==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-JUL-08 3DU8 . COMPND 2 MOLECULE: GLYCOGEN SYNTHASE KINASE-3 BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.T.BOSSI . 675 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31820.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 425 63.0 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 . 104 15.4 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 40 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 24.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 9 2 1 3 0 0 4 0 2 0 0 0 2 0 0 0 2 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 . 0 6 1 1 3 3 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 0 139 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 130.3 21.3 -40.9 -11.9 2 36 A K - 0 0 170 23,-0.1 22,-0.5 1,-0.0 2,-0.4 -0.468 360.0-157.9 -74.1 124.8 24.6 -39.2 -13.0 3 37 A V E -A 23 0A 73 -2,-0.3 2,-0.5 20,-0.1 20,-0.2 -0.847 2.6-158.1-101.6 138.1 27.0 -38.2 -10.2 4 38 A T E -A 22 0A 37 18,-2.8 18,-2.4 -2,-0.4 2,-0.5 -0.982 6.3-167.5-110.0 125.6 29.7 -35.5 -10.6 5 39 A T E +A 21 0A 73 -2,-0.5 2,-0.3 16,-0.2 16,-0.2 -0.972 16.2 166.2-113.6 125.5 32.6 -35.6 -8.3 6 40 A V E -A 20 0A 27 14,-2.5 14,-3.4 -2,-0.5 2,-0.8 -0.869 41.6-116.8-129.1 160.0 34.9 -32.5 -8.2 7 41 A V E -A 19 0A 101 -2,-0.3 76,-0.3 12,-0.2 2,-0.3 -0.878 46.8-178.3-101.5 107.6 37.6 -31.1 -6.0 8 42 A A E -A 18 0A 0 10,-2.3 10,-2.4 -2,-0.8 74,-0.2 -0.745 25.6-128.6-114.2 147.9 36.1 -27.9 -4.7 9 43 A T E -B 81 0A 17 72,-2.8 72,-1.2 -2,-0.3 6,-0.1 -0.849 30.4-114.9 -98.9 120.1 37.4 -25.1 -2.5 10 44 A P E -B 80 0A 27 0, 0.0 70,-0.3 0, 0.0 6,-0.1 -0.209 24.2-128.3 -47.5 139.4 35.2 -23.9 0.5 11 45 A G S S+ 0 0 1 68,-2.0 2,-0.2 67,-0.4 68,-0.1 0.831 84.8 36.5 -68.7 -36.9 34.1 -20.3 -0.1 12 46 A Q S S+ 0 0 64 67,-0.3 57,-0.1 66,-0.2 56,-0.1 -0.489 102.9 11.3-108.9-176.6 35.2 -19.0 3.3 13 47 A G S S+ 0 0 62 55,-0.2 2,-0.1 -2,-0.2 55,-0.0 -0.059 105.9 12.9 46.8-142.6 38.1 -19.6 5.7 14 48 A P S S- 0 0 92 0, 0.0 2,-2.1 0, 0.0 -2,-0.1 -0.330 76.1-112.8 -77.2 136.6 41.2 -21.6 4.8 15 49 A D + 0 0 100 -2,-0.1 -2,-0.1 -6,-0.1 -4,-0.1 -0.378 63.7 142.7 -65.5 81.2 42.0 -22.6 1.2 16 50 A R - 0 0 186 -2,-2.1 -8,-0.1 -6,-0.1 -1,-0.1 -0.787 38.9-148.6-134.1 86.2 41.5 -26.3 1.7 17 51 A P - 0 0 69 0, 0.0 2,-0.3 0, 0.0 -8,-0.2 -0.153 15.2-174.0 -54.2 145.5 39.9 -28.2 -1.2 18 52 A Q E -A 8 0A 96 -10,-2.4 -10,-2.3 -12,-0.0 2,-0.3 -0.944 33.6 -97.8-136.7 156.8 37.7 -31.2 -0.5 19 53 A E E -A 7 0A 139 -2,-0.3 2,-0.4 -12,-0.3 -12,-0.2 -0.616 41.9-166.0 -78.3 130.2 36.1 -33.7 -2.9 20 54 A V E -A 6 0A 12 -14,-3.4 -14,-2.5 -2,-0.3 2,-0.4 -0.981 6.4-159.4-128.2 126.9 32.4 -32.8 -3.5 21 55 A S E +A 5 0A 24 -2,-0.4 21,-1.4 -16,-0.2 22,-0.5 -0.882 16.3 168.8-107.9 135.8 29.8 -35.0 -5.0 22 56 A Y E +AC 4 41A 23 -18,-2.4 -18,-2.8 -2,-0.4 2,-0.2 -0.987 6.7 176.8-145.3 158.5 26.5 -33.8 -6.6 23 57 A T E +AC 3 40A 8 17,-3.0 17,-3.2 -2,-0.3 -20,-0.1 -0.840 52.1 59.2-146.4 176.0 23.7 -35.1 -8.7 24 58 A D E - 0 0 87 -22,-0.5 2,-0.3 -2,-0.2 -1,-0.1 0.836 66.9-176.5 65.7 39.2 20.3 -34.2 -10.3 25 59 A T E + 0 0 61 -23,-0.3 2,-0.3 -3,-0.1 14,-0.2 -0.495 9.9 160.0 -74.5 127.3 21.9 -31.4 -12.3 26 60 A K E - C 0 38A 120 12,-2.1 12,-2.9 -2,-0.3 2,-0.2 -0.992 41.1-105.2-150.1 148.5 19.5 -29.2 -14.3 27 61 A V E + C 0 37A 77 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.451 36.7 164.6 -73.4 138.1 19.6 -25.8 -15.9 28 62 A I E + 0 0 79 8,-3.3 2,-0.3 1,-0.4 9,-0.2 0.444 63.7 19.9-130.5 -7.1 17.5 -23.1 -14.2 29 63 A G E + C 0 36A 27 7,-1.3 7,-2.0 1,-0.0 -1,-0.4 -0.976 47.6 178.4-165.2 157.0 18.8 -19.8 -15.6 30 64 A N + 0 0 108 -2,-0.3 5,-0.1 5,-0.2 -1,-0.0 0.297 26.8 137.4-157.9 17.0 20.7 -18.7 -18.7 31 65 A G S > S- 0 0 49 2,-0.1 3,-0.6 1,-0.0 -2,-0.0 0.608 71.9 -58.8 -53.4-152.7 21.4 -14.9 -19.1 32 66 A S T 3 S+ 0 0 29 1,-0.2 3,-0.1 3,-0.0 -1,-0.0 0.961 125.3 60.3 -60.0 -56.2 24.6 -13.0 -20.3 33 67 A F T 3 S- 0 0 81 1,-0.1 21,-0.5 20,-0.1 2,-0.3 0.653 114.0 -99.7 -40.5 -32.6 27.0 -14.3 -17.5 34 68 A G E < - D 0 53A 23 -3,-0.6 2,-0.3 19,-0.1 19,-0.2 -0.997 62.9 -24.7 133.9-140.8 26.7 -17.9 -18.5 35 69 A V E - D 0 52A 29 17,-1.9 17,-2.5 -2,-0.3 2,-0.4 -0.831 34.4-153.6-121.6 149.5 24.5 -20.6 -16.8 36 70 A V E -CD 29 51A 29 -7,-2.0 -8,-3.3 -2,-0.3 -7,-1.3 -0.995 20.4-173.7-117.1 123.6 22.9 -21.4 -13.5 37 71 A Y E -CD 27 50A 58 13,-1.9 13,-2.2 -2,-0.4 2,-0.4 -0.763 17.0-141.3-105.1 156.2 22.3 -25.1 -12.6 38 72 A Q E +CD 26 49A 20 -12,-2.9 -12,-2.1 -2,-0.3 2,-0.3 -0.916 30.8 164.4-109.3 146.6 20.5 -26.6 -9.7 39 73 A A E - D 0 48A 0 9,-2.4 9,-2.6 -2,-0.4 2,-0.4 -0.942 31.9-124.0-152.6 171.4 22.0 -29.8 -8.2 40 74 A K E -CD 23 47A 66 -17,-3.2 -17,-3.0 -2,-0.3 2,-0.5 -0.983 24.6-124.6-126.6 129.7 21.7 -31.9 -5.1 41 75 A L E > -C 22 0A 10 5,-3.1 4,-2.8 -2,-0.4 5,-0.3 -0.660 14.5-144.5 -77.6 121.0 24.7 -32.7 -2.9 42 76 A C T 4 S+ 0 0 48 -21,-1.4 -1,-0.1 -2,-0.5 -20,-0.1 0.823 94.3 52.4 -49.1 -41.1 25.0 -36.5 -2.5 43 77 A D T 4 S+ 0 0 150 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.941 128.4 12.6 -69.1 -44.0 26.2 -36.3 1.1 44 78 A S T 4 S- 0 0 64 -3,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.482 88.2-124.5-114.6 -7.5 23.5 -34.1 2.6 45 79 A G < + 0 0 35 -4,-2.8 -3,-0.1 1,-0.3 2,-0.1 0.490 60.4 151.5 67.1 1.6 20.7 -34.0 0.0 46 80 A E - 0 0 93 -5,-0.3 -5,-3.1 -6,-0.1 2,-0.4 -0.426 44.9-125.5 -66.1 137.8 21.1 -30.2 0.2 47 81 A L E +D 40 0A 77 -7,-0.2 48,-1.7 48,-0.1 2,-0.3 -0.695 32.2 179.1 -87.3 135.7 20.1 -28.3 -2.9 48 82 A V E -DE 39 94A 0 -9,-2.6 -9,-2.4 -2,-0.4 2,-0.4 -0.905 24.4-134.2-131.0 157.0 22.7 -25.9 -4.4 49 83 A A E -DE 38 93A 11 44,-2.5 44,-3.6 -2,-0.3 2,-0.6 -0.959 16.6-152.8-109.1 136.4 22.9 -23.6 -7.4 50 84 A I E -DE 37 92A 2 -13,-2.2 -13,-1.9 -2,-0.4 2,-0.8 -0.911 2.2-160.0-111.6 106.3 26.0 -23.7 -9.6 51 85 A K E -DE 36 91A 13 40,-2.6 40,-3.0 -2,-0.6 2,-0.6 -0.774 11.6-163.7 -86.3 109.7 26.8 -20.4 -11.4 52 86 A K E +DE 35 90A 49 -17,-2.5 -17,-1.9 -2,-0.8 2,-0.3 -0.880 14.6 170.9-102.3 118.7 29.2 -21.4 -14.3 53 87 A V E -DE 34 89A 21 36,-3.1 36,-2.3 -2,-0.6 2,-0.3 -0.918 39.3-102.6-130.5 144.7 31.0 -18.5 -15.8 54 88 A L E - E 0 88A 102 -21,-0.5 2,-0.6 -2,-0.3 34,-0.2 -0.571 40.6-131.8 -70.1 132.8 33.9 -18.3 -18.4 55 89 A Q - 0 0 22 32,-2.5 -1,-0.1 -2,-0.3 5,-0.0 -0.776 9.9-127.3-100.1 116.6 37.2 -17.5 -16.6 56 90 A D - 0 0 55 -2,-0.6 5,-0.1 1,-0.1 -1,-0.0 -0.252 12.0-144.0 -56.6 138.5 39.5 -14.8 -17.8 57 91 A K S S+ 0 0 148 1,-0.1 -1,-0.1 3,-0.0 -2,-0.0 0.916 94.2 43.4 -73.4 -41.7 43.1 -16.1 -18.3 58 92 A R S S+ 0 0 200 2,-0.0 -1,-0.1 -3,-0.0 -2,-0.0 0.986 109.3 51.9 -60.4 -65.6 44.8 -12.9 -17.1 59 93 A F S S- 0 0 158 1,-0.1 2,-0.4 0, 0.0 0, 0.0 -0.107 76.3-111.2 -93.6 168.3 42.8 -11.8 -14.1 60 94 A K - 0 0 150 1,-0.0 2,-0.5 -5,-0.0 -1,-0.1 -0.767 50.4-103.5 -84.7 136.5 41.5 -13.0 -10.8 61 95 A N > - 0 0 28 -2,-0.4 4,-2.0 1,-0.2 5,-0.1 -0.558 29.9-159.4 -67.1 114.8 37.6 -13.2 -10.9 62 96 A R H > S+ 0 0 133 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 0.849 88.7 55.1 -66.4 -39.5 36.3 -10.2 -9.0 63 97 A E H > S+ 0 0 20 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.919 110.2 47.9 -57.1 -48.5 32.9 -11.6 -8.3 64 98 A L H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.923 110.0 51.0 -57.4 -49.2 34.6 -14.6 -6.6 65 99 A Q H X S+ 0 0 61 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.870 111.5 47.7 -65.0 -34.2 36.9 -12.5 -4.5 66 100 A I H >< S+ 0 0 13 -4,-2.1 3,-0.9 1,-0.2 4,-0.3 0.934 110.8 51.8 -70.0 -43.4 34.1 -10.4 -3.2 67 101 A M H >< S+ 0 0 6 -4,-2.3 3,-0.7 1,-0.2 11,-0.4 0.746 100.7 61.1 -66.0 -29.2 31.9 -13.4 -2.4 68 102 A R H 3< S+ 0 0 47 -4,-1.7 -1,-0.2 1,-0.2 -55,-0.2 0.778 106.1 48.8 -67.1 -27.2 34.7 -15.1 -0.4 69 103 A K T << S+ 0 0 137 -3,-0.9 2,-0.4 -4,-0.7 -1,-0.2 0.500 94.2 93.3 -85.3 -8.0 34.7 -12.1 2.0 70 104 A L < + 0 0 8 -3,-0.7 8,-0.3 -4,-0.3 2,-0.3 -0.740 36.9 161.9-103.8 133.2 30.9 -12.0 2.6 71 105 A D + 0 0 114 -2,-0.4 2,-0.3 6,-0.1 5,-0.1 -0.749 24.2 129.4-150.9 95.4 29.1 -13.7 5.4 72 106 A H > - 0 0 21 3,-0.3 3,-1.5 -2,-0.3 57,-0.0 -0.988 59.9-123.9-154.6 139.8 25.6 -12.4 6.1 73 107 A C T 3 S+ 0 0 38 -2,-0.3 4,-0.1 1,-0.3 241,-0.1 0.690 111.4 50.2 -60.9 -22.3 22.1 -14.0 6.5 74 108 A N T 3 S+ 0 0 2 84,-0.1 85,-2.8 51,-0.1 2,-0.4 0.010 99.0 75.2-106.7 24.9 20.6 -11.9 3.7 75 109 A I B < S-g 159 0B 6 -3,-1.5 -3,-0.3 83,-0.3 85,-0.2 -0.997 92.0-104.4-132.7 135.0 23.3 -12.6 1.1 76 110 A V - 0 0 3 83,-2.6 2,-0.4 -2,-0.4 -2,-0.1 -0.351 41.9-116.0 -60.4 145.0 23.5 -15.9 -0.7 77 111 A R - 0 0 109 -4,-0.1 17,-1.8 1,-0.1 2,-1.0 -0.635 8.2-140.1 -92.8 128.8 26.2 -18.1 0.6 78 112 A L E + F 0 93A 3 -2,-0.4 -67,-0.4 -11,-0.4 15,-0.2 -0.745 27.0 174.2 -74.0 101.2 29.2 -19.2 -1.5 79 113 A R E - 0 0 35 13,-2.5 -68,-2.0 -2,-1.0 -67,-0.3 0.957 60.6 -21.0 -76.2 -50.8 29.5 -22.8 -0.3 80 114 A Y E -BF 10 92A 38 12,-1.5 12,-2.9 -70,-0.3 2,-0.3 -0.917 54.0-155.4-147.5 166.5 32.3 -23.9 -2.7 81 115 A F E +BF 9 91A 9 -72,-1.2 -72,-2.8 -2,-0.3 2,-0.3 -0.963 16.7 165.6-142.0 156.7 33.9 -23.0 -6.0 82 116 A F E - 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0 0 4 -4,-2.0 -1,-0.2 -5,-0.4 18,-0.2 -0.211 49.2 -41.8 88.4 167.0 35.0 -9.2 -30.8 575 275 B T - 0 0 34 16,-2.4 2,-0.2 -2,-0.1 18,-0.1 -0.478 68.3-115.3 -63.7 132.8 36.8 -7.2 -28.0 576 276 B P - 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.507 26.9-123.1 -74.2 144.3 37.5 -3.7 -29.1 577 277 B T > - 0 0 72 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.266 29.8-101.6 -73.7 167.5 41.2 -2.7 -29.3 578 278 B R H > S+ 0 0 231 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.837 125.8 53.2 -59.7 -33.6 42.6 0.3 -27.4 579 279 B E H > S+ 0 0 100 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.943 109.3 46.3 -64.8 -49.7 42.4 2.3 -30.6 580 280 B Q H > S+ 0 0 43 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.884 111.5 53.6 -60.6 -40.2 38.7 1.4 -31.2 581 281 B I H X S+ 0 0 65 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.877 107.9 49.5 -60.8 -39.9 38.0 2.3 -27.5 582 282 B R H < S+ 0 0 150 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.822 108.0 54.3 -71.2 -32.9 39.7 5.7 -27.9 583 283 B E H < S+ 0 0 70 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.917 116.2 37.0 -63.0 -47.2 37.6 6.4 -31.1 584 284 B M H < S- 0 0 1 -4,-2.1 -2,-0.2 1,-0.2 -51,-0.2 0.953 106.9-170.6 -68.6 -57.1 34.3 5.7 -29.2 585 285 B N < 0 0 70 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.1 -0.895 360.0 360.0 123.9-109.7 35.9 7.3 -26.2 586 286 B P 0 0 93 0, 0.0 -1,-0.2 0, 0.0 -56,-0.2 0.977 360.0 360.0 -59.9 360.0 34.8 7.6 -22.5 587 ! 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 0.0 588 293 B F 0 0 215 0, 0.0 2,-0.1 0, 0.0 -13,-0.0 0.000 360.0 360.0 360.0 68.4 37.1 -5.5 -19.7 589 294 B P - 0 0 61 0, 0.0 2,-0.9 0, 0.0 0, 0.0 -0.270 360.0-137.2 -83.2 143.1 36.5 -9.0 -21.4 590 295 B Q + 0 0 121 -2,-0.1 2,-0.4 -15,-0.1 -20,-0.0 -0.660 36.8 149.3-104.3 83.3 38.5 -10.9 -24.1 591 296 B I - 0 0 59 -2,-0.9 -16,-2.4 3,-0.0 2,-0.2 -0.907 39.1-131.9-113.9 135.4 36.5 -12.6 -26.9 592 297 B K - 0 0 179 -2,-0.4 -18,-0.3 -18,-0.2 -2,-0.0 -0.588 47.9 -74.8 -82.9 150.8 37.7 -13.1 -30.5 593 298 B A - 0 0 59 -20,-0.3 -20,-0.2 -2,-0.2 -21,-0.1 -0.149 36.2-128.9 -59.8 131.5 35.2 -12.1 -33.3 594 299 B H - 0 0 70 -22,-0.9 5,-0.1 -23,-0.5 -1,-0.1 -0.679 34.1-115.7 -71.5 111.5 32.2 -14.2 -34.2 595 300 B P >> - 0 0 89 0, 0.0 3,-2.2 0, 0.0 4,-0.6 -0.348 25.5-129.1 -56.7 118.3 32.4 -14.7 -37.9 596 301 B W H >> S+ 0 0 41 1,-0.3 4,-0.8 2,-0.2 3,-0.5 0.656 102.5 67.2 -47.5 -24.1 29.2 -12.9 -39.0 597 302 B T H 34 S+ 0 0 108 1,-0.2 3,-0.4 2,-0.2 -1,-0.3 0.872 97.2 53.5 -68.5 -35.1 28.0 -15.8 -41.1 598 303 B K H <4 S+ 0 0 166 -3,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.699 99.6 66.9 -66.2 -20.8 27.6 -17.9 -38.0 599 304 B V H << S+ 0 0 29 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.873 98.6 52.5 -69.1 -40.2 25.4 -15.1 -36.5 600 305 B F S < S- 0 0 13 -4,-0.8 -48,-0.1 -3,-0.4 -52,-0.0 -0.563 95.8 -85.8-102.9 162.7 22.5 -15.4 -39.1 601 306 B R > - 0 0 100 -50,-0.2 3,-1.7 -2,-0.2 -1,-0.1 -0.109 53.8 -92.0 -63.5 162.3 20.3 -18.4 -40.2 602 307 B P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.781 117.7 42.2 -55.0 -38.5 21.6 -20.6 -43.1 603 308 B R T 3 S+ 0 0 199 2,-0.1 -2,-0.1 3,-0.0 0, 0.0 0.301 75.9 138.4 -97.9 18.8 20.1 -18.9 -46.2 604 309 B T < - 0 0 10 -3,-1.7 -4,-0.1 -7,-0.1 5,-0.0 -0.355 65.2-105.8 -59.6 125.1 20.8 -15.3 -45.3 605 310 B P >> - 0 0 25 0, 0.0 4,-1.6 0, 0.0 3,-1.3 -0.349 21.2-135.0 -55.7 126.9 22.0 -13.4 -48.3 606 311 B P H 3> S+ 0 0 93 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.799 105.3 61.4 -49.5 -33.6 25.8 -12.8 -47.9 607 312 B E H 3> S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 27,-0.3 0.825 102.6 50.1 -64.1 -33.4 25.2 -9.1 -49.1 608 313 B A H <> S+ 0 0 0 -3,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.953 111.9 47.5 -67.7 -50.9 22.9 -8.5 -46.0 609 314 B I H X S+ 0 0 13 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.882 112.6 49.6 -55.8 -44.9 25.5 -9.9 -43.7 610 315 B A H X S+ 0 0 41 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.856 109.2 51.4 -67.4 -39.1 28.2 -7.8 -45.3 611 316 B L H >X S+ 0 0 0 -4,-2.0 4,-0.9 2,-0.2 3,-0.9 0.958 109.8 50.5 -61.7 -49.3 26.1 -4.7 -45.1 612 317 B C H >X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 3,-1.2 0.926 106.2 55.1 -51.6 -49.6 25.5 -5.4 -41.3 613 318 B S H 3< S+ 0 0 34 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.762 110.1 46.4 -60.1 -22.7 29.2 -5.8 -40.7 614 319 B R H << S+ 0 0 105 -4,-1.0 10,-2.0 -3,-0.9 -1,-0.2 0.525 115.9 44.4 -97.4 -8.8 29.9 -2.3 -42.2 615 320 B L H << S+ 0 0 0 -3,-1.2 2,-1.5 -4,-0.9 -2,-0.2 0.789 107.8 59.3 -91.0 -43.2 27.2 -0.6 -40.3 616 321 B L S < S+ 0 0 2 -4,-2.9 2,-0.3 -5,-0.2 -1,-0.2 -0.542 75.5 138.3 -93.4 71.2 27.9 -2.2 -36.9 617 322 B E - 0 0 54 -2,-1.5 6,-0.1 -3,-0.2 5,-0.1 -0.896 54.5-136.6-114.1 141.2 31.6 -1.1 -36.4 618 323 B Y S S+ 0 0 6 -2,-0.3 -92,-0.1 -45,-0.1 -1,-0.1 0.961 91.1 75.0 -58.9 -51.5 33.2 0.1 -33.1 619 324 B T S >> S- 0 0 15 1,-0.2 3,-1.4 2,-0.1 4,-0.5 -0.495 75.7-151.7 -69.6 113.0 35.0 3.0 -34.8 620 325 B P G >4 S+ 0 0 15 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.903 95.0 49.5 -49.7 -51.9 32.3 5.6 -35.6 621 326 B T G 34 S+ 0 0 115 1,-0.3 -2,-0.1 -3,-0.1 4,-0.1 0.625 102.4 65.3 -65.5 -16.4 34.1 7.0 -38.6 622 327 B A G <4 S+ 0 0 35 -3,-1.4 -1,-0.3 -5,-0.1 2,-0.1 0.616 81.8 98.9 -80.5 -11.3 34.5 3.5 -40.0 623 328 B R S << S- 0 0 11 -3,-1.5 -8,-0.2 -4,-0.5 -9,-0.1 -0.471 84.9-101.6 -74.8 146.1 30.7 3.0 -40.4 624 329 B L - 0 0 15 -10,-2.0 -1,-0.1 -13,-0.2 -2,-0.1 -0.304 35.8-120.3 -54.4 146.1 29.1 3.4 -43.9 625 330 B T > - 0 0 51 1,-0.1 4,-1.9 -4,-0.1 5,-0.2 -0.543 30.8-104.6 -77.8 157.7 27.3 6.8 -44.3 626 331 B P H > S+ 0 0 9 0, 0.0 4,-2.3 0, 0.0 -156,-0.2 0.866 122.5 50.7 -50.7 -41.2 23.6 6.5 -45.1 627 332 B L H > S+ 0 0 1 1,-0.2 4,-0.9 2,-0.2 5,-0.1 0.929 110.4 48.5 -69.2 -44.8 24.2 7.4 -48.8 628 333 B E H 4 S+ 0 0 70 2,-0.2 -1,-0.2 1,-0.2 3,-0.2 0.818 109.5 54.3 -56.6 -34.2 26.9 4.7 -49.1 629 334 B A H >< S+ 0 0 0 -4,-1.9 3,-1.9 1,-0.2 6,-0.2 0.940 104.4 53.1 -69.5 -45.8 24.6 2.2 -47.4 630 335 B C H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.755 108.0 52.8 -53.0 -26.2 21.9 2.9 -50.1 631 336 B A T 3< S+ 0 0 16 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.356 84.5 120.2 -94.5 -2.9 24.6 2.2 -52.7 632 337 B H S X S- 0 0 35 -3,-1.9 3,-1.8 1,-0.1 4,-0.1 -0.348 76.8-118.2 -66.1 150.6 25.4 -1.2 -51.2 633 338 B S G > S+ 0 0 56 1,-0.3 3,-1.8 2,-0.2 4,-0.4 0.683 107.3 77.2 -66.9 -16.0 24.9 -4.3 -53.3 634 339 B F G 3 S+ 0 0 2 -27,-0.3 3,-0.4 1,-0.3 -1,-0.3 0.844 98.8 47.6 -58.9 -29.6 22.3 -5.6 -50.8 635 340 B F G X> S+ 0 0 0 -3,-1.8 3,-1.2 -6,-0.2 4,-0.6 0.366 78.5 103.3 -93.7 8.9 20.0 -3.1 -52.5 636 341 B D H X> S+ 0 0 83 -3,-1.8 3,-2.0 1,-0.3 4,-0.8 0.916 75.6 62.8 -57.8 -38.9 20.9 -4.0 -56.2 637 342 B E H >4 S+ 0 0 86 -4,-0.4 3,-0.7 -3,-0.4 -1,-0.3 0.816 98.4 54.9 -51.3 -35.6 17.6 -5.8 -56.5 638 343 B L H <4 S+ 0 0 0 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.687 104.6 55.3 -71.9 -21.8 15.8 -2.5 -55.9 639 344 B R H << S+ 0 0 21 -3,-2.0 -1,-0.2 -4,-0.6 -2,-0.2 0.565 81.5 110.4 -89.1 -12.2 17.7 -1.1 -58.8 640 345 B D S X< S- 0 0 76 -4,-0.8 3,-1.2 -3,-0.7 -3,-0.0 -0.445 71.3-133.9 -62.2 128.1 16.6 -3.8 -61.3 641 346 B P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.785 103.6 50.7 -57.2 -25.0 14.1 -2.4 -63.9 642 347 B N T 3 S+ 0 0 134 2,-0.0 -4,-0.1 0, 0.0 -2,-0.0 0.607 77.6 129.9 -94.2 -6.8 11.8 -5.4 -63.4 643 348 B V < + 0 0 20 -3,-1.2 8,-0.5 -6,-0.3 2,-0.3 -0.108 29.7 169.1 -44.5 129.9 11.5 -5.3 -59.6 644 349 B K - 0 0 93 6,-0.2 6,-0.2 0, 0.0 5,-0.1 -0.935 38.2 -99.7-135.7 160.7 7.9 -5.4 -58.3 645 350 B L > - 0 0 5 4,-3.0 3,-2.0 -2,-0.3 6,-0.0 -0.522 41.3-108.9 -71.2 152.2 6.2 -5.8 -54.9 646 351 B P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.859 120.7 60.5 -50.3 -41.8 4.8 -9.3 -54.2 647 352 B N T 3 S- 0 0 83 -155,-0.1 -2,-0.0 1,-0.1 -155,-0.0 0.202 124.1-106.6 -70.8 15.2 1.2 -8.0 -54.6 648 353 B G S < S+ 0 0 52 -3,-2.0 -1,-0.1 1,-0.2 0, 0.0 0.146 78.7 125.3 83.3 -19.2 2.2 -7.1 -58.2 649 354 B R - 0 0 127 -157,-0.1 -4,-3.0 1,-0.1 -1,-0.2 -0.161 66.3 -92.9 -65.3 166.7 2.5 -3.3 -57.8 650 355 B D - 0 0 112 -6,-0.2 -6,-0.2 1,-0.1 -1,-0.1 -0.400 45.0-102.0 -68.7 153.9 5.4 -1.0 -58.6 651 356 B T - 0 0 30 -8,-0.5 -1,-0.1 1,-0.1 3,-0.1 -0.320 45.5 -99.6 -65.7 156.1 7.9 -0.2 -55.9 652 357 B P - 0 0 23 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.197 62.0 -57.3 -65.5 174.5 7.5 3.3 -54.3 653 358 B A + 0 0 54 1,-0.1 -241,-0.0 -3,-0.1 0, 0.0 -0.348 65.7 155.3 -49.7 127.9 9.7 6.2 -55.3 654 359 B L + 0 0 3 -3,-0.1 -1,-0.1 -2,-0.1 -16,-0.0 0.420 64.9 43.5-134.3 -8.7 13.4 5.2 -54.8 655 360 B F + 0 0 36 1,-0.1 2,-2.0 18,-0.1 -2,-0.1 0.317 69.2 111.3-134.7 -0.7 15.5 7.3 -57.1 656 361 B N + 0 0 86 17,-0.0 2,-0.1 2,-0.0 -1,-0.1 -0.251 49.0 169.3 -72.7 52.3 14.0 10.8 -56.9 657 362 B F - 0 0 24 -2,-2.0 2,-0.3 12,-0.1 -2,-0.0 -0.403 22.8-147.2 -66.0 139.7 17.2 12.0 -55.2 658 363 B T > - 0 0 68 -2,-0.1 4,-1.6 1,-0.1 5,-0.2 -0.713 27.9-109.7 -98.9 159.9 17.6 15.9 -54.7 659 364 B T H > S+ 0 0 125 -2,-0.3 4,-1.1 2,-0.2 -1,-0.1 0.864 121.1 54.4 -51.5 -43.0 21.0 17.7 -54.8 660 365 B Q H >4 S+ 0 0 77 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.956 108.6 48.3 -53.8 -54.8 20.6 18.3 -50.9 661 366 B E H 34 S+ 0 0 3 1,-0.2 3,-0.3 2,-0.1 -1,-0.2 0.799 116.7 43.5 -54.3 -33.4 20.1 14.6 -50.4 662 367 B L H >< S+ 0 0 22 -4,-1.6 3,-2.4 1,-0.2 -1,-0.2 0.568 84.4 101.0 -91.8 -10.1 23.2 13.8 -52.5 663 368 B S T << + 0 0 58 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.1 0.717 67.6 66.8 -55.4 -26.8 25.5 16.5 -51.1 664 369 B S T 3 S- 0 0 79 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.773 131.2 -5.2 -67.2 -21.9 27.5 14.2 -48.8 665 370 B N X - 0 0 55 -3,-2.4 3,-2.5 1,-0.0 4,-0.3 -0.271 67.2-175.1-170.3 67.7 28.9 12.5 -51.9 666 371 B P G > S+ 0 0 76 0, 0.0 3,-2.2 0, 0.0 4,-0.2 0.800 78.8 67.5 -48.9 -41.4 27.5 13.6 -55.3 667 372 B P G > S+ 0 0 86 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.636 83.1 76.2 -50.3 -18.3 29.4 11.0 -57.5 668 373 B L G X> S+ 0 0 26 -3,-2.5 4,-2.9 1,-0.3 3,-1.8 0.702 72.1 82.1 -72.4 -18.7 27.3 8.2 -55.8 669 374 B A H <> S+ 0 0 25 -3,-2.2 4,-2.0 -4,-0.3 -1,-0.3 0.749 78.6 70.4 -49.5 -24.0 24.4 9.2 -58.0 670 375 B T H <4 S+ 0 0 105 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.800 112.4 26.4 -72.2 -28.7 26.2 7.0 -60.6 671 376 B I H <4 S+ 0 0 76 -3,-1.8 -2,-0.2 -4,-0.2 -1,-0.2 0.797 120.2 56.9 -89.5 -40.4 25.2 4.0 -58.6 672 377 B L H < S+ 0 0 0 -4,-2.9 -3,-0.2 1,-0.1 -2,-0.2 0.822 103.5 51.2 -71.1 -34.7 22.1 5.3 -56.9 673 378 B I S < S- 0 0 38 -4,-2.0 -1,-0.1 -5,-0.2 5,-0.1 -0.899 86.8-146.6 -98.9 106.5 20.1 6.3 -60.0 674 379 B P >> - 0 0 9 0, 0.0 3,-2.2 0, 0.0 4,-0.9 -0.386 26.4-101.2 -78.0 162.1 20.1 3.3 -62.3 675 380 B P G >4 S+ 0 0 97 0, 0.0 3,-1.6 0, 0.0 -2,-0.0 0.882 120.0 55.8 -43.0 -52.1 20.1 3.7 -66.2 676 381 B H G 34 S+ 0 0 72 1,-0.3 3,-0.4 -37,-0.2 -36,-0.0 0.627 101.8 57.6 -56.4 -22.1 16.3 3.0 -66.5 677 382 B A G <4 S+ 0 0 42 -3,-2.2 2,-0.4 1,-0.2 -1,-0.3 0.669 99.2 59.8 -84.7 -22.5 15.5 5.8 -64.1 678 383 B R S << S+ 0 0 144 -3,-1.6 2,-0.3 -4,-0.9 -1,-0.2 -0.447 88.4 106.1 -97.0 56.8 17.3 8.4 -66.3 679 384 B I 0 0 117 -2,-0.4 -3,-0.0 -3,-0.4 0, 0.0 -0.982 360.0 360.0-133.9 141.6 15.1 7.8 -69.4 680 385 B Q 0 0 250 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.131 360.0 360.0-137.3 360.0 12.3 9.7 -71.1