==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-AUG-12 4GVQ . COMPND 2 MOLECULE: METHENYLTETRAHYDROMETHANOPTERIN CYCLOHYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR V.UPADHYAY,U.DEMMER,E.WARKENTIN,J.MOLL,S.SHIMA,U.ERMLER . 945 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32996.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 700 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 141 14.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 . 76 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 241 25.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 38 4.0 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 6 3 0 9 3 0 0 9 0 2 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 0 3 0 6 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 0 3 3 6 6 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 3 3 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 1 A M 0 0 130 0, 0.0 2,-0.5 0, 0.0 335,-0.1 0.000 360.0 360.0 360.0 150.1 1.3 -33.5 -22.4 2 2 A L - 0 0 13 334,-0.1 2,-0.7 335,-0.0 3,-0.1 -0.910 360.0-152.9-101.5 129.1 0.9 -33.3 -18.7 3 3 A S > - 0 0 9 -2,-0.5 4,-2.5 1,-0.2 5,-0.3 -0.877 7.2-168.5-103.7 104.0 -0.4 -30.0 -17.4 4 4 A V H > S+ 0 0 0 -2,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.861 88.8 50.6 -61.7 -32.9 0.7 -29.4 -13.8 5 5 A N H > S+ 0 0 0 106,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.929 111.2 45.4 -71.7 -43.6 -1.7 -26.5 -13.4 6 6 A E H > S+ 0 0 103 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.927 116.3 46.6 -64.6 -41.7 -4.8 -28.3 -14.7 7 7 A I H X S+ 0 0 27 -4,-2.5 4,-1.4 1,-0.2 3,-0.4 0.950 114.7 46.3 -65.3 -46.8 -4.0 -31.4 -12.6 8 8 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.864 105.4 60.1 -64.7 -34.2 -3.3 -29.3 -9.4 9 9 A A H X S+ 0 0 11 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.870 102.3 54.2 -62.6 -35.3 -6.5 -27.1 -10.0 10 10 A E H X S+ 0 0 138 -4,-1.4 4,-1.8 -3,-0.4 -1,-0.2 0.906 108.5 48.6 -62.5 -41.3 -8.5 -30.4 -9.7 11 11 A I H X S+ 0 0 27 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.919 110.6 50.9 -65.0 -44.1 -6.8 -31.1 -6.3 12 12 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.933 107.9 51.7 -60.0 -43.3 -7.5 -27.6 -5.1 13 13 A E H X S+ 0 0 75 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.885 109.1 51.5 -63.5 -31.0 -11.2 -27.9 -6.1 14 14 A D H >< S+ 0 0 75 -4,-1.8 3,-0.5 2,-0.2 4,-0.5 0.928 108.2 51.7 -67.5 -43.8 -11.3 -31.1 -4.1 15 15 A M H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 7,-0.2 0.923 106.1 55.1 -54.6 -43.3 -9.8 -29.3 -1.1 16 16 A L H >< S+ 0 0 27 -4,-2.4 3,-0.8 1,-0.3 -1,-0.2 0.773 100.6 59.2 -67.4 -24.1 -12.5 -26.7 -1.4 17 17 A D T << S+ 0 0 118 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.601 114.2 37.0 -74.7 -12.2 -15.2 -29.4 -1.1 18 18 A Y T <> S+ 0 0 108 -3,-1.7 4,-2.4 -4,-0.5 -1,-0.2 -0.129 75.1 136.8-131.2 35.1 -13.8 -30.4 2.3 19 19 A E H <>>S+ 0 0 49 -3,-0.8 5,-2.2 1,-0.2 4,-0.9 0.919 74.8 43.8 -53.5 -53.0 -12.8 -27.0 3.8 20 20 A E H >45S+ 0 0 100 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.912 114.1 49.0 -65.3 -44.2 -14.2 -27.5 7.2 21 21 A E H 345S+ 0 0 61 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.896 115.6 45.3 -60.6 -38.9 -12.9 -31.1 7.6 22 22 A L H 3<5S- 0 0 12 -4,-2.4 26,-0.3 -7,-0.2 -1,-0.2 0.556 109.5-126.0 -81.6 -9.0 -9.4 -29.9 6.4 23 23 A R T <<5 + 0 0 88 -4,-0.9 21,-2.4 -3,-0.7 2,-0.2 0.873 68.3 124.2 61.2 43.9 -9.6 -26.8 8.7 24 24 A I < - 0 0 5 -5,-2.2 2,-0.3 -6,-0.2 -1,-0.2 -0.756 46.7-149.8-121.4 170.4 -8.9 -24.4 5.8 25 25 A E E -A 37 0A 114 12,-2.0 12,-2.9 -2,-0.2 2,-0.3 -0.996 6.0-159.8-145.5 134.2 -10.8 -21.4 4.4 26 26 A S E -A 36 0A 46 -2,-0.3 2,-0.3 10,-0.3 10,-0.2 -0.829 6.2-175.5-111.3 160.0 -11.2 -19.9 1.0 27 27 A K E -A 35 0A 143 8,-1.9 8,-2.7 -2,-0.3 2,-0.5 -0.982 20.8-136.8-147.0 143.4 -12.2 -16.5 -0.3 28 28 A K E -A 34 0A 117 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.893 28.0-140.7 -97.7 127.3 -12.7 -15.1 -3.8 29 29 A L > - 0 0 20 4,-3.0 3,-2.2 -2,-0.5 117,-0.0 -0.213 31.0 -91.5 -82.1 175.7 -11.2 -11.7 -4.2 30 30 A E T 3 S+ 0 0 167 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.780 127.6 49.7 -60.9 -27.9 -12.7 -8.7 -6.2 31 31 A N T 3 S- 0 0 18 2,-0.1 -1,-0.3 130,-0.1 131,-0.1 0.356 122.6-103.9 -92.0 5.3 -10.8 -9.8 -9.3 32 32 A G S < S+ 0 0 8 -3,-2.2 -2,-0.1 1,-0.3 132,-0.1 0.323 73.0 142.1 93.9 -12.9 -12.0 -13.4 -9.0 33 33 A A - 0 0 0 -5,-0.1 -4,-3.0 130,-0.1 2,-0.6 -0.388 46.3-134.6 -63.2 143.1 -8.8 -15.0 -7.7 34 34 A I E -Ab 28 165A 24 130,-2.6 132,-2.4 -6,-0.2 2,-0.5 -0.916 17.1-166.6-104.7 123.6 -9.3 -17.7 -5.1 35 35 A V E -Ab 27 166A 10 -8,-2.7 -8,-1.9 -2,-0.6 2,-0.7 -0.939 4.0-160.9-111.7 121.6 -7.1 -17.5 -2.0 36 36 A V E -Ab 26 167A 0 130,-3.5 132,-2.2 -2,-0.5 2,-0.7 -0.892 9.0-147.9-109.3 106.9 -7.1 -20.7 0.1 37 37 A D E +Ab 25 168A 6 -12,-2.9 -12,-2.0 -2,-0.7 7,-0.2 -0.679 24.0 169.7 -75.0 113.5 -5.9 -20.1 3.7 38 38 A C S S- 0 0 0 130,-3.0 137,-0.4 -2,-0.7 7,-0.2 0.258 77.2 -15.0-108.5 7.9 -4.2 -23.3 4.8 39 39 A G S S+ 0 0 10 129,-0.4 130,-0.2 5,-0.1 -2,-0.1 0.485 105.2 90.7 171.9 5.8 -2.6 -22.0 8.0 40 40 A V S S+ 0 0 32 128,-0.4 129,-0.1 1,-0.1 -3,-0.0 0.970 115.8 1.1 -79.4 -58.3 -2.4 -18.2 8.4 41 41 A N S S+ 0 0 129 -16,-0.1 -1,-0.1 102,-0.0 -4,-0.0 0.173 132.7 57.0-116.1 17.9 -5.7 -17.6 10.3 42 42 A V S S- 0 0 16 -17,-0.1 -18,-0.1 1,-0.0 -17,-0.1 -0.921 82.2-120.4-141.6 161.5 -6.8 -21.2 10.4 43 43 A P - 0 0 72 0, 0.0 131,-0.6 0, 0.0 132,-0.4 0.813 37.8-162.1 -75.8 -30.4 -5.2 -24.4 11.8 44 44 A G - 0 0 0 -21,-2.4 2,-0.3 -7,-0.2 -5,-0.1 -0.301 13.5-125.0 62.6-165.1 -5.0 -26.5 8.7 45 45 A S > - 0 0 3 -7,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.974 23.2 -91.4-166.3 166.2 -4.5 -30.2 9.1 46 46 A Y H > S+ 0 0 1 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.932 126.2 48.5 -57.6 -46.3 -2.3 -33.2 8.2 47 47 A D H > S+ 0 0 56 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.904 108.6 52.3 -68.2 -36.8 -4.5 -33.9 5.2 48 48 A A H > S+ 0 0 0 -26,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.901 109.8 51.8 -59.6 -37.6 -4.4 -30.2 4.1 49 49 A G H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.905 109.3 48.5 -64.2 -44.8 -0.6 -30.6 4.3 50 50 A I H X S+ 0 0 9 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.938 114.3 45.7 -60.2 -46.0 -0.7 -33.7 2.1 51 51 A M H X S+ 0 0 25 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.900 110.4 53.0 -69.0 -37.0 -2.9 -32.0 -0.5 52 52 A Y H X S+ 0 0 1 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.924 111.2 47.7 -59.9 -43.1 -0.8 -28.8 -0.4 53 53 A T H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.910 109.8 52.1 -62.8 -45.3 2.3 -31.0 -1.1 54 54 A Q H <>S+ 0 0 49 -4,-2.6 5,-2.7 1,-0.2 6,-0.3 0.904 111.0 48.2 -58.9 -42.7 0.5 -32.8 -3.9 55 55 A V H ><5S+ 0 0 0 -4,-2.4 3,-2.2 1,-0.2 -2,-0.2 0.928 108.0 53.5 -62.3 -45.4 -0.4 -29.5 -5.5 56 56 A C H 3<5S+ 0 0 0 -4,-2.6 54,-0.3 1,-0.3 -1,-0.2 0.852 107.9 52.1 -56.9 -37.2 3.2 -28.3 -5.1 57 57 A M T ><5S- 0 0 1 -4,-2.0 3,-1.8 35,-0.2 -1,-0.3 0.208 117.4-114.8 -88.3 14.2 4.3 -31.4 -7.0 58 58 A G T < 5 - 0 0 0 -3,-2.2 -3,-0.2 1,-0.3 -50,-0.2 0.719 61.1 -69.5 68.7 21.0 1.8 -30.7 -9.9 59 59 A G T 3 S-F 73 0B 1 3,-2.2 3,-2.3 -2,-0.3 -2,-0.0 -0.987 96.1 -15.6-127.5 115.9 13.2 -42.3 15.8 71 71 A N T 3 S- 0 0 125 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 0.901 130.2 -57.7 50.6 43.2 15.1 -43.7 18.8 72 72 A D T 3 S+ 0 0 84 1,-0.2 -1,-0.3 860,-0.0 844,-0.0 0.258 110.7 126.3 70.9 -7.2 11.6 -44.9 19.9 73 73 A V E < -F 70 0B 6 -3,-2.3 -3,-2.2 1,-0.1 -1,-0.2 -0.665 62.3-123.0 -79.3 128.5 10.2 -41.3 19.9 74 74 A P E +F 69 0B 0 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.501 38.7 162.8 -76.4 140.7 7.1 -41.1 17.7 75 75 A F E -F 68 0B 0 -7,-2.7 -7,-2.4 -2,-0.2 2,-0.3 -0.975 39.7-113.5-141.6 154.8 6.8 -38.8 14.8 76 76 A A E -F 67 0B 3 135,-0.3 135,-3.1 -2,-0.3 2,-0.4 -0.729 38.3-161.0 -79.9 141.9 4.6 -38.4 11.7 77 77 A F E -FG 66 210B 1 -11,-2.9 -11,-2.1 -2,-0.3 2,-0.4 -0.956 16.9-130.6-122.9 143.2 6.6 -39.0 8.5 78 78 A V E -FG 65 209B 0 131,-2.9 131,-2.0 -2,-0.4 2,-0.4 -0.777 22.2-172.5 -80.7 135.3 6.0 -38.0 4.9 79 79 A T E +FG 64 208B 9 -15,-2.4 -15,-2.4 -2,-0.4 2,-0.3 -0.998 20.4 157.7-123.8 131.1 6.5 -41.0 2.5 80 80 A E E -FG 63 207B 0 127,-2.4 127,-2.7 -2,-0.4 2,-0.3 -0.984 21.1-174.5-152.5 158.7 6.4 -40.0 -1.2 81 81 A Y E -FG 62 206B 6 -19,-2.1 -19,-2.7 -2,-0.3 2,-0.3 -0.993 1.7-171.9-155.2 156.7 7.4 -41.0 -4.7 82 82 A T E -FG 61 205B 2 123,-2.5 123,-2.2 -2,-0.3 -21,-0.2 -0.990 22.7-162.9-150.7 143.6 7.3 -39.6 -8.2 83 83 A D S S+ 0 0 11 -23,-0.5 -22,-0.1 -2,-0.3 3,-0.1 0.159 95.4 57.8-107.3 15.3 8.0 -40.9 -11.8 84 84 A H > + 0 0 15 -24,-0.5 4,-3.1 121,-0.1 5,-0.4 -0.430 64.7 155.9-131.7 60.5 8.2 -37.3 -13.1 85 85 A P H >> + 0 0 3 0, 0.0 4,-2.3 0, 0.0 5,-0.8 0.880 68.9 49.4 -64.2 -41.0 11.0 -35.9 -10.9 86 86 A A H >>S+ 0 0 14 116,-0.4 5,-2.3 113,-0.2 4,-1.2 0.953 121.2 34.5 -62.4 -48.2 12.2 -33.1 -13.1 87 87 A I H 45S+ 0 0 34 3,-0.2 5,-0.3 4,-0.2 6,-0.2 0.949 122.7 44.3 -71.3 -49.2 8.7 -31.7 -13.7 88 88 A A H <>S+ 0 0 0 -4,-3.1 5,-2.5 3,-0.2 -2,-0.2 0.882 127.4 27.8 -62.7 -41.2 7.2 -32.4 -10.3 89 89 A C H <>S+ 0 0 0 -4,-2.3 5,-2.5 -5,-0.4 -3,-0.2 0.913 136.3 19.8 -92.7 -51.9 10.2 -31.2 -8.3 90 90 A L T < S-C 104 0A 16 3,-2.6 3,-2.9 -2,-0.4 2,-0.1 -0.941 70.8 -59.5-128.9 106.7 4.6 -6.9 -4.3 102 102 A D T 3 S- 0 0 120 -2,-0.5 -1,-0.0 1,-0.3 0, 0.0 -0.365 123.4 -14.8 48.9-119.0 5.1 -3.6 -2.4 103 103 A K T 3 S+ 0 0 184 -2,-0.1 2,-0.6 -3,-0.1 -1,-0.3 0.507 115.2 104.9 -88.1 -1.9 5.4 -4.7 1.2 104 104 A Y E < +C 101 0A 21 -3,-2.9 -3,-2.6 2,-0.0 2,-0.4 -0.691 47.7 179.6 -87.7 123.4 4.0 -8.2 0.5 105 105 A F E +C 100 0A 117 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.961 7.7 156.1-122.8 136.6 6.7 -11.0 0.5 106 106 A A E -C 99 0A 4 -7,-2.1 -7,-2.6 -2,-0.4 2,-0.6 -0.991 42.9-118.0-151.5 154.8 6.2 -14.7 -0.1 107 107 A M E -CD 98 140A 21 33,-2.2 33,-2.5 -2,-0.3 2,-0.5 -0.851 37.8-147.6 -87.9 124.9 8.1 -17.7 -1.2 108 108 A G E +CD 97 139A 0 -11,-2.0 -11,-2.2 -2,-0.6 2,-0.3 -0.859 26.7 159.5-104.4 124.9 6.3 -18.9 -4.3 109 109 A S E + D 0 138A 2 29,-2.8 29,-2.9 -2,-0.5 3,-0.3 -0.812 27.2 48.8-125.9 170.1 6.2 -22.7 -5.3 110 110 A G S > S- 0 0 0 -18,-2.6 3,-2.2 -16,-0.4 4,-0.3 -0.313 93.6 -30.6 97.4-174.9 4.0 -24.9 -7.4 111 111 A P T > S+ 0 0 0 0, 0.0 3,-2.3 0, 0.0 4,-0.3 0.760 115.6 71.4 -59.4 -30.7 2.5 -25.2 -10.9 112 112 A A T >> S+ 0 0 0 24,-2.6 4,-2.5 -3,-0.3 3,-1.9 0.817 87.3 69.1 -54.5 -28.9 2.1 -21.5 -11.6 113 113 A R H <>>S+ 0 0 0 -3,-2.2 5,-1.6 1,-0.3 4,-1.5 0.783 92.0 59.0 -57.3 -31.0 6.0 -21.4 -11.9 114 114 A A H <45S+ 0 0 0 -3,-2.3 16,-2.0 -4,-0.3 -1,-0.3 0.462 110.8 41.0 -83.7 -2.5 5.6 -23.5 -15.1 115 115 A L H <45S+ 0 0 16 -3,-1.9 -2,-0.2 -4,-0.3 -1,-0.2 0.724 120.6 40.5-102.3 -43.1 3.5 -20.8 -16.7 116 116 A A H <5S- 0 0 14 -4,-2.5 -2,-0.2 2,-0.1 -3,-0.2 0.673 103.9-131.9 -77.3 -17.7 5.4 -17.8 -15.5 117 117 A L T <5 - 0 0 48 -4,-1.5 3,-0.2 -5,-0.3 -3,-0.2 0.974 29.9-160.8 61.9 62.0 8.7 -19.6 -16.2 118 118 A K S > S- 0 0 52 0, 0.0 3,-1.1 0, 0.0 4,-0.9 0.635 84.3-151.9 -84.7 153.2 13.2 -19.1 -13.0 120 120 A K H >> S+ 0 0 130 1,-0.2 4,-1.7 -3,-0.2 3,-0.5 0.861 91.3 60.0 -54.9 -40.2 13.6 -19.3 -16.8 121 121 A K H 3> S+ 0 0 163 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.814 97.2 60.3 -64.7 -28.7 16.8 -21.4 -16.7 122 122 A T H <> S+ 0 0 12 -3,-1.1 4,-2.5 2,-0.2 -1,-0.3 0.912 105.6 46.4 -63.3 -45.2 15.0 -24.3 -14.9 123 123 A Y H S+ 0 0 11 -4,-0.9 4,-1.3 -3,-0.5 5,-1.2 0.869 111.7 51.8 -70.2 -31.1 12.4 -24.7 -17.7 124 124 A E H <5S+ 0 0 118 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.919 112.8 47.0 -63.2 -45.3 15.2 -24.6 -20.3 125 125 A R H <5S+ 0 0 93 -4,-2.2 75,-0.3 1,-0.2 -2,-0.2 0.859 119.6 35.9 -70.5 -40.4 17.1 -27.3 -18.3 126 126 A I H <5S- 0 0 12 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.568 100.6-131.8 -92.0 -8.0 14.2 -29.7 -17.8 127 127 A E T <5 + 0 0 147 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.940 62.5 124.1 57.7 50.6 12.6 -29.0 -21.2 128 128 A Y < + 0 0 21 -5,-1.2 2,-0.3 -6,-0.1 -1,-0.2 -0.998 28.6 165.4-137.6 143.0 9.1 -28.4 -19.8 129 129 A E - 0 0 105 -2,-0.3 -14,-0.2 -3,-0.1 2,-0.1 -0.938 30.2-128.8-149.9 136.4 6.5 -25.6 -20.0 130 130 A D - 0 0 5 -16,-2.0 2,-0.4 -2,-0.3 -127,-0.1 -0.435 9.7-156.1 -78.8 162.1 2.8 -25.9 -19.1 131 131 A D + 0 0 130 -2,-0.1 2,-0.3 0, 0.0 -16,-0.1 -0.906 40.6 128.1-139.7 100.6 0.1 -24.7 -21.4 132 132 A A - 0 0 10 -2,-0.4 -2,-0.0 -127,-0.1 -128,-0.0 -0.992 58.1-139.6-155.0 158.2 -3.0 -23.9 -19.4 133 133 A D S S+ 0 0 127 -2,-0.3 2,-0.3 26,-0.1 27,-0.3 0.122 89.9 66.0-107.5 17.4 -5.6 -21.2 -18.8 134 134 A V - 0 0 24 25,-0.1 2,-0.4 23,-0.1 30,-0.2 -0.968 66.5-159.0-133.4 148.4 -5.6 -21.8 -15.0 135 135 A A E - e 0 164A 0 28,-2.3 30,-2.6 -2,-0.3 2,-0.5 -0.998 4.8-168.2-134.1 136.7 -2.7 -21.2 -12.6 136 136 A V E + e 0 165A 0 -2,-0.4 -24,-2.6 28,-0.2 2,-0.3 -0.981 10.5 179.6-126.3 119.6 -2.1 -22.7 -9.1 137 137 A I E - e 0 166A 0 28,-2.6 30,-2.5 -2,-0.5 2,-0.5 -0.890 18.6-148.3-116.8 150.5 0.5 -21.2 -6.8 138 138 A A E -De 109 167A 0 -29,-2.9 -29,-2.8 -2,-0.3 2,-0.5 -0.980 18.5-162.3-116.8 120.9 1.5 -22.2 -3.3 139 139 A L E -De 108 168A 0 28,-3.4 30,-2.1 -2,-0.5 2,-0.7 -0.891 13.5-155.7-110.3 126.5 2.7 -19.3 -1.1 140 140 A E E +De 107 169A 13 -33,-2.5 -33,-2.2 -2,-0.5 2,-0.3 -0.909 49.2 119.7 -97.4 111.6 4.7 -19.7 2.1 141 141 A A - 0 0 9 28,-1.0 -35,-0.1 -2,-0.7 -2,-0.1 -0.969 67.7-125.5-165.8 158.4 3.9 -16.5 4.0 142 142 A N S S+ 0 0 98 -2,-0.3 2,-0.3 28,-0.1 -36,-0.1 0.152 95.2 56.5 -99.6 11.8 2.4 -15.2 7.3 143 143 A Q S S- 0 0 109 -38,-0.2 26,-0.1 26,-0.1 -103,-0.0 -0.987 85.6-116.0-139.2 146.6 -0.1 -13.0 5.4 144 144 A L - 0 0 62 -2,-0.3 2,-0.2 1,-0.1 -2,-0.1 -0.634 37.0-111.5 -80.0 140.5 -2.7 -13.7 2.8 145 145 A P - 0 0 4 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.458 32.0-146.4 -73.1 143.7 -2.2 -12.1 -0.6 146 146 A D > - 0 0 86 -2,-0.2 4,-2.5 -117,-0.0 5,-0.2 -0.271 36.9 -77.1 -98.5-172.9 -4.6 -9.4 -1.7 147 147 A E H > S+ 0 0 69 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.881 128.2 51.7 -52.4 -45.5 -6.1 -8.4 -5.1 148 148 A K H > S+ 0 0 113 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 110.7 48.2 -65.8 -38.7 -2.9 -6.6 -6.2 149 149 A V H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.942 114.3 45.7 -65.4 -45.5 -0.7 -9.6 -5.4 150 150 A M H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.847 109.3 55.1 -69.6 -32.6 -3.0 -12.0 -7.2 151 151 A E H X S+ 0 0 93 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.914 109.1 49.4 -62.6 -41.6 -3.3 -9.7 -10.2 152 152 A F H X S+ 0 0 66 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.937 111.4 47.2 -63.0 -48.5 0.5 -9.7 -10.4 153 153 A I H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.934 112.8 49.7 -59.1 -45.7 0.7 -13.5 -10.3 154 154 A A H X>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 4,-0.6 0.936 110.2 50.4 -57.7 -48.5 -2.1 -13.8 -12.9 155 155 A K H ><5S+ 0 0 144 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.919 109.2 50.9 -56.3 -44.7 -0.3 -11.4 -15.2 156 156 A E H 3<5S+ 0 0 57 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.813 113.1 45.8 -68.7 -26.0 3.0 -13.2 -15.0 157 157 A C H 3<5S- 0 0 5 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.449 109.6-123.7 -91.9 -4.1 1.3 -16.5 -15.8 158 158 A D T <<5S+ 0 0 141 -3,-1.3 2,-0.3 -4,-0.6 -3,-0.2 0.863 72.0 121.3 59.3 40.2 -0.7 -15.0 -18.7 159 159 A V S - 0 0 107 -2,-0.3 3,-2.4 -27,-0.3 -9,-0.0 -0.543 32.6-119.9 -71.2 144.4 -7.0 -14.0 -16.0 161 161 A P G > S+ 0 0 18 0, 0.0 3,-1.8 0, 0.0 -127,-0.2 0.786 111.5 70.4 -59.1 -25.3 -7.2 -13.6 -12.2 162 162 A E G 3 S+ 0 0 133 1,-0.3 -130,-0.1 -129,-0.1 -2,-0.0 0.628 101.3 47.7 -61.5 -14.5 -10.6 -15.3 -12.2 163 163 A N G < S+ 0 0 63 -3,-2.4 -28,-2.3 -130,-0.0 2,-0.4 0.032 91.7 100.4-116.9 23.7 -8.6 -18.5 -13.1 164 164 A V E < - e 0 135A 1 -3,-1.8 -130,-2.6 -30,-0.2 2,-0.4 -0.912 46.7-171.3-112.1 140.2 -5.8 -18.2 -10.4 165 165 A Y E -be 34 136A 30 -30,-2.6 -28,-2.6 -2,-0.4 2,-0.4 -0.980 2.1-166.9-123.1 141.4 -5.7 -20.1 -7.1 166 166 A A E -be 35 137A 0 -132,-2.4 -130,-3.5 -2,-0.4 2,-0.4 -0.997 7.0-159.9-125.6 127.0 -3.3 -19.6 -4.3 167 167 A L E -be 36 138A 0 -30,-2.5 -28,-3.4 -2,-0.4 2,-0.4 -0.877 20.9-168.0 -93.1 140.7 -2.7 -21.9 -1.3 168 168 A V E +be 37 139A 0 -132,-2.2 -130,-3.0 -2,-0.4 -129,-0.4 -0.991 19.3 150.5-136.1 131.7 -1.1 -20.1 1.6 169 169 A A E - e 0 140A 0 -30,-2.1 -28,-1.0 -2,-0.4 2,-0.1 -0.969 36.8-120.1-154.6 145.6 0.5 -21.3 4.8 170 170 A P - 0 0 10 0, 0.0 6,-0.4 0, 0.0 -28,-0.1 -0.396 31.8-108.9 -79.2 162.4 3.2 -19.9 7.1 171 171 A T S S+ 0 0 11 1,-0.2 2,-1.4 5,-0.1 9,-0.1 0.903 113.7 59.9 -56.3 -44.5 6.4 -21.8 7.9 172 172 A A S S+ 0 0 22 4,-0.1 2,-0.3 42,-0.1 -1,-0.2 -0.697 89.0 88.0 -89.9 88.6 5.2 -22.4 11.5 173 173 A S S > S- 0 0 10 -2,-1.4 4,-2.9 1,-0.1 5,-0.2 -0.944 88.2-104.9-168.7 160.9 2.0 -24.4 10.8 174 174 A I H > S+ 0 0 12 -131,-0.6 4,-2.7 -2,-0.3 5,-0.2 0.922 124.0 50.7 -65.7 -38.8 1.1 -28.0 10.3 175 175 A V H > S+ 0 0 0 -137,-0.4 4,-3.1 -132,-0.4 5,-0.3 0.928 110.7 51.0 -61.8 -41.4 0.7 -27.4 6.6 176 176 A G H > S+ 0 0 0 -6,-0.4 4,-2.4 2,-0.2 5,-0.3 0.951 111.6 46.2 -56.4 -52.4 4.2 -25.8 6.6 177 177 A S H X S+ 0 0 1 -4,-2.9 4,-2.1 1,-0.2 35,-0.4 0.924 116.6 44.1 -60.1 -44.6 5.8 -28.7 8.4 178 178 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.953 114.9 46.5 -68.0 -46.1 4.1 -31.3 6.1 179 179 A Q H < S+ 0 0 1 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.853 113.0 49.6 -70.1 -31.4 4.8 -29.5 2.8 180 180 A I H >< S+ 0 0 4 -4,-2.4 3,-2.2 -5,-0.3 -1,-0.2 0.959 113.0 44.8 -72.3 -46.2 8.4 -28.7 3.7 181 181 A S H >< S+ 0 0 0 -4,-2.1 3,-1.5 -5,-0.3 -1,-0.2 0.823 103.6 69.0 -62.8 -27.0 9.2 -32.3 4.7 182 182 A G T 3< S+ 0 0 0 -4,-2.0 -1,-0.3 1,-0.3 3,-0.3 0.475 85.1 71.3 -66.4 -4.6 7.3 -33.2 1.5 183 183 A R T <> + 0 0 18 -3,-2.2 4,-2.8 1,-0.2 -1,-0.3 0.232 63.0 111.5 -90.2 14.2 10.2 -31.7 -0.4 184 184 A I H <> S+ 0 0 0 -3,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.921 80.9 40.9 -61.2 -45.9 12.5 -34.6 0.5 185 185 A V H > S+ 0 0 0 -3,-0.3 4,-2.3 1,-0.2 3,-0.4 0.949 114.4 55.2 -63.1 -44.3 12.7 -36.0 -3.1 186 186 A E H > S+ 0 0 15 -4,-0.2 4,-3.2 1,-0.2 5,-0.3 0.871 100.2 59.0 -55.3 -40.0 13.0 -32.4 -4.4 187 187 A T H X S+ 0 0 5 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.915 108.8 45.4 -56.8 -43.5 16.0 -31.7 -2.1 188 188 A A H X S+ 0 0 0 -4,-1.3 4,-2.6 -3,-0.4 -2,-0.2 0.940 115.0 45.6 -63.1 -49.8 17.9 -34.5 -3.8 189 189 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.913 113.9 50.4 -61.0 -41.4 16.9 -33.4 -7.3 190 190 A F H X S+ 0 0 26 -4,-3.2 4,-2.7 2,-0.2 -1,-0.2 0.931 112.4 45.4 -63.0 -49.4 17.7 -29.8 -6.6 191 191 A K H X S+ 0 0 11 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.906 111.1 53.9 -62.4 -43.8 21.2 -30.6 -5.2 192 192 A M H <>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 4,-0.3 0.936 111.8 44.8 -55.8 -46.5 21.9 -33.0 -8.1 193 193 A N H ><5S+ 0 0 36 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.928 109.4 56.6 -63.5 -41.9 21.0 -30.1 -10.5 194 194 A E H 3<5S+ 0 0 62 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.831 106.0 49.7 -60.3 -35.7 23.1 -27.6 -8.5 195 195 A I T 3<5S- 0 0 43 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.406 128.2 -97.9 -89.6 6.9 26.2 -29.8 -8.8 196 196 A G T < 5S+ 0 0 47 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.431 73.6 142.7 104.0 1.1 25.7 -30.1 -12.6 197 197 A Y < - 0 0 6 -5,-2.4 -1,-0.3 -6,-0.2 -2,-0.1 -0.612 58.5-112.2 -78.6 132.9 24.0 -33.4 -13.0 198 198 A D > - 0 0 41 -2,-0.3 3,-2.1 1,-0.2 4,-0.2 -0.506 19.2-153.8 -68.0 114.6 21.3 -33.3 -15.8 199 199 A P G > S+ 0 0 1 0, 0.0 3,-1.6 0, 0.0 -113,-0.2 0.737 91.0 72.5 -64.7 -16.8 17.9 -33.7 -14.1 200 200 A K G 3 S+ 0 0 58 1,-0.3 -2,-0.1 -75,-0.3 -74,-0.0 0.658 89.1 62.4 -69.0 -15.8 16.6 -35.1 -17.4 201 201 A L G < S+ 0 0 45 -3,-2.1 39,-2.7 38,-0.1 2,-0.5 0.556 81.2 99.7 -81.2 -8.5 18.6 -38.2 -16.5 202 202 A I E < - H 0 239B 12 -3,-1.6 -116,-0.4 37,-0.2 37,-0.3 -0.692 47.9-178.2 -87.6 124.0 16.5 -38.9 -13.4 203 203 A V E - 0 0 32 35,-2.6 2,-0.3 -2,-0.5 36,-0.2 0.881 60.5 -24.7 -88.4 -43.3 13.8 -41.5 -13.9 204 204 A S E - H 0 238B 2 34,-1.3 34,-2.5 -120,-0.1 -1,-0.3 -0.977 51.6-153.9-164.7 164.4 12.1 -41.6 -10.5 205 205 A G E -GH 82 237B 0 -123,-2.2 -123,-2.5 -2,-0.3 2,-0.3 -0.987 2.8-169.3-151.5 148.3 12.5 -40.8 -6.8 206 206 A A E -GH 81 236B 0 30,-2.5 30,-2.9 -2,-0.3 2,-0.3 -0.993 17.7-178.2-136.6 137.0 11.1 -42.0 -3.5 207 207 A G E -GH 80 235B 0 -127,-2.7 -127,-2.4 -2,-0.3 2,-0.4 -0.966 21.1-160.5-143.2 157.7 11.6 -40.4 -0.2 208 208 A R E +GH 79 234B 16 26,-2.4 26,-2.5 -2,-0.3 -129,-0.2 -0.997 20.0 162.6-133.1 140.3 10.9 -40.5 3.6 209 209 A C E -G 78 0B 0 -131,-2.0 -131,-2.9 -2,-0.4 24,-0.2 -0.945 36.6-114.8-159.5 132.5 11.3 -37.6 6.0 210 210 A P E -G 77 0B 0 0, 0.0 2,-0.5 0, 0.0 -133,-0.3 -0.372 33.2-119.3 -65.4 150.7 10.0 -36.8 9.5 211 211 A I - 0 0 6 -135,-3.1 -135,-0.3 17,-0.1 -33,-0.1 -0.788 32.4-119.4 -91.7 122.5 7.5 -33.9 9.9 212 212 A S - 0 0 3 -2,-0.5 13,-0.1 -35,-0.4 -35,-0.1 -0.345 21.4-114.0 -62.8 139.5 8.9 -31.2 12.2 213 213 A P - 0 0 2 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.300 45.4 -95.5 -53.5 158.5 7.0 -30.3 15.3 214 214 A I - 0 0 21 712,-0.1 2,-0.1 -42,-0.1 -42,-0.1 -0.735 43.3-154.1 -88.2 118.3 5.7 -26.7 15.1 215 215 A L - 0 0 9 -2,-0.6 710,-0.2 2,-0.2 6,-0.1 -0.322 33.1 -87.4 -86.4 179.4 8.2 -24.2 16.7 216 216 A E S S+ 0 0 76 708,-0.3 2,-0.3 -2,-0.1 709,-0.1 0.561 99.4 3.1 -75.0 -16.6 7.3 -20.8 18.2 217 217 A N S > S- 0 0 72 708,-0.1 4,-2.3 1,-0.1 -2,-0.2 -0.968 78.9 -95.9-160.5 169.3 7.5 -18.7 15.1 218 218 A D H > S+ 0 0 38 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 0.807 117.0 56.7 -64.0 -33.1 8.2 -18.8 11.4 219 219 A L H > S+ 0 0 76 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.952 112.0 41.2 -68.5 -45.3 11.9 -18.0 11.7 220 220 A K H >> S+ 0 0 55 1,-0.2 4,-1.8 2,-0.2 3,-0.7 0.893 111.5 57.1 -66.5 -37.1 12.6 -20.9 14.1 221 221 A A H 3X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.2 5,-0.4 0.836 95.6 64.8 -63.1 -30.5 10.4 -23.2 12.0 222 222 A M H 3X S+ 0 0 7 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.891 106.4 45.6 -57.3 -38.1 12.5 -22.5 8.9 223 223 A G H X S+ 0 0 0 -4,-2.5 4,-0.8 1,-0.2 3,-0.6 0.963 115.1 43.2 -62.7 -46.8 11.5 -28.0 9.0 226 226 A N H >X S+ 0 0 11 -4,-1.4 4,-2.3 -5,-0.4 3,-0.5 0.864 107.2 59.7 -66.4 -37.2 14.7 -27.9 6.8 227 227 A D H 3X>S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 5,-0.6 0.790 92.9 68.9 -61.9 -25.7 16.7 -29.9 9.3 228 228 A S H - 0 0 70 -2,-0.1 3,-2.3 1,-0.1 4,-0.2 -0.987 24.7-132.0-137.9 131.9 28.1 -39.9 -12.4 244 244 A E G > S+ 0 0 134 -2,-0.4 3,-1.9 1,-0.3 4,-0.2 0.746 101.7 75.7 -54.5 -25.0 30.7 -40.1 -9.7 245 245 A I G > S+ 0 0 51 1,-0.3 3,-2.4 2,-0.2 -1,-0.3 0.719 74.5 81.1 -62.9 -20.6 29.9 -36.5 -8.7 246 246 A L G X S+ 0 0 0 -3,-2.3 3,-1.9 1,-0.3 -1,-0.3 0.702 71.1 77.5 -63.5 -15.2 26.7 -37.9 -7.1 247 247 A K G < S+ 0 0 84 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.729 88.7 61.6 -59.6 -20.1 28.7 -38.8 -4.1 248 248 A N G < S+ 0 0 70 -3,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.326 78.3 90.3 -90.9 9.0 28.5 -35.1 -3.3 249 249 A V < + 0 0 0 -3,-1.9 -1,-0.2 32,-0.0 -2,-0.1 0.946 65.1 85.7 -69.3 -49.1 24.7 -35.0 -3.0 250 250 A P S > S- 0 0 1 0, 0.0 3,-2.0 0, 0.0 33,-0.2 -0.181 83.1-121.4 -63.4 154.7 24.3 -35.7 0.7 251 251 A S G > S+ 0 0 4 31,-2.4 3,-2.0 1,-0.3 6,-0.2 0.770 105.9 71.9 -62.9 -25.3 24.4 -32.9 3.2 252 252 A C G 3 S+ 0 0 44 31,-0.4 -1,-0.3 1,-0.3 31,-0.1 0.632 91.5 59.1 -70.9 -8.3 27.4 -34.5 5.1 253 253 A T G < S+ 0 0 64 -3,-2.0 2,-0.3 -5,-0.1 -1,-0.3 0.464 89.0 100.6 -91.9 -3.8 29.6 -33.6 2.2 254 254 A S S X S- 0 0 28 -3,-2.0 3,-2.2 -4,-0.2 25,-0.0 -0.625 80.2-125.4 -86.4 143.0 28.8 -29.8 2.6 255 255 A R T 3 S+ 0 0 176 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.720 111.2 51.6 -47.3 -29.4 31.0 -27.3 4.3 256 256 A D T > S+ 0 0 17 -5,-0.1 3,-2.3 2,-0.1 -1,-0.3 0.351 74.2 135.1-101.1 10.3 28.1 -26.4 6.6 257 257 A Y T < + 0 0 50 -3,-2.2 -5,-0.1 1,-0.3 -26,-0.0 -0.318 69.5 32.8 -61.5 135.0 27.2 -29.9 7.8 258 258 A G T 3 S+ 0 0 45 1,-0.4 -1,-0.3 -2,-0.0 -2,-0.1 0.061 92.1 110.3 104.2 -23.2 26.6 -29.9 11.5 259 259 A K S < S- 0 0 102 -3,-2.3 -1,-0.4 1,-0.1 2,-0.1 -0.691 76.7-116.0 -80.1 135.0 25.2 -26.3 11.5 260 260 A P >> - 0 0 52 0, 0.0 3,-1.2 0, 0.0 4,-1.2 -0.456 24.3-119.6 -62.5 144.9 21.5 -26.1 12.3 261 261 A F H 3> S+ 0 0 0 -38,-0.4 4,-2.7 1,-0.3 5,-0.2 0.857 113.3 66.8 -55.6 -33.1 19.6 -24.8 9.2 262 262 A Y H 3> S+ 0 0 62 1,-0.2 4,-2.9 2,-0.2 -1,-0.3 0.890 98.9 51.2 -54.3 -40.8 18.5 -21.9 11.5 263 263 A E H <> S+ 0 0 88 -3,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.884 109.9 49.1 -66.0 -35.4 22.1 -20.7 11.7 264 264 A I H X S+ 0 0 11 -4,-1.2 4,-1.0 -3,-0.2 -2,-0.2 0.925 114.0 46.0 -65.4 -44.2 22.4 -20.8 7.9 265 265 A F H <>S+ 0 0 7 -4,-2.7 5,-2.3 1,-0.2 6,-0.5 0.909 111.8 51.0 -66.5 -46.2 19.2 -18.9 7.5 266 266 A K H ><5S+ 0 0 100 -4,-2.9 3,-1.8 1,-0.2 -1,-0.2 0.905 106.9 53.9 -56.7 -42.9 20.3 -16.3 10.2 267 267 A A H 3<5S+ 0 0 92 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.774 104.1 56.9 -67.5 -23.9 23.6 -15.8 8.4 268 268 A A T ><5S- 0 0 15 -4,-1.0 3,-1.6 -3,-0.4 -1,-0.3 0.051 125.5-105.8 -89.7 22.9 21.6 -15.0 5.3 269 269 A N T < 5 - 0 0 129 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.2 0.814 67.0 -65.8 53.9 37.6 19.8 -12.3 7.2 270 270 A Y T 3 S+ 0 0 37 -2,-0.7 3,-1.2 1,-0.3 -1,-0.2 0.848 90.7 55.9 -49.7 -41.0 15.5 -17.5 2.2 273 273 A Y G 3 S+ 0 0 58 1,-0.3 -1,-0.3 -3,-0.1 -175,-0.0 0.498 100.7 59.5 -77.6 -4.7 16.5 -16.3 -1.3 274 274 A K G < S+ 0 0 145 -3,-2.2 -1,-0.3 -6,-0.2 2,-0.3 0.479 78.9 108.1 -98.0 -3.9 20.0 -15.2 -0.1 275 275 A I S < S- 0 0 10 -3,-1.2 5,-0.1 -4,-0.5 -10,-0.1 -0.534 86.0-104.8 -71.6 135.0 20.9 -18.7 1.1 276 276 A D > - 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g 0 772F 0 -30,-2.0 -28,-1.2 -2,-0.4 2,-0.1 -0.971 36.3-120.5-153.7 146.2 -17.7 -57.4 15.8 802 170 C P - 0 0 10 0, 0.0 6,-0.4 0, 0.0 -28,-0.1 -0.373 32.5-107.9 -79.5 164.8 -16.5 -59.4 18.8 803 171 C T S S+ 0 0 14 1,-0.2 2,-1.3 5,-0.1 9,-0.1 0.911 113.4 60.1 -57.8 -44.7 -13.2 -58.7 20.6 804 172 C A S S+ 0 0 25 4,-0.1 2,-0.3 42,-0.1 -1,-0.2 -0.703 89.1 86.8 -88.6 85.8 -11.6 -61.9 19.1 805 173 C S S > S- 0 0 10 -2,-1.3 4,-2.8 1,-0.1 5,-0.2 -0.938 88.8-103.0-167.5 163.0 -11.9 -61.1 15.4 806 174 C I H > S+ 0 0 10 -131,-0.6 4,-2.8 -2,-0.3 5,-0.2 0.938 124.4 50.0 -66.0 -38.3 -9.8 -59.3 12.8 807 175 C V H > S+ 0 0 0 -137,-0.4 4,-2.9 -132,-0.4 5,-0.3 0.930 110.3 52.0 -64.3 -39.2 -12.2 -56.3 12.9 808 176 C G H > S+ 0 0 0 -6,-0.4 4,-2.2 1,-0.2 5,-0.3 0.943 111.4 45.9 -57.9 -49.1 -11.9 -56.4 16.8 809 177 C S H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 35,-0.4 0.924 116.7 44.2 -63.4 -44.6 -8.1 -56.4 16.6 810 178 C V H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.941 114.4 47.5 -65.1 -47.3 -7.9 -53.6 14.1 811 179 C Q H < S+ 0 0 1 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.859 112.5 49.3 -68.5 -31.3 -10.5 -51.4 15.6 812 180 C I H >< S+ 0 0 6 -4,-2.2 3,-2.1 -5,-0.3 -1,-0.2 0.948 113.6 44.2 -72.1 -48.2 -9.0 -51.6 19.1 813 181 C S H >< S+ 0 0 0 -4,-2.1 3,-1.6 1,-0.3 -2,-0.2 0.851 104.5 67.8 -61.8 -26.6 -5.5 -50.9 18.0 814 182 C G T 3< S+ 0 0 0 -4,-2.1 3,-0.3 1,-0.3 -1,-0.3 0.507 86.3 70.0 -69.1 -3.1 -7.2 -48.1 15.9 815 183 C R T <> + 0 0 16 -3,-2.1 4,-2.7 1,-0.2 -1,-0.3 0.244 64.0 112.1 -91.4 11.6 -8.0 -46.5 19.3 816 184 C I H <> S+ 0 0 0 -3,-1.6 4,-1.2 1,-0.2 -1,-0.2 0.900 81.0 40.7 -58.9 -43.7 -4.3 -45.6 19.9 817 185 C V H > S+ 0 0 0 -3,-0.3 4,-2.4 1,-0.2 3,-0.5 0.953 114.7 55.0 -66.6 -43.6 -4.9 -41.8 19.5 818 186 C E H > S+ 0 0 17 -4,-0.3 4,-3.2 1,-0.2 5,-0.3 0.865 101.0 56.6 -55.2 -41.2 -8.1 -42.1 21.5 819 187 C T H X S+ 0 0 17 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.897 109.3 47.2 -66.1 -32.9 -6.5 -43.8 24.5 820 188 C A H X S+ 0 0 0 -4,-1.2 4,-2.7 -3,-0.5 -2,-0.2 0.955 114.1 46.6 -63.4 -50.3 -4.1 -40.8 24.7 821 189 C I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.921 114.9 47.1 -59.8 -45.4 -6.9 -38.2 24.4 822 190 C F H X S+ 0 0 69 -4,-3.2 4,-2.6 2,-0.2 -1,-0.2 0.929 112.8 47.5 -63.5 -45.9 -9.0 -40.1 27.0 823 191 C K H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.3 6,-0.2 0.919 110.2 54.3 -62.2 -41.5 -6.2 -40.5 29.5 824 192 C M H <>S+ 0 0 1 -4,-2.7 5,-2.6 1,-0.2 3,-0.3 0.948 111.0 44.5 -58.2 -47.4 -5.3 -36.9 29.1 825 193 C N H ><5S+ 0 0 42 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.911 109.5 56.5 -62.7 -40.5 -8.9 -35.8 29.9 826 194 C E H 3<5S+ 0 0 60 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.807 105.8 50.4 -64.8 -27.6 -9.0 -38.3 32.9 827 195 C I T 3<5S- 0 0 40 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.343 129.7 -94.9 -93.2 6.4 -5.9 -36.7 34.5 828 196 C G T < 5S+ 0 0 54 -3,-1.6 2,-0.5 1,-0.3 -3,-0.2 0.524 77.3 140.0 100.6 10.1 -7.5 -33.2 34.1 829 197 C Y < - 0 0 9 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.1 -0.769 58.2-117.2 -89.7 126.4 -6.1 -31.9 30.9 830 198 C D > - 0 0 40 -2,-0.5 3,-2.2 1,-0.2 4,-0.2 -0.421 15.1-151.3 -65.3 117.2 -8.7 -30.0 28.8 831 199 C P G > S+ 0 0 1 0, 0.0 3,-1.6 0, 0.0 -113,-0.2 0.730 92.7 73.1 -66.2 -17.3 -9.2 -32.0 25.5 832 200 C K G 3 S+ 0 0 64 1,-0.3 -2,-0.1 -75,-0.2 -74,-0.0 0.666 89.6 61.1 -66.4 -15.9 -10.1 -28.6 23.9 833 201 C L G < S+ 0 0 51 -3,-2.2 39,-2.9 38,-0.1 2,-0.6 0.537 82.6 99.3 -82.0 -9.6 -6.4 -27.8 24.1 834 202 C I E < - O 0 871C 12 -3,-1.6 -116,-0.4 37,-0.2 37,-0.2 -0.701 47.3-179.5 -88.5 122.0 -5.5 -30.7 21.9 835 203 C V E - 0 0 37 35,-2.4 2,-0.3 -2,-0.6 36,-0.2 0.905 59.8 -27.8 -84.9 -46.6 -4.9 -29.7 18.3 836 204 C S E - O 0 870C 2 34,-1.4 34,-2.4 -120,-0.1 2,-0.3 -0.980 50.6-152.4-162.7 165.9 -4.1 -33.0 16.6 837 205 C G E -NO 714 869C 0 -123,-2.2 -123,-2.5 -2,-0.3 2,-0.4 -0.990 2.7-167.7-151.8 152.7 -2.7 -36.5 17.1 838 206 C A E -NO 713 868C 0 30,-2.5 30,-3.1 -2,-0.3 2,-0.3 -0.998 18.8-178.0-140.4 131.5 -1.0 -39.2 15.1 839 207 C G E -NO 712 867C 0 -127,-2.7 -127,-2.5 -2,-0.4 2,-0.4 -0.928 20.4-161.4-139.2 159.1 -0.5 -42.8 16.3 840 208 C R E +NO 711 866C 16 26,-2.4 26,-2.5 -2,-0.3 -129,-0.2 -0.997 19.6 163.7-135.5 139.2 0.9 -46.2 15.5 841 209 C C E -N 710 0C 0 -131,-2.1 -131,-3.0 -2,-0.4 24,-0.2 -0.944 36.0-114.9-158.5 131.8 -0.0 -49.5 17.1 842 210 C P E -N 709 0C 0 0, 0.0 2,-0.5 0, 0.0 -133,-0.3 -0.372 32.2-120.1 -65.7 149.9 0.5 -53.1 16.2 843 211 C I - 0 0 5 -135,-3.2 -135,-0.3 -30,-0.1 -33,-0.1 -0.783 32.3-119.7 -91.1 123.3 -2.7 -55.1 15.5 844 212 C S - 0 0 2 -2,-0.5 -35,-0.1 -35,-0.4 13,-0.1 -0.325 21.0-113.6 -64.0 140.4 -3.0 -58.1 17.9 845 213 C P - 0 0 1 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.272 45.4 -96.1 -53.0 157.4 -3.1 -61.6 16.6 846 214 C I - 0 0 19 -236,-0.1 -237,-0.1 -42,-0.1 -42,-0.1 -0.759 44.9-152.8 -85.7 119.1 -6.5 -63.2 17.2 847 215 C L - 0 0 6 -2,-0.6 -238,-0.2 2,-0.2 -237,-0.1 -0.242 30.7 -90.6 -88.3-177.6 -6.4 -65.1 20.5 848 216 C E S S+ 0 0 71 -240,-0.3 2,-0.3 -239,-0.1 -239,-0.1 0.547 98.8 7.4 -84.0 -7.7 -8.6 -68.1 21.4 849 217 C N S > S- 0 0 71 -240,-0.1 4,-2.3 1,-0.0 -2,-0.2 -0.971 79.8 -97.6-159.6 169.5 -11.5 -66.3 23.0 850 218 C D H > S+ 0 0 49 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.803 117.9 56.7 -63.6 -31.9 -12.9 -62.9 23.7 851 219 C L H > S+ 0 0 56 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.948 111.5 41.3 -67.6 -47.5 -11.4 -62.7 27.2 852 220 C K H > S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.915 114.3 53.7 -61.8 -42.8 -7.8 -63.3 26.1 853 221 C A H X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.2 5,-0.4 0.863 101.1 59.0 -64.3 -35.9 -8.4 -61.0 23.1 854 222 C M H X S+ 0 0 40 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.929 110.3 45.4 -56.2 -41.7 -9.6 -58.2 25.5 855 223 C G H X S+ 0 0 1 -4,-1.4 4,-2.7 2,-0.2 38,-0.4 0.952 115.4 42.4 -68.0 -49.4 -6.2 -58.5 27.1 856 224 C S H X S+ 0 0 1 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.873 113.7 51.1 -72.3 -36.3 -4.0 -58.6 23.9 857 225 C T H X S+ 0 0 0 -4,-2.5 4,-0.9 -5,-0.2 3,-0.3 0.953 114.6 44.5 -65.9 -42.0 -5.8 -55.9 22.1 858 226 C N H >X S+ 0 0 33 -4,-1.8 4,-2.4 -5,-0.4 3,-0.7 0.919 109.7 55.7 -65.9 -38.9 -5.5 -53.6 25.1 859 227 C D H 3X>S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.6 0.787 94.1 69.1 -65.1 -29.3 -1.9 -54.5 25.6 860 228 C S H 3X5S+ 0 0 0 -4,-1.5 4,-1.3 -3,-0.3 -1,-0.2 0.940 111.4 32.2 -51.0 -47.5 -1.1 -53.5 22.0 861 229 C M H - 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0 0 13 0, 0.0 4,-1.6 0, 0.0 3,-1.2 -0.286 46.1-115.4 -56.3 144.8 -0.3 -58.5 30.3 893 261 C F H 3> S+ 0 0 0 -38,-0.4 4,-3.3 1,-0.3 5,-0.2 0.835 113.0 61.8 -55.5 -38.2 -3.8 -57.1 30.9 894 262 C Y H 3> S+ 0 0 53 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.893 105.4 49.1 -55.9 -38.4 -5.4 -60.6 31.0 895 263 C E H <> S+ 0 0 72 -3,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.900 112.6 46.8 -66.2 -43.3 -3.2 -61.4 34.1 896 264 C I H X S+ 0 0 11 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.928 114.0 48.7 -62.2 -44.3 -4.2 -58.1 35.7 897 265 C F H <>S+ 0 0 10 -4,-3.3 5,-2.8 1,-0.2 6,-0.4 0.923 111.7 46.7 -68.4 -42.5 -7.9 -58.7 35.0 898 266 C K H ><5S+ 0 0 87 -4,-2.5 3,-1.7 1,-0.2 -1,-0.2 0.891 110.0 54.6 -67.7 -35.3 -8.0 -62.3 36.3 899 267 C A H 3<5S+ 0 0 82 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.848 106.4 52.1 -66.0 -31.5 -6.2 -61.2 39.4 900 268 C A T ><5S- 0 0 13 -4,-1.6 3,-1.0 -3,-0.2 -1,-0.3 0.180 121.8-110.8 -83.7 11.0 -8.9 -58.6 40.0 901 269 C N T < 5 - 0 0 105 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.849 66.6 -64.2 56.3 39.5 -11.5 -61.3 39.6 902 270 C Y T 3 S+ 0 0 107 -2,-0.6 3,-1.8 1,-0.3 -1,-0.1 0.813 88.1 67.7 -59.9 -29.1 -13.0 -53.4 36.0 905 273 C Y G 3 S+ 0 0 198 1,-0.3 -1,-0.3 -5,-0.1 -2,-0.0 0.673 95.2 57.4 -70.0 -12.5 -13.7 -51.4 39.1 906 274 C K G < S+ 0 0 93 -3,-1.7 2,-0.4 -6,-0.2 -1,-0.3 0.339 91.1 86.1 -96.7 3.9 -10.6 -53.0 40.8 907 275 C I S < S- 0 0 6 -3,-1.8 -10,-0.0 -4,-0.1 3,-0.0 -0.854 91.6-102.7-107.2 140.7 -8.1 -51.9 38.1 908 276 C D > - 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