6 -54.8 679 364 B T H > S+ 0 0 126 -2,-0.2 4,-0.6 2,-0.2 3,-0.1 0.899 120.1 54.5 -57.1 -42.7 20.1 17.8 -54.8 680 365 B Q H >4 S+ 0 0 79 1,-0.2 3,-1.9 2,-0.2 4,-0.4 0.967 106.3 49.2 -55.5 -58.0 19.8 18.1 -51.1 681 366 B E H 34 S+ 0 0 3 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.816 117.3 43.3 -48.9 -36.4 19.7 14.4 -50.4 682 367 B L H >< S+ 0 0 22 -4,-1.5 3,-1.8 1,-0.2 -1,-0.3 0.470 83.2 98.8 -90.7 -4.5 22.7 13.9 -52.6 683 368 B S T << S+ 0 0 62 -3,-1.9 -1,-0.2 -4,-0.6 -2,-0.1 0.767 70.2 68.6 -67.8 -24.9 24.8 16.8 -51.4 684 369 B S T 3 S- 0 0 78 -4,-0.4 -1,-0.3 -3,-0.4 -2,-0.1 0.814 131.4 -11.8 -54.9 -33.5 26.9 14.7 -49.0 685 370 B N X - 0 0 47 -3,-1.8 3,-0.9 1,-0.0 -1,-0.3 -0.547 67.1-172.1-175.3 85.9 28.6 13.0 -52.1 686 371 B P G > S+ 0 0 73 0, 0.0 3,-1.9 0, 0.0 4,-0.3 0.757 74.3 74.4 -70.9 -29.0 26.9 13.7 -55.5 687 372 B P G > S+ 0 0 83 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.821 81.5 72.7 -47.6 -34.6 28.9 11.2 -57.7 688 373 B L G X> S+ 0 0 25 -3,-0.9 3,-3.4 1,-0.3 4,-3.0 0.781 74.9 81.6 -58.5 -23.5 26.9 8.3 -56.1 689 374 B A H <> S+ 0 0 23 -3,-1.9 4,-3.1 1,-0.3 -1,-0.3 0.866 81.7 65.8 -45.4 -39.8 23.9 9.4 -58.2 690 375 B T H <4 S+ 0 0 107 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.641 115.4 27.5 -59.2 -20.4 25.6 7.5 -61.0 691 376 B I H <4 S+ 0 0 82 -3,-3.4 -2,-0.2 -4,-0.2 -1,-0.2 0.639 120.7 53.3-105.7 -31.3 25.0 4.3 -58.9 692 377 B L H < S+ 0 0 0 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.891 105.0 55.8 -74.4 -39.0 21.9 5.4 -57.0 693 378 B I S < S- 0 0 41 -4,-3.1 -1,-0.2 -5,-0.2 -18,-0.1 -0.831 86.5-148.5 -95.8 102.4 19.9 6.4 -60.1 694 379 B P >> - 0 0 8 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.266 24.3-103.7 -75.1 158.4 19.8 3.4 -62.4 695 380 B P G >4 S+ 0 0 106 0, 0.0 3,-2.4 0, 0.0 -2,-0.0 0.884 118.0 51.3 -38.7 -60.8 19.7 3.5 -66.2 696 381 B H G 34 S+ 0 0 91 1,-0.3 -36,-0.0 -37,-0.2 -3,-0.0 0.651 99.3 63.5 -62.7 -22.5 16.0 2.6 -66.5 697 382 B A G <4 0 0 47 -3,-1.4 -1,-0.3 -38,-0.1 -22,-0.0 0.567 360.0 360.0 -75.2 -10.5 14.9 5.3 -64.0 698 383 B R << 0 0 194 -3,-2.4 -5,-0.0 -4,-0.5 0, 0.0 -0.656 360.0 360.0 -85.3 360.0 16.2 8.0 -66.4