==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-JAN-04 1UV5 . COMPND 2 MOLECULE: GLYCOGEN SYNTHASE KINASE-3 BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.DAJANI,L.H.PEARL,S.M.ROE . 348 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 208 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 53 15.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 20 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 4 1 0 1 1 0 2 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 3 0 1 2 1 1 1 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 1 0 0 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 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 0 106 0, 0.0 2,-0.1 0, 0.0 25,-0.0 0.000 360.0 360.0 360.0-131.3 101.1 75.2 26.6 2 36 A K - 0 0 152 23,-0.1 22,-0.4 21,-0.1 2,-0.3 -0.439 360.0-107.6 -87.8 163.7 100.5 72.8 29.6 3 37 A V - 0 0 90 20,-0.1 2,-0.4 -2,-0.1 20,-0.2 -0.745 31.5-162.8 -95.0 142.3 101.2 69.1 29.7 4 38 A T E -A 22 0A 31 18,-2.2 18,-2.9 -2,-0.3 2,-0.5 -0.995 3.9-168.1-127.6 133.5 98.2 66.6 29.6 5 39 A T E +A 21 0A 76 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.983 14.1 163.7-128.7 125.8 98.3 63.0 30.5 6 40 A V E -A 20 0A 26 14,-3.2 14,-3.4 -2,-0.5 2,-0.6 -0.844 42.0-110.9-134.6 168.4 95.6 60.5 29.8 7 41 A V E -A 19 0A 102 -2,-0.3 76,-0.3 12,-0.2 2,-0.3 -0.919 47.8-177.4 -99.2 119.4 95.0 56.7 29.7 8 42 A A E -A 18 0A 1 10,-3.9 10,-3.4 -2,-0.6 74,-0.2 -0.811 23.5-136.6-120.4 163.2 94.6 55.9 26.0 9 43 A T E -B 81 0A 22 72,-2.4 72,-1.7 -2,-0.3 2,-0.1 -0.894 31.1-110.6-114.0 144.3 93.8 52.8 24.0 10 44 A P E -B 80 0A 19 0, 0.0 70,-0.3 0, 0.0 69,-0.1 -0.477 21.7-133.7 -72.7 148.5 95.6 52.0 20.7 11 45 A G S S+ 0 0 2 68,-1.9 2,-0.3 67,-0.3 68,-0.1 0.977 87.0 24.1 -64.5 -57.4 93.4 52.3 17.6 12 46 A Q S S+ 0 0 80 66,-0.5 57,-0.1 67,-0.2 -1,-0.1 -0.716 109.1 27.8-107.4 156.0 94.4 49.1 16.0 13 47 A G S S- 0 0 55 -2,-0.3 0, 0.0 55,-0.2 0, 0.0 -0.420 104.3 -2.4 92.1-171.3 95.8 46.0 17.6 14 48 A P S S- 0 0 85 0, 0.0 2,-1.6 0, 0.0 -2,-0.0 -0.230 70.9-116.5 -56.1 137.1 95.3 44.6 21.1 15 49 A D + 0 0 86 -6,-0.1 -2,-0.1 1,-0.0 -6,-0.1 -0.599 54.4 153.3 -82.6 86.8 93.2 46.7 23.5 16 50 A R - 0 0 174 -2,-1.6 -8,-0.1 -6,-0.0 -1,-0.0 -0.856 42.9-129.8-120.4 96.9 95.8 47.6 26.2 17 51 A P + 0 0 89 0, 0.0 2,-0.3 0, 0.0 -8,-0.2 -0.109 35.7 180.0 -45.6 127.4 95.3 50.8 28.1 18 52 A Q E -A 8 0A 78 -10,-3.4 -10,-3.9 2,-0.0 2,-0.4 -0.930 30.0-104.6-135.1 158.4 98.4 52.9 28.1 19 53 A E E -A 7 0A 156 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.664 36.1-177.3 -81.7 130.2 99.6 56.2 29.4 20 54 A V E -A 6 0A 12 -14,-3.4 -14,-3.2 -2,-0.4 2,-0.4 -0.996 8.5-171.4-132.3 135.6 99.9 59.1 27.0 21 55 A S E +A 5 0A 33 -2,-0.4 21,-2.2 -16,-0.2 22,-0.3 -0.982 12.6 169.2-124.1 134.0 101.2 62.7 27.5 22 56 A Y E +AC 4 41A 24 -18,-2.9 -18,-2.2 -2,-0.4 2,-0.2 -0.972 5.2 175.5-143.0 158.9 101.0 65.4 25.0 23 57 A T E + C 0 40A 15 17,-2.7 17,-3.5 -2,-0.3 -20,-0.1 -0.820 48.6 67.5-148.6-178.8 101.5 69.2 24.9 24 58 A D E - 0 0 67 -22,-0.4 2,-0.3 -2,-0.2 -1,-0.1 0.863 63.6-176.7 64.0 41.4 101.5 72.2 22.6 25 59 A T E + 0 0 54 -23,-0.3 2,-0.3 -3,-0.1 14,-0.2 -0.511 11.4 160.4 -73.4 126.3 97.9 72.0 21.9 26 60 A K E - C 0 38A 120 12,-1.8 12,-2.7 -2,-0.3 2,-0.2 -0.977 40.8-106.2-141.5 154.4 96.4 74.5 19.3 27 61 A V E + C 0 37A 78 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.543 39.1 162.6 -81.0 144.9 93.2 74.4 17.3 28 62 A I E + 0 0 80 8,-3.2 2,-0.3 1,-0.4 9,-0.2 0.402 58.5 16.2-143.5 9.2 93.5 73.6 13.6 29 63 A G E - C 0 36A 25 7,-1.0 7,-2.4 9,-0.0 -1,-0.4 -0.946 52.1-155.9-175.4 155.7 90.0 72.6 12.5 30 64 A N + 0 0 129 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.864 17.8 158.1-134.1 168.0 86.3 72.6 13.3 31 65 A G > - 0 0 49 -2,-0.3 3,-1.1 137,-0.0 -2,-0.0 -0.985 54.4 -95.6-176.5 173.2 83.3 70.5 12.3 32 66 A S T 3 S+ 0 0 114 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.424 125.0 50.2 -86.3 3.5 79.8 69.4 13.1 33 67 A F T 3 S- 0 0 97 1,-0.4 -1,-0.3 20,-0.1 2,-0.1 0.008 124.6 -75.4-124.0 27.4 81.4 66.3 14.6 34 68 A G < - 0 0 18 -3,-1.1 -1,-0.4 19,-0.1 2,-0.2 -0.408 55.0 -52.3 112.6 173.9 83.9 68.2 16.8 35 69 A V E - D 0 52A 36 17,-1.9 17,-3.3 -5,-0.2 2,-0.5 -0.630 35.5-147.1 -95.2 150.0 87.2 70.1 17.0 36 70 A V E -CD 29 51A 35 -7,-2.4 -8,-3.2 15,-0.3 -7,-1.0 -0.967 17.8-175.3-122.5 122.9 90.6 69.1 15.7 37 71 A Y E -CD 27 50A 60 13,-3.4 13,-2.6 -2,-0.5 2,-0.3 -0.797 22.1-132.5-113.5 157.5 93.8 70.2 17.5 38 72 A Q E +CD 26 49A 24 -12,-2.7 -12,-1.8 -2,-0.3 2,-0.3 -0.769 36.6 167.3-100.3 153.9 97.4 69.8 16.7 39 73 A A E - D 0 48A 0 9,-2.0 9,-2.9 -2,-0.3 2,-0.5 -0.976 32.1-121.9-160.0 165.3 99.6 68.5 19.5 40 74 A K E -CD 23 47A 74 -17,-3.5 -17,-2.7 -2,-0.3 2,-0.5 -0.971 22.8-129.4-120.6 129.5 103.0 67.1 20.3 41 75 A L E > -C 22 0A 9 5,-4.0 4,-2.3 -2,-0.5 -19,-0.3 -0.674 25.1-141.0 -75.0 124.4 103.5 63.7 22.0 42 76 A C T 4 S+ 0 0 48 -21,-2.2 -1,-0.2 -2,-0.5 3,-0.1 0.944 89.7 39.1 -50.5 -66.6 105.8 64.5 24.9 43 77 A D T 4 S+ 0 0 162 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.728 127.2 32.6 -68.4 -20.8 108.2 61.6 25.0 44 78 A S T 4 S- 0 0 60 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.597 92.7-134.4-109.0 -13.7 108.6 61.1 21.2 45 79 A G < + 0 0 39 -4,-2.3 -3,-0.1 1,-0.3 -2,-0.1 0.322 54.2 147.0 79.9 -11.1 108.3 64.7 20.1 46 80 A E - 0 0 93 -6,-0.1 -5,-4.0 -5,-0.1 2,-0.4 -0.227 47.4-125.6 -62.8 144.9 105.9 63.6 17.3 47 81 A L E +D 40 0A 73 -7,-0.3 53,-0.7 -3,-0.1 2,-0.3 -0.744 35.2 172.7 -91.6 134.3 103.1 65.8 16.1 48 82 A V E -DE 39 99A 0 -9,-2.9 -9,-2.0 -2,-0.4 2,-0.4 -0.829 28.4-123.0-135.6 174.8 99.7 64.4 16.1 49 83 A A E -DE 38 98A 10 49,-3.1 49,-3.4 -2,-0.3 2,-0.5 -0.948 18.3-162.7-119.7 144.9 96.2 65.5 15.6 50 84 A I E -DE 37 97A 4 -13,-2.6 -13,-3.4 -2,-0.4 2,-0.5 -0.996 1.6-162.3-128.7 124.8 93.5 65.1 18.2 51 85 A K E -DE 36 96A 15 45,-2.5 45,-2.8 -2,-0.5 2,-0.5 -0.947 9.0-161.0-109.0 127.0 89.9 65.3 17.1 52 86 A K E +DE 35 95A 47 -17,-3.3 -17,-1.9 -2,-0.5 2,-0.3 -0.939 13.6 173.3-115.3 115.8 87.5 65.9 20.1 53 87 A V E - E 0 94A 8 41,-2.1 41,-2.8 -2,-0.5 2,-0.3 -0.878 37.4-109.0-118.9 150.0 83.8 65.2 19.7 54 88 A L E - E 0 93A 102 -2,-0.3 2,-0.4 39,-0.2 39,-0.3 -0.574 39.8-149.8 -76.0 136.9 81.1 65.2 22.3 55 89 A Q E - E 0 92A 29 37,-2.9 37,-0.7 -2,-0.3 5,-0.1 -0.935 21.7-151.1-121.0 141.9 80.0 61.7 23.1 56 90 A G - 0 0 50 -2,-0.4 2,-0.7 3,-0.3 -1,-0.1 0.685 18.8-159.2 -75.2 -22.5 76.7 60.2 24.2 57 91 A K S S+ 0 0 129 2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.173 87.2 74.0 62.1 -22.3 78.3 57.3 26.0 58 92 A A S S+ 0 0 77 -2,-0.7 2,-0.3 1,-0.1 -1,-0.2 0.437 101.7 43.1 -92.8 -9.6 74.8 55.8 25.7 59 93 A F S S- 0 0 160 0, 0.0 -2,-0.5 0, 0.0 -3,-0.3 -0.997 89.8-112.4-140.7 140.3 75.6 55.3 21.9 60 94 A K - 0 0 173 -2,-0.3 2,-0.7 -4,-0.1 -4,-0.1 -0.117 31.1-117.1 -63.2 161.4 78.7 54.0 20.1 61 95 A N > - 0 0 28 1,-0.2 4,-2.6 -4,-0.1 5,-0.1 -0.918 19.3-161.6-107.4 117.3 80.7 56.4 17.9 62 96 A R H > S+ 0 0 120 -2,-0.7 4,-3.0 1,-0.2 5,-0.3 0.855 88.9 60.5 -65.9 -33.8 80.6 55.2 14.3 63 97 A E H > S+ 0 0 9 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.950 110.9 41.6 -58.4 -45.4 83.6 57.4 13.3 64 98 A L H > S+ 0 0 12 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.948 112.0 54.8 -66.4 -46.6 85.6 55.4 15.9 65 99 A Q H X S+ 0 0 90 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.880 114.5 40.4 -52.2 -44.7 84.0 52.1 14.9 66 100 A I H >X S+ 0 0 6 -4,-3.0 4,-1.2 2,-0.2 3,-0.9 0.943 112.1 54.3 -70.9 -51.7 85.0 52.7 11.2 67 101 A M H 3< S+ 0 0 9 -4,-2.5 3,-0.4 -5,-0.3 11,-0.3 0.859 103.2 57.2 -53.5 -38.6 88.5 54.1 11.9 68 102 A R H 3< S+ 0 0 91 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.889 106.8 50.8 -61.7 -32.4 89.4 51.1 14.0 69 103 A K H << S+ 0 0 89 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.737 96.6 82.9 -77.3 -26.0 88.6 48.9 11.0 70 104 A L < + 0 0 14 -4,-1.2 8,-0.2 -3,-0.4 2,-0.1 -0.397 38.9 161.6 -84.7 159.2 90.7 50.7 8.4 71 105 A D + 0 0 129 -2,-0.1 2,-0.3 6,-0.1 5,-0.1 -0.482 23.3 128.2-174.0 99.4 94.4 50.4 7.6 72 106 A H > - 0 0 16 3,-0.4 3,-2.2 -2,-0.1 -2,-0.0 -0.971 63.3-113.8-158.1 141.6 95.7 51.7 4.3 73 107 A C T 3 S+ 0 0 49 -2,-0.3 4,-0.1 1,-0.3 251,-0.1 0.577 114.2 53.7 -59.3 -8.7 98.5 54.0 3.3 74 108 A N T 3 S+ 0 0 1 89,-0.1 90,-3.6 2,-0.1 2,-0.4 0.256 95.7 75.3-112.9 15.6 96.0 56.5 2.0 75 109 A I B < S-g 164 0B 7 -3,-2.2 -3,-0.4 88,-0.3 90,-0.2 -0.994 92.2-104.1-128.1 131.0 93.8 56.8 5.0 76 110 A V - 0 0 7 88,-2.6 2,-0.3 -2,-0.4 -2,-0.1 -0.297 40.6-120.6 -56.3 130.3 94.8 58.8 8.0 77 111 A R - 0 0 111 -4,-0.1 22,-2.0 -6,-0.0 2,-0.6 -0.538 9.9-139.0 -78.7 132.2 95.9 56.4 10.8 78 112 A L E - F 0 98A 7 -2,-0.3 -66,-0.5 -11,-0.3 -67,-0.3 -0.784 20.9-179.2 -87.4 118.3 94.2 56.4 14.2 79 113 A R E - 0 0 28 18,-2.8 -68,-1.9 -2,-0.6 2,-0.3 0.932 60.5 -25.7 -85.0 -50.4 96.9 56.1 16.9 80 114 A Y E -BF 10 97A 48 17,-1.6 17,-3.1 -70,-0.3 -1,-0.3 -0.932 52.3-152.6-150.3 174.5 94.9 56.1 20.1 81 115 A F E +BF 9 96A 13 -72,-1.7 -72,-2.4 -2,-0.3 2,-0.3 -0.971 17.0 168.9-151.8 151.3 91.6 57.2 21.5 82 116 A F E - F 0 95A 8 13,-1.7 13,-2.2 -2,-0.3 2,-0.2 -0.971 27.8-118.5-155.9 161.0 90.5 58.1 25.0 83 117 A Y E + F 0 94A 90 -76,-0.3 2,-0.3 -2,-0.3 11,-0.2 -0.657 29.2 172.4-103.2 163.3 87.5 59.8 26.8 84 118 A S E - 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0 0 30 0, 0.0 -9,-0.1 0, 0.0 -33,-0.0 -0.319 38.6-147.1 -55.1 135.2 84.3 74.6 -7.9 222 256 A I S S+ 0 0 20 -11,-0.4 -10,-0.0 1,-0.2 -11,-0.0 0.840 89.4 37.6 -78.0 -33.5 82.8 73.2 -11.1 223 257 A F S S+ 0 0 2 -36,-0.3 -1,-0.2 -12,-0.1 12,-0.1 -0.559 74.4 161.1-119.6 72.1 79.2 73.1 -9.8 224 258 A P + 0 0 37 0, 0.0 10,-0.2 0, 0.0 2,-0.2 -0.273 8.5 146.2 -77.1 175.5 78.6 76.1 -7.6 225 259 A G - 0 0 13 1,-0.1 6,-0.1 9,-0.1 -2,-0.0 -0.453 46.8-137.1 155.2 129.2 75.0 77.1 -6.9 226 260 A D S S+ 0 0 165 -2,-0.2 2,-0.2 2,-0.0 -1,-0.1 0.946 93.5 33.3 -69.9 -47.9 73.1 78.6 -4.0 227 261 A S S > S- 0 0 49 1,-0.1 4,-2.3 0, 0.0 5,-0.2 -0.645 86.9-114.1-104.9 166.8 70.2 76.3 -4.3 228 262 A G H > S+ 0 0 28 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.844 119.2 60.0 -64.2 -32.0 70.0 72.7 -5.4 229 263 A V H > S+ 0 0 54 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.928 105.4 47.5 -61.3 -44.1 68.0 74.0 -8.4 230 264 A D H > S+ 0 0 66 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.952 111.0 50.4 -64.7 -45.2 71.1 76.2 -9.4 231 265 A Q H X S+ 0 0 2 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.925 110.0 50.6 -56.8 -43.1 73.5 73.3 -9.0 232 266 A L H X S+ 0 0 11 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.924 110.2 50.6 -60.5 -42.8 71.2 71.1 -11.1 233 267 A V H X S+ 0 0 55 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.924 110.4 48.3 -64.3 -41.0 71.3 73.9 -13.7 234 268 A E H < S+ 0 0 47 -4,-2.8 -2,-0.2 -10,-0.2 -1,-0.2 0.953 114.6 47.1 -59.8 -49.3 75.1 74.1 -13.6 235 269 A I H >X S+ 0 0 2 -4,-3.0 3,-2.3 1,-0.2 4,-1.9 0.938 110.1 51.8 -58.6 -48.4 75.3 70.3 -14.0 236 270 A I H 3X S+ 0 0 12 -4,-3.2 4,-2.0 1,-0.3 29,-0.3 0.867 100.8 63.8 -61.0 -31.5 72.7 70.3 -16.8 237 271 A K H 3< S+ 0 0 74 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.568 114.0 32.3 -69.9 -0.3 74.8 72.9 -18.6 238 272 A V H <4 S+ 0 0 18 -3,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.604 130.8 28.8-126.4 -21.8 77.6 70.4 -18.8 239 273 A L H < S- 0 0 35 -4,-1.9 -3,-0.2 1,-0.2 -2,-0.2 0.484 104.7-122.8-116.3 -13.1 76.0 67.0 -19.2 240 274 A G < - 0 0 1 -4,-2.0 -1,-0.2 -5,-0.5 23,-0.2 -0.121 51.6 -35.2 89.5 166.9 72.8 68.1 -20.9 241 275 A T - 0 0 34 21,-0.2 2,-0.3 1,-0.1 23,-0.0 -0.256 68.5-109.8 -65.2 144.8 69.3 67.5 -19.7 242 276 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.627 28.6-123.4 -75.5 132.6 68.6 64.2 -17.9 243 277 A T > - 0 0 73 -2,-0.3 4,-2.5 1,-0.1 5,-0.3 -0.376 29.6-108.8 -68.0 155.8 66.5 61.6 -19.8 244 278 A R H > S+ 0 0 182 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.864 123.1 57.5 -53.9 -36.6 63.4 60.5 -17.8 245 279 A E H >> S+ 0 0 84 2,-0.2 3,-1.8 1,-0.2 4,-1.4 0.992 106.7 45.7 -55.0 -68.1 65.2 57.2 -17.4 246 280 A Q H >> S+ 0 0 42 1,-0.3 4,-1.5 2,-0.2 3,-1.0 0.893 107.6 55.5 -43.1 -55.8 68.2 58.9 -15.8 247 281 A I H 3X S+ 0 0 36 -4,-2.5 4,-1.7 1,-0.3 -1,-0.3 0.806 108.9 51.5 -51.5 -26.5 66.1 61.0 -13.4 248 282 A R H << S+ 0 0 91 -3,-1.8 -1,-0.3 -4,-1.2 -2,-0.2 0.815 104.9 53.6 -79.0 -33.5 64.6 57.7 -12.3 249 283 A E H << S+ 0 0 75 -4,-1.4 -2,-0.2 -3,-1.0 -1,-0.2 0.668 110.7 49.1 -74.2 -19.1 68.0 56.1 -11.6 250 284 A M H < S- 0 0 2 -4,-1.5 -2,-0.2 -5,-0.2 -51,-0.2 0.881 134.0 -1.1 -86.0 -45.0 68.9 59.0 -9.4 251 285 A N < - 0 0 11 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 -0.711 58.5-159.4-154.7 98.4 65.7 59.0 -7.3 252 286 A P S S+ 0 0 60 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.885 93.5 41.0 -39.9 -64.5 62.8 56.6 -7.9 253 287 A N S S+ 0 0 129 1,-0.2 0, 0.0 -57,-0.0 0, 0.0 -0.809 82.3 146.6 -84.4 120.5 60.2 58.8 -6.1 254 288 A Y - 0 0 81 -2,-0.7 -1,-0.2 -57,-0.0 -57,-0.0 0.822 44.6-131.3-128.9 -35.9 61.2 62.1 -7.4 255 289 A T - 0 0 122 2,-0.0 -2,-0.0 0, 0.0 0, 0.0 0.720 34.5-106.0 77.3 113.6 58.6 64.9 -8.0 256 290 A E - 0 0 156 1,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.231 36.6-166.3 -66.7 159.8 58.9 66.7 -11.4 257 291 A F - 0 0 117 1,-0.3 -2,-0.0 0, 0.0 -1,-0.0 -0.954 25.5-112.3-143.9 160.1 60.4 70.2 -11.7 258 292 A K + 0 0 74 -2,-0.3 -1,-0.3 1,-0.1 0, 0.0 0.877 58.6 129.3 -52.2-110.1 60.6 73.0 -14.4 259 293 A F + 0 0 55 1,-0.2 -1,-0.1 -18,-0.0 -26,-0.0 -0.821 24.2 144.7 98.0-104.9 64.2 73.4 -15.6 260 294 A P + 0 0 79 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.846 18.3 92.6 20.7 138.5 64.7 73.4 -19.4 261 295 A Q S S+ 0 0 167 1,-0.6 2,-0.1 -25,-0.0 -25,-0.0 0.334 71.5 24.5 118.9 117.5 67.0 75.2 -21.7 262 296 A I - 0 0 82 1,-0.1 -1,-0.6 2,-0.0 2,-0.2 -0.034 63.3-174.1 92.3 160.1 70.5 74.3 -23.1 263 297 A K + 0 0 120 -23,-0.2 -23,-0.1 -26,-0.1 -26,-0.1 -0.850 50.5 20.5 179.0 150.2 71.5 70.6 -23.3 264 298 A A S S- 0 0 83 -2,-0.2 -25,-0.1 -28,-0.2 -1,-0.1 0.945 75.7-166.7 42.4 78.1 74.6 68.5 -24.2 265 299 A H - 0 0 72 -29,-0.3 2,-0.7 1,-0.1 -1,-0.1 -0.489 31.4 -83.0 -91.5 160.2 77.4 71.1 -23.7 266 300 A P > - 0 0 63 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 -0.467 31.2-165.1 -64.5 104.2 81.1 71.1 -24.7 267 301 A W G >> S+ 0 0 46 -2,-0.7 3,-0.7 1,-0.2 4,-0.5 0.816 95.2 49.4 -58.5 -28.5 82.9 69.1 -22.0 268 302 A T G 34 S+ 0 0 105 1,-0.2 -1,-0.2 2,-0.2 3,-0.2 0.721 99.5 62.8 -83.1 -22.1 86.1 70.6 -23.6 269 303 A K G <4 S+ 0 0 165 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.254 94.8 70.2 -81.8 8.8 84.7 74.2 -23.7 270 304 A V T <4 S+ 0 0 38 -3,-0.7 -1,-0.2 2,-0.1 -2,-0.2 0.875 94.7 47.3 -92.5 -47.4 84.6 73.8 -19.8 271 305 A F S < S- 0 0 12 -4,-0.5 -53,-0.1 -3,-0.2 -57,-0.0 -0.519 97.6 -80.5 -97.3 165.9 88.3 73.9 -19.0 272 306 A R > - 0 0 134 -55,-0.4 3,-1.3 -2,-0.2 -1,-0.2 -0.072 50.1-104.4 -53.4 162.5 91.3 76.1 -20.0 273 307 A P T 3 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.868 117.8 55.9 -60.1 -42.6 92.8 75.3 -23.4 274 308 A R T 3 S+ 0 0 218 2,-0.1 -2,-0.1 3,-0.0 -3,-0.0 0.528 76.8 129.3 -71.1 -6.4 95.9 73.6 -22.1 275 309 A T < - 0 0 15 -3,-1.3 -4,-0.1 1,-0.1 5,-0.1 -0.337 68.8-109.2 -58.6 120.1 93.8 71.1 -20.1 276 310 A P >> - 0 0 37 0, 0.0 4,-1.8 0, 0.0 3,-1.0 -0.239 18.9-131.3 -53.2 125.7 95.0 67.5 -20.9 277 311 A P H 3> S+ 0 0 106 0, 0.0 4,-2.2 0, 0.0 28,-0.1 0.826 106.6 53.6 -44.9 -44.9 92.5 65.6 -23.0 278 312 A E H 3> S+ 0 0 75 2,-0.2 4,-2.8 1,-0.2 27,-0.3 0.824 102.5 56.7 -66.0 -34.5 92.7 62.6 -20.7 279 313 A A H <> S+ 0 0 0 -3,-1.0 4,-2.2 1,-0.2 -1,-0.2 0.951 110.7 44.9 -63.7 -47.5 91.9 64.7 -17.6 280 314 A I H X S+ 0 0 13 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.916 110.8 54.8 -62.7 -39.3 88.7 65.9 -19.3 281 315 A A H X S+ 0 0 32 -4,-2.2 4,-1.6 -5,-0.2 3,-0.2 0.961 107.1 49.4 -57.5 -51.1 88.0 62.3 -20.4 282 316 A L H X S+ 0 0 0 -4,-2.8 4,-1.3 1,-0.2 3,-0.3 0.891 107.6 56.2 -53.1 -44.7 88.2 61.0 -16.7 283 317 A C H >X S+ 0 0 0 -4,-2.2 4,-3.7 1,-0.2 3,-0.6 0.922 106.7 48.4 -56.6 -44.5 85.9 63.8 -15.6 284 318 A S H 3< S+ 0 0 26 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.793 111.1 50.5 -64.7 -30.6 83.2 62.7 -18.1 285 319 A R H 3< S+ 0 0 89 -4,-1.6 10,-2.2 -3,-0.3 -1,-0.3 0.688 117.4 40.8 -82.4 -15.7 83.6 59.2 -16.9 286 320 A L H << S+ 0 0 0 -4,-1.3 2,-1.8 -3,-0.6 -2,-0.2 0.865 107.4 59.1 -95.2 -51.1 83.2 60.3 -13.3 287 321 A L S < S+ 0 0 0 -4,-3.7 2,-0.4 -5,-0.2 -1,-0.2 -0.490 73.5 147.1 -85.3 77.2 80.4 62.9 -13.5 288 322 A E - 0 0 57 -2,-1.8 6,-0.1 -3,-0.2 5,-0.1 -0.913 49.8-140.2-111.3 133.3 77.7 60.8 -14.9 289 323 A Y S S+ 0 0 9 -2,-0.4 -97,-0.2 4,-0.1 -1,-0.2 0.976 92.5 67.8 -53.2 -58.3 73.9 61.2 -14.2 290 324 A T S > S- 0 0 18 1,-0.2 3,-1.2 3,-0.1 4,-0.2 -0.431 80.2-149.2 -65.1 117.0 73.4 57.4 -14.0 291 325 A P G > S+ 0 0 16 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.902 92.3 52.3 -59.1 -39.9 75.2 56.3 -10.9 292 326 A T G 3 S+ 0 0 128 1,-0.3 -2,-0.1 -43,-0.1 -3,-0.1 0.668 100.9 65.7 -67.7 -15.3 76.2 52.8 -12.0 293 327 A A G < S+ 0 0 40 -3,-1.2 2,-0.3 -5,-0.1 -1,-0.3 0.464 79.7 102.1 -84.4 2.7 77.6 54.3 -15.2 294 328 A R S < S- 0 0 12 -3,-1.8 -8,-0.2 -4,-0.2 -9,-0.1 -0.683 86.4-101.9 -87.1 141.5 80.3 56.1 -13.2 295 329 A L - 0 0 18 -10,-2.2 -1,-0.1 -2,-0.3 -7,-0.1 -0.117 39.1-115.4 -50.6 151.3 83.7 54.5 -13.3 296 330 A T > - 0 0 60 1,-0.1 4,-1.8 -3,-0.1 5,-0.1 -0.516 29.0-105.8 -83.1 167.3 84.5 52.6 -10.1 297 331 A P H > S+ 0 0 12 0, 0.0 4,-2.0 0, 0.0 3,-0.3 0.940 121.2 47.5 -59.5 -44.8 87.4 53.9 -8.0 298 332 A L H > S+ 0 0 5 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.899 110.0 52.0 -63.7 -37.0 89.8 51.2 -9.0 299 333 A E H 4 S+ 0 0 71 1,-0.2 -1,-0.2 2,-0.2 -4,-0.1 0.828 106.4 57.1 -65.6 -29.5 88.9 51.6 -12.7 300 334 A A H >< S+ 0 0 0 -4,-1.8 3,-1.9 -3,-0.3 6,-0.2 0.914 103.2 51.4 -67.2 -44.1 89.7 55.3 -12.2 301 335 A C H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.895 109.2 52.7 -60.8 -36.1 93.2 54.5 -11.0 302 336 A A T 3< S+ 0 0 13 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.360 86.0 118.6 -78.5 5.5 93.6 52.4 -14.2 303 337 A H S X S- 0 0 28 -3,-1.9 3,-1.6 -5,-0.1 -3,-0.1 -0.332 77.1-116.7 -73.9 155.2 92.5 55.3 -16.3 304 338 A S G > S+ 0 0 52 1,-0.3 3,-2.6 2,-0.2 4,-0.3 0.819 108.7 73.4 -59.8 -31.0 95.0 56.7 -18.9 305 339 A F G 3 S+ 0 0 3 1,-0.3 3,-0.5 -27,-0.3 -1,-0.3 0.837 97.4 50.9 -52.5 -30.2 95.1 60.0 -17.2 306 340 A F G <> S+ 0 0 0 -3,-1.6 4,-0.6 -6,-0.2 -1,-0.3 0.169 77.5 104.6 -95.6 22.3 97.2 58.3 -14.6 307 341 A D H X> S+ 0 0 80 -3,-2.6 3,-1.6 1,-0.2 4,-1.0 0.894 70.7 62.8 -69.0 -38.5 99.7 56.7 -17.0 308 342 A E H >4 S+ 0 0 75 -3,-0.5 3,-0.9 -4,-0.3 6,-0.3 0.891 98.4 57.8 -53.5 -41.7 102.5 59.2 -16.1 309 343 A L H 34 S+ 0 0 0 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.2 0.824 104.6 50.8 -59.8 -27.0 102.4 57.8 -12.6 310 344 A R H << S+ 0 0 19 -3,-1.6 -1,-0.2 -4,-0.6 -2,-0.2 0.677 83.9 117.2 -85.2 -14.4 103.1 54.3 -14.0 311 345 A D S << S- 0 0 72 -4,-1.0 3,-0.0 -3,-0.9 -3,-0.0 -0.231 70.0-131.9 -52.8 132.0 106.1 55.6 -16.0 312 346 A P S S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.820 103.1 43.7 -59.8 -31.6 109.4 54.0 -14.9 313 347 A N S S+ 0 0 122 2,-0.0 -2,-0.0 -5,-0.0 -5,-0.0 0.846 79.3 133.8 -84.6 -36.1 111.2 57.3 -14.8 314 348 A V + 0 0 23 -6,-0.3 8,-0.4 1,-0.1 2,-0.3 0.341 26.8 173.8 -19.7 130.7 108.6 59.5 -13.1 315 349 A K - 0 0 112 6,-0.1 6,-0.2 0, 0.0 4,-0.1 -0.987 38.0 -98.2-145.6 148.4 109.9 61.7 -10.3 316 350 A L > - 0 0 5 4,-2.5 3,-1.4 -2,-0.3 6,-0.1 -0.186 46.5-102.3 -58.9 161.2 108.2 64.4 -8.2 317 351 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 -194,-0.0 0.768 124.3 61.3 -60.5 -21.1 109.0 67.9 -9.4 318 352 A N T 3 S- 0 0 74 -160,-0.2 2,-0.7 2,-0.1 -2,-0.1 -0.090 118.9-109.7 -94.4 35.4 111.5 68.1 -6.6 319 353 A G S < S+ 0 0 54 -3,-1.4 -1,-0.1 1,-0.2 -3,-0.0 0.249 81.2 124.1 61.1 -18.3 113.5 65.2 -7.9 320 354 A R - 0 0 130 -2,-0.7 -4,-2.5 1,-0.1 -1,-0.2 -0.176 69.6 -89.3 -69.6 165.1 112.4 63.0 -5.0 321 355 A D - 0 0 107 -6,-0.2 -6,-0.1 1,-0.1 -1,-0.1 -0.301 42.5-104.1 -71.2 163.0 110.7 59.6 -5.6 322 356 A T - 0 0 32 -8,-0.4 3,-0.1 1,-0.1 -162,-0.1 -0.509 41.3-103.1 -82.9 153.6 106.9 59.3 -6.0 323 357 A P - 0 0 21 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.088 57.8 -61.4 -62.4-176.2 104.9 57.9 -3.0 324 358 A A + 0 0 48 1,-0.2 0, 0.0 -251,-0.1 0, 0.0 -0.551 69.0 144.4 -70.8 130.8 103.6 54.3 -2.9 325 359 A L + 0 0 4 -2,-0.3 -1,-0.2 -3,-0.1 3,-0.0 0.469 66.9 41.4-142.8 -15.8 101.1 53.7 -5.8 326 360 A F S S+ 0 0 43 1,-0.1 2,-3.5 18,-0.1 -2,-0.1 0.474 73.3 107.1-118.0 -6.1 101.5 50.2 -7.0 327 361 A N + 0 0 85 17,-0.0 2,-0.1 2,-0.0 -1,-0.1 -0.177 50.4 169.3 -70.7 53.7 101.9 48.2 -3.8 328 362 A F - 0 0 23 -2,-3.5 2,-0.2 12,-0.1 -2,-0.0 -0.411 28.7-136.0 -66.2 137.7 98.4 46.7 -4.3 329 363 A T > - 0 0 50 1,-0.1 4,-1.6 -2,-0.1 5,-0.2 -0.611 21.9-115.0 -88.8 159.6 97.6 43.9 -2.0 330 364 A T H > S+ 0 0 128 1,-0.2 4,-1.1 -2,-0.2 3,-0.4 0.944 120.5 53.9 -59.3 -42.8 95.9 40.8 -3.4 331 365 A Q H >4 S+ 0 0 160 1,-0.2 3,-0.8 2,-0.2 4,-0.4 0.923 104.4 56.6 -54.3 -45.0 92.8 41.7 -1.2 332 366 A E H 34 S+ 0 0 26 1,-0.2 3,-0.5 2,-0.1 -1,-0.2 0.873 113.5 37.7 -55.4 -41.3 92.9 45.2 -2.7 333 367 A L H >< S+ 0 0 14 -4,-1.6 3,-2.3 -3,-0.4 -1,-0.2 0.494 87.0 97.1 -91.0 -5.5 92.5 44.0 -6.4 334 368 A S T << S+ 0 0 81 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.1 0.749 72.2 68.5 -58.8 -23.3 90.2 41.1 -5.7 335 369 A S T 3 S+ 0 0 86 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.1 0.713 126.8 1.7 -71.4 -12.6 87.2 43.3 -6.7 336 370 A N S X S- 0 0 45 -3,-2.3 3,-2.6 1,-0.0 4,-0.3 -0.181 70.4-179.3-172.1 63.4 88.4 43.3 -10.3 337 371 A P G > S+ 0 0 75 0, 0.0 3,-3.5 0, 0.0 4,-0.4 0.795 75.9 70.7 -35.8 -52.2 91.6 41.3 -10.8 338 372 A P G > S+ 0 0 88 0, 0.0 3,-1.1 0, 0.0 4,-0.1 0.759 88.0 67.2 -42.5 -31.6 91.9 42.0 -14.6 339 373 A L G X> S+ 0 0 20 -3,-2.6 4,-3.6 1,-0.2 3,-2.6 0.725 79.0 81.1 -64.8 -22.4 92.9 45.6 -13.6 340 374 A A H <> S+ 0 0 30 -3,-3.5 4,-2.1 1,-0.3 -1,-0.2 0.896 82.1 63.1 -50.5 -42.6 96.1 44.3 -12.1 341 375 A T H <4 S+ 0 0 120 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.621 116.8 28.1 -62.7 -12.9 97.6 44.2 -15.6 342 376 A I H <4 S+ 0 0 73 -3,-2.6 -1,-0.2 -4,-0.1 -2,-0.2 0.683 118.7 56.4-113.6 -33.9 97.2 48.0 -15.8 343 377 A L H < S+ 0 0 0 -4,-3.6 -3,-0.2 1,-0.2 -2,-0.2 0.973 105.0 51.0 -62.0 -57.4 97.5 48.8 -12.1 344 378 A I S < S- 0 0 56 -4,-2.1 -1,-0.2 -5,-0.2 4,-0.2 -0.732 90.5-134.3 -86.2 108.3 100.9 47.2 -11.5 345 379 A P - 0 0 10 0, 0.0 3,-0.3 0, 0.0 -3,-0.1 0.051 24.6-102.1 -54.9 167.3 103.4 48.3 -14.1 346 380 A P S S+ 0 0 134 0, 0.0 2,-2.6 0, 0.0 -2,-0.0 0.935 118.6 64.2 -58.7 -48.0 105.8 45.9 -15.9 347 381 A H 0 0 98 1,-0.2 0, 0.0 0, 0.0 0, 0.0 -0.307 360.0 360.0 -74.8 58.0 108.7 47.0 -13.6 348 382 A A 0 0 97 -2,-2.6 -1,-0.2 -3,-0.3 -4,-0.0 0.176 360.0 360.0-169.5 360.0 106.9 45.5 -10.6