==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-AUG-12 4GL3 . COMPND 2 MOLECULE: PUTATIVE GLUCOAMYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES UNIFORMIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 412 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15259.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 277 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.7 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 . 15 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 2 1 0 2 0 0 0 2 0 0 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 11 5 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 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 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 E 0 0 235 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 132.3 10.3 52.3 89.2 2 36 A K - 0 0 147 1,-0.1 2,-0.1 0, 0.0 0, 0.0 -0.176 360.0 -95.2 -57.6 149.6 8.7 54.7 91.8 3 37 A Q - 0 0 124 1,-0.1 2,-0.3 6,-0.0 -1,-0.1 -0.428 35.4-122.0 -66.7 142.1 8.8 53.4 95.4 4 38 A L - 0 0 48 -2,-0.1 -1,-0.1 -3,-0.1 2,-0.0 -0.608 27.5-114.2 -75.6 143.1 5.7 51.5 96.6 5 39 A S > - 0 0 55 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.271 35.1-101.9 -61.5 165.2 4.0 53.0 99.7 6 40 A D H > S+ 0 0 68 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.925 125.5 51.3 -61.2 -40.1 4.2 50.8 102.8 7 41 A D H > S+ 0 0 96 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 111.7 47.2 -63.0 -42.3 0.6 49.7 102.2 8 42 A E H > S+ 0 0 106 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.893 112.8 48.8 -62.2 -43.0 1.4 48.8 98.6 9 43 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.925 112.2 48.3 -63.0 -47.4 4.5 46.9 99.5 10 44 A X H X S+ 0 0 7 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.919 112.4 48.7 -60.8 -44.7 2.7 45.0 102.3 11 45 A T H X S+ 0 0 46 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.908 111.6 48.9 -64.3 -43.3 -0.1 44.1 99.9 12 46 A L H X S+ 0 0 46 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.930 111.4 50.1 -61.7 -43.2 2.3 42.9 97.2 13 47 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.948 114.3 44.7 -62.2 -44.2 4.2 40.8 99.7 14 48 A Q H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.920 115.6 47.3 -64.1 -44.4 1.0 39.2 100.9 15 49 A K H X S+ 0 0 105 -4,-2.7 4,-0.7 2,-0.2 -2,-0.2 0.900 114.5 44.4 -66.5 -44.9 -0.4 38.7 97.4 16 50 A Q H >< S+ 0 0 25 -4,-2.9 3,-0.7 -5,-0.2 4,-0.3 0.915 116.1 46.9 -67.5 -41.6 2.8 37.1 95.9 17 51 A T H >< S+ 0 0 0 -4,-2.2 3,-1.9 -5,-0.3 4,-0.5 0.829 100.3 68.4 -68.9 -32.6 3.3 34.9 99.0 18 52 A F H >X S+ 0 0 8 -4,-1.9 4,-1.4 1,-0.3 3,-1.2 0.806 84.6 72.1 -57.3 -31.3 -0.3 33.8 98.9 19 53 A R T <<>S+ 0 0 80 -3,-0.7 5,-2.2 -4,-0.7 -1,-0.3 0.807 88.0 63.1 -52.8 -34.3 0.4 32.0 95.6 20 54 A Y T <45S+ 0 0 0 -3,-1.9 13,-0.3 -4,-0.3 -1,-0.2 0.836 112.4 34.0 -59.5 -38.7 2.3 29.4 97.7 21 55 A F T <45S+ 0 0 4 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.577 129.5 31.9 -95.1 -17.0 -0.8 28.4 99.5 22 56 A W T ><5S+ 0 0 35 -4,-1.4 3,-0.8 3,-0.1 -3,-0.2 0.801 128.3 25.1-104.4 -73.8 -3.4 28.8 96.8 23 57 A D T 3 5S+ 0 0 111 -4,-0.2 -3,-0.2 1,-0.2 -4,-0.1 0.852 128.8 44.2 -64.6 -36.2 -2.0 28.1 93.3 24 58 A F T 3 - 0 0 2 5,-3.0 4,-2.7 1,-0.1 3,-0.3 -0.427 37.7-141.1 -55.2 130.3 -1.9 20.1 96.4 27 61 A P T 4 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 72,-0.1 0.814 95.4 51.9 -69.3 -27.6 -4.9 20.0 94.0 28 62 A E T 4 S+ 0 0 87 70,-0.1 71,-0.1 1,-0.1 -2,-0.1 0.825 130.1 12.6 -77.3 -30.6 -6.5 16.9 95.6 29 63 A S T 4 S- 0 0 0 69,-0.3 50,-0.2 -3,-0.3 51,-0.2 0.646 86.6-125.2-121.5 -24.1 -6.4 18.2 99.2 30 64 A G < + 0 0 6 -4,-2.7 46,-0.1 1,-0.3 -5,-0.1 0.387 63.5 141.4 79.6 -0.5 -5.6 21.9 99.3 31 65 A L - 0 0 1 67,-0.3 -5,-3.0 -5,-0.2 2,-0.3 -0.331 53.0-108.6 -75.7 156.3 -2.7 21.2 101.6 32 66 A A - 0 0 3 12,-0.4 12,-2.3 -7,-0.2 16,-0.2 -0.619 23.5-120.4 -87.1 138.1 0.6 23.0 101.5 33 67 A H B -A 43 0A 20 -13,-0.3 336,-0.5 -2,-0.3 10,-0.2 -0.498 20.3-127.3 -64.2 147.5 3.8 21.5 100.2 34 68 A E S S- 0 0 21 8,-0.7 335,-1.4 1,-0.2 336,-0.4 0.875 88.0 -8.5 -63.4 -38.8 6.6 21.5 102.8 35 69 A R B > -D 368 0B 55 333,-0.2 3,-0.6 7,-0.2 333,-0.2 -0.972 62.5-118.0-155.0 163.0 8.9 23.3 100.2 36 70 A S T 3 S+ 0 0 36 331,-2.1 332,-0.1 -2,-0.3 -2,-0.0 0.569 111.9 45.4 -80.5 -14.2 9.0 24.3 96.5 37 71 A N T 3 S+ 0 0 85 330,-0.3 -1,-0.2 3,-0.0 2,-0.1 -0.181 101.0 74.4-126.1 43.8 12.0 22.1 95.7 38 72 A G S < S- 0 0 46 -3,-0.6 -5,-0.0 1,-0.5 -2,-0.0 -0.198 90.4 -17.6-123.2-147.2 11.1 18.7 97.5 39 73 A G - 0 0 44 1,-0.1 -1,-0.5 -2,-0.1 -4,-0.1 0.044 43.6-137.5 -44.1 163.1 8.7 15.8 96.8 40 74 A A S S+ 0 0 67 -3,-0.1 -1,-0.1 -7,-0.0 58,-0.1 0.503 107.0 47.1 -84.7 -14.6 5.8 16.2 94.4 41 75 A E S S+ 0 0 76 56,-0.1 57,-2.8 57,-0.1 2,-0.4 0.596 82.8 106.4-105.3 -17.2 4.0 14.2 97.1 42 76 A T E - B 0 97A 25 55,-0.2 -8,-0.7 56,-0.1 2,-0.4 -0.593 37.2-179.9 -84.3 125.3 4.7 15.8 100.5 43 77 A A E -AB 33 96A 0 53,-2.9 53,-1.9 -2,-0.4 2,-0.5 -0.933 18.4-143.1-113.0 142.8 2.2 18.0 102.5 44 78 A T E > - B 0 95A 0 -12,-2.3 4,-1.8 -2,-0.4 -12,-0.4 -0.923 0.8-153.6-110.3 131.5 3.1 19.5 105.8 45 79 A I H > S+ 0 0 0 49,-2.6 4,-1.7 -2,-0.5 -1,-0.1 0.908 93.0 43.8 -71.9 -47.0 0.4 19.7 108.5 46 80 A G H > S+ 0 0 0 48,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.934 117.1 47.6 -61.7 -47.4 1.7 22.7 110.5 47 81 A G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.834 109.0 54.4 -60.6 -36.9 2.4 24.7 107.4 48 82 A S H X S+ 0 0 6 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.868 103.2 56.8 -67.6 -34.0 -1.0 23.7 106.0 49 83 A G H X S+ 0 0 0 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.903 106.9 48.1 -60.5 -40.5 -2.5 25.2 109.2 50 84 A F H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.901 108.5 56.2 -63.9 -37.9 -0.7 28.4 108.3 51 85 A G H X S+ 0 0 4 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.879 101.2 56.1 -58.6 -43.7 -2.2 28.0 104.8 52 86 A V H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.924 110.2 45.1 -54.9 -46.3 -5.7 27.8 106.3 53 87 A X H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.896 109.5 56.2 -66.2 -38.3 -5.1 31.2 107.9 54 88 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.867 102.7 55.9 -60.1 -37.7 -3.6 32.5 104.6 55 89 A I H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.937 107.0 48.5 -61.3 -44.3 -6.8 31.6 102.9 56 90 A I H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.936 112.1 49.5 -61.4 -43.9 -8.9 33.8 105.3 57 91 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 6,-0.2 0.939 109.9 52.8 -57.5 -46.5 -6.4 36.7 104.8 58 92 A G H <>S+ 0 0 0 -4,-2.8 5,-2.2 1,-0.2 6,-1.2 0.838 107.5 49.6 -61.7 -37.2 -6.8 36.2 101.0 59 93 A I H ><5S+ 0 0 17 -4,-2.1 3,-1.1 4,-0.2 -1,-0.2 0.952 113.6 45.9 -64.3 -50.5 -10.6 36.4 101.1 60 94 A E H 3<5S+ 0 0 103 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.793 114.1 48.7 -64.3 -31.8 -10.4 39.6 103.2 61 95 A R T 3<5S- 0 0 76 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.480 114.5-116.9 -85.8 -2.4 -7.8 41.1 100.9 62 96 A G T < 5S+ 0 0 58 -3,-1.1 -3,-0.2 -4,-0.4 -4,-0.1 0.645 77.7 128.9 75.7 16.5 -9.8 40.2 97.8 63 97 A F S - 0 0 69 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.399 31.8-113.9 -79.2 161.8 -13.7 35.5 96.5 66 100 A R H > S+ 0 0 48 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.863 119.3 53.0 -61.9 -37.7 -15.4 34.2 99.7 67 101 A E H > S+ 0 0 124 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.915 111.0 47.3 -64.7 -41.8 -17.1 31.5 97.7 68 102 A Q H > S+ 0 0 83 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.908 113.4 47.5 -64.3 -43.2 -13.7 30.4 96.3 69 103 A G H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.888 112.0 48.9 -67.1 -40.5 -12.1 30.4 99.7 70 104 A A H X S+ 0 0 4 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.890 109.2 53.8 -63.7 -41.0 -15.0 28.5 101.3 71 105 A E H X S+ 0 0 141 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.949 111.8 44.4 -60.4 -47.8 -14.8 25.9 98.5 72 106 A R H X S+ 0 0 39 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.917 112.1 52.5 -60.1 -48.5 -11.1 25.4 99.1 73 107 A X H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.903 107.9 51.2 -57.0 -44.2 -11.6 25.3 102.9 74 108 A L H X S+ 0 0 15 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.916 108.8 51.9 -59.7 -42.8 -14.3 22.6 102.6 75 109 A K H X S+ 0 0 72 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.926 111.7 48.0 -57.3 -45.3 -11.9 20.5 100.4 76 110 A I H X S+ 0 0 4 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.936 114.2 42.5 -62.7 -51.6 -9.2 20.8 103.1 77 111 A V H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.848 112.6 54.0 -73.9 -29.7 -11.3 19.9 106.1 78 112 A R H X S+ 0 0 133 -4,-2.5 4,-0.8 -5,-0.3 -1,-0.2 0.917 110.9 47.0 -62.9 -44.2 -13.0 17.1 104.2 79 113 A F H >< S+ 0 0 29 -4,-2.1 3,-0.5 -50,-0.2 -2,-0.2 0.910 112.6 48.3 -62.1 -44.7 -9.5 15.7 103.4 80 114 A L H 3< S+ 0 0 4 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.791 115.8 44.0 -67.6 -29.6 -8.2 16.0 106.9 81 115 A S H 3< S+ 0 0 47 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.524 83.8 119.1 -92.0 -10.4 -11.3 14.3 108.4 82 116 A D X< - 0 0 73 -4,-0.8 3,-1.5 -3,-0.5 -3,-0.0 -0.348 69.1-131.3 -60.8 135.1 -11.6 11.5 105.9 83 117 A K T 3 S+ 0 0 200 1,-0.2 4,-0.2 3,-0.0 -1,-0.2 0.722 107.7 59.2 -59.0 -21.8 -11.2 8.0 107.5 84 118 A N T 3 S+ 0 0 93 2,-0.1 2,-0.5 -5,-0.0 -1,-0.2 0.583 85.8 88.1 -86.1 -9.7 -8.6 7.1 104.8 85 119 A T S < S- 0 0 6 -3,-1.5 17,-0.2 -6,-0.2 16,-0.1 -0.803 93.3-108.0 -85.8 125.3 -6.4 10.0 105.8 86 120 A D + 0 0 48 15,-2.3 7,-0.4 -2,-0.5 2,-0.3 -0.262 49.1 160.2 -62.4 134.7 -4.1 8.8 108.6 87 121 A S - 0 0 69 -4,-0.2 2,-0.4 5,-0.1 5,-0.2 -0.975 25.6-153.2-150.2 158.8 -4.6 10.0 112.1 88 122 A Y B > S-E 91 0C 37 3,-3.0 3,-2.0 -2,-0.3 24,-0.0 -0.965 80.9 -20.8-140.8 110.4 -3.6 8.8 115.6 89 123 A H T 3 S- 0 0 61 -2,-0.4 65,-2.0 1,-0.3 68,-0.1 0.861 128.8 -51.8 54.6 39.2 -5.7 9.7 118.7 90 124 A G T 3 S+ 0 0 18 1,-0.3 -1,-0.3 63,-0.2 2,-0.3 0.346 119.6 108.1 81.6 -3.6 -7.2 12.6 116.6 91 125 A X B < -E 88 0C 0 -3,-2.0 -3,-3.0 61,-0.1 -1,-0.3 -0.706 58.4-136.8-104.3 157.1 -3.8 14.0 115.6 92 126 A W - 0 0 2 22,-0.3 22,-2.5 -2,-0.3 26,-0.3 -0.679 24.2-101.4-102.4 163.7 -2.0 13.9 112.3 93 127 A A - 0 0 2 -7,-0.4 -48,-0.2 20,-0.3 20,-0.2 -0.192 33.3-110.6 -66.8 162.4 1.6 13.2 111.3 94 128 A H S S+ 0 0 19 18,-0.4 -49,-2.6 1,-0.2 2,-0.4 0.943 105.0 26.3 -60.2 -52.0 4.1 16.1 110.5 95 129 A W E +BC 44 104A 59 9,-0.6 9,-2.3 -51,-0.2 2,-0.3 -0.924 69.3 169.8-116.9 142.0 4.1 15.0 106.9 96 130 A X E -BC 43 103A 0 -53,-1.9 -53,-2.9 -2,-0.4 2,-0.5 -0.956 45.8 -90.4-140.2 161.8 1.5 13.2 104.8 97 131 A N E > -B 42 0A 23 5,-2.6 4,-2.3 -2,-0.3 -55,-0.2 -0.627 33.5-145.1 -71.0 123.1 1.0 12.4 101.1 98 132 A G T 4 S+ 0 0 0 -57,-2.8 -69,-0.3 -2,-0.5 -67,-0.3 0.554 95.9 39.5 -72.0 -9.2 -1.0 15.4 99.7 99 133 A K T 4 S+ 0 0 75 -58,-0.3 -1,-0.2 -71,-0.1 -57,-0.1 0.785 128.7 24.6-100.4 -44.7 -2.9 13.2 97.3 100 134 A T T 4 S- 0 0 76 -59,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.631 90.3-129.8-101.4 -16.2 -3.6 10.0 99.4 101 135 A G < + 0 0 0 -4,-2.3 -15,-2.3 1,-0.3 2,-0.3 0.588 56.5 144.2 77.3 9.2 -3.5 11.2 103.0 102 136 A K - 0 0 91 -17,-0.2 -5,-2.6 1,-0.1 -1,-0.3 -0.603 56.8-101.4 -82.6 138.6 -1.1 8.5 104.1 103 137 A T E -C 96 0A 24 -2,-0.3 -7,-0.3 -7,-0.2 -1,-0.1 -0.289 27.3-157.0 -55.3 140.3 1.5 9.4 106.7 104 138 A I E -C 95 0A 44 -9,-2.3 -9,-0.6 -61,-0.1 -10,-0.1 -0.994 27.7-119.7-114.4 115.7 5.1 10.1 105.5 105 139 A P - 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0 0 2 -2,-0.7 12,-0.1 137,-0.2 11,-0.1 -0.716 12.6-166.2 -79.9 114.3 -2.8 37.5 120.4 252 286 A P > + 0 0 1 0, 0.0 3,-1.7 0, 0.0 11,-0.5 0.610 53.5 112.6 -77.4 -8.6 0.1 38.4 122.7 253 287 A R T 3 S- 0 0 98 1,-0.3 3,-0.1 9,-0.1 -2,-0.1 -0.487 98.8 -5.4 -70.7 120.5 -1.0 42.0 123.1 254 288 A G T 3 S+ 0 0 20 -2,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.543 100.5 143.2 70.3 8.2 -2.1 42.5 126.8 255 289 A L < + 0 0 0 -3,-1.7 7,-2.6 153,-0.1 8,-0.6 -0.696 20.9 164.6 -83.2 126.1 -1.6 38.7 127.3 256 290 A K B +LM 261 407J 91 151,-2.2 151,-2.3 -2,-0.4 2,-0.2 -1.000 15.7 172.2-143.1 136.8 -0.2 37.9 130.7 257 291 A D - 0 0 16 3,-2.0 148,-0.1 -2,-0.3 149,-0.1 -0.618 59.0 -80.1-124.9-168.1 0.1 34.7 132.9 258 292 A R S S+ 0 0 177 -2,-0.2 3,-0.1 1,-0.2 147,-0.1 0.613 127.9 45.7 -71.5 -11.3 1.9 34.3 136.2 259 293 A Y S S- 0 0 53 1,-0.3 2,-0.3 -41,-0.0 -1,-0.2 0.779 117.0 -1.3-100.7 -37.1 5.2 33.9 134.3 260 294 A A - 0 0 11 -42,-0.0 -3,-2.0 -30,-0.0 2,-0.7 -0.992 50.6-119.0-154.2 160.8 5.3 36.7 131.7 261 295 A D B > -L 256 0J 43 -2,-0.3 4,-2.0 -5,-0.2 -5,-0.2 -0.936 34.9-158.6 -93.2 109.5 3.8 39.7 129.9 262 296 A Y H > S+ 0 0 0 -7,-2.6 4,-2.2 -2,-0.7 5,-0.2 0.789 86.6 58.3 -72.9 -25.5 3.8 38.1 126.4 263 297 A E H > S+ 0 0 57 -8,-0.6 4,-2.1 -11,-0.5 -1,-0.2 0.918 108.8 46.6 -64.9 -44.5 3.7 41.4 124.6 264 298 A E H > S+ 0 0 76 -3,-0.2 4,-3.0 1,-0.2 5,-0.3 0.910 110.7 54.3 -59.1 -43.6 6.9 42.4 126.3 265 299 A Q H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.924 109.8 45.0 -57.4 -47.9 8.3 38.9 125.4 266 300 A X H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.916 117.0 44.8 -70.2 -41.1 7.6 39.2 121.7 267 301 A K H X S+ 0 0 85 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.924 114.1 49.2 -64.3 -46.9 9.0 42.8 121.5 268 302 A A H X S+ 0 0 5 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.940 112.5 47.2 -60.0 -50.3 12.1 42.0 123.6 269 303 A H H X S+ 0 0 1 -4,-2.7 4,-2.3 -5,-0.3 5,-0.2 0.929 113.5 48.4 -60.1 -46.3 13.0 38.9 121.5 270 304 A T H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.919 114.6 44.6 -57.7 -44.3 12.5 40.8 118.2 271 305 A L H X S+ 0 0 53 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.873 112.6 51.1 -77.0 -33.8 14.6 43.8 119.3 272 306 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.922 109.6 50.2 -63.5 -45.1 17.4 41.6 120.8 273 307 A N H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.2 20,-0.3 0.950 114.7 45.3 -58.6 -46.2 17.6 39.5 117.5 274 308 A R H X S+ 0 0 28 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.914 110.9 51.9 -61.2 -46.4 17.8 42.8 115.6 275 309 A A H X S+ 0 0 19 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.891 106.7 54.7 -61.4 -38.7 20.4 44.3 118.0 276 310 A Y H X S+ 0 0 11 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.939 108.9 48.4 -57.2 -44.9 22.5 41.1 117.6 277 311 A C H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.883 111.6 48.3 -66.8 -37.1 22.5 41.7 113.9 278 312 A I H < S+ 0 0 63 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.916 110.9 50.6 -69.0 -42.7 23.4 45.3 114.2 279 313 A D H < S- 0 0 93 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.916 85.7-173.8 -56.8 -42.8 26.3 44.4 116.6 280 314 A N >< + 0 0 34 -4,-2.7 3,-1.6 -5,-0.2 -3,-0.1 0.924 5.7 179.5 49.5 55.9 27.4 41.8 114.0 281 315 A P T 3 S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.805 76.3 51.6 -63.8 -26.3 30.0 40.3 116.2 282 316 A K T 3 S- 0 0 124 2,-0.0 -2,-0.1 1,-0.0 -3,-0.0 0.529 108.9-124.4 -86.0 -4.7 31.2 37.7 113.6 283 317 A G < + 0 0 56 -3,-1.6 3,-0.1 1,-0.2 -3,-0.1 0.817 42.6 175.3 71.4 33.9 31.6 40.4 111.0 284 318 A Y > - 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