==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 11-OCT-08 3EUW . COMPND 2 MOLECULE: MYO-INOSITOL DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM; . AUTHOR D.KUMARAN,A.MAHMOOD,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RE . 1332 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50942.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 992 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 127 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 197 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 1 0.1 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 . 81 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 132 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 383 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 2.0 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 12 8 1 0 2 3 2 12 4 0 0 1 0 3 0 0 4 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 12 4 1 2 4 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 . 10 7 0 4 4 0 4 8 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 . 0 0 0 0 1 3 0 1 3 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 L 0 0 186 0, 0.0 2,-0.2 0, 0.0 25,-0.0 0.000 360.0 360.0 360.0 109.4 14.2 48.4 -9.2 2 2 A T - 0 0 52 1,-0.1 2,-0.3 25,-0.1 25,-0.2 -0.440 360.0-130.0 -66.5 128.2 13.7 49.0 -5.5 3 3 A L E -a 27 0A 11 23,-2.8 25,-1.9 -2,-0.2 2,-0.5 -0.625 14.1-129.8 -84.5 137.4 10.1 48.5 -4.4 4 4 A R E -a 28 0A 88 -2,-0.3 61,-2.0 59,-0.3 62,-1.6 -0.750 25.2-165.5 -90.4 124.5 8.3 51.1 -2.3 5 5 A I E -ab 29 66A 0 23,-3.2 25,-2.1 -2,-0.5 26,-1.0 -0.901 12.8-156.8-117.3 136.4 6.5 50.0 0.8 6 6 A A E -ab 31 67A 0 60,-2.7 62,-2.2 -2,-0.4 2,-0.4 -0.912 16.8-153.7-106.6 132.6 3.9 51.7 3.0 7 7 A L E -ab 32 68A 1 24,-3.0 26,-2.7 -2,-0.5 2,-0.5 -0.914 5.7-157.9-113.4 132.3 3.7 50.4 6.7 8 8 A F E +ab 33 69A 9 60,-2.7 62,-2.5 -2,-0.4 26,-0.2 -0.926 64.2 31.6-108.5 121.7 0.7 50.6 8.9 9 9 A G - 0 0 3 24,-3.1 25,-0.1 -2,-0.5 62,-0.1 0.338 51.8-152.3 105.1 124.0 1.3 50.4 12.7 10 10 A A + 0 0 9 4,-0.1 24,-0.1 22,-0.1 -1,-0.1 0.256 63.5 112.5-108.2 10.5 4.3 51.7 14.6 11 11 A G S > S- 0 0 38 59,-0.3 4,-2.0 3,-0.1 5,-0.1 0.245 91.0 -70.9 -66.1-163.3 3.8 49.1 17.3 12 12 A R H > S+ 0 0 142 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.923 135.8 44.8 -61.3 -49.1 6.2 46.2 18.1 13 13 A I H > S+ 0 0 28 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.901 110.9 57.2 -63.5 -36.6 5.3 44.2 15.0 14 14 A G H > S+ 0 0 0 56,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.894 102.8 54.0 -59.8 -39.4 5.6 47.4 13.1 15 15 A H H X S+ 0 0 65 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.880 108.0 50.0 -63.1 -37.8 9.2 47.8 14.4 16 16 A V H X S+ 0 0 25 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.949 113.1 44.1 -66.4 -50.8 10.1 44.4 13.1 17 17 A H H X S+ 0 0 0 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.940 113.5 51.4 -60.2 -46.6 8.7 44.9 9.6 18 18 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.945 112.5 45.7 -55.5 -50.7 10.3 48.4 9.3 19 19 A A H X S+ 0 0 51 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.852 114.6 48.8 -62.6 -34.7 13.7 47.1 10.4 20 20 A N H X S+ 0 0 9 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.880 108.7 52.2 -73.1 -37.2 13.3 44.1 8.0 21 21 A I H < S+ 0 0 0 -4,-3.2 6,-0.3 2,-0.2 -2,-0.2 0.931 109.4 50.0 -63.5 -44.4 12.3 46.3 5.1 22 22 A A H < S+ 0 0 60 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.958 113.6 46.2 -56.7 -51.3 15.3 48.5 5.6 23 23 A A H < S+ 0 0 70 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.828 94.2 87.6 -60.9 -37.2 17.5 45.4 5.7 24 24 A N >< - 0 0 25 -4,-2.4 3,-1.0 1,-0.1 -4,-0.0 -0.526 69.6-151.3 -69.1 126.1 15.9 43.9 2.6 25 25 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.671 92.1 55.3 -72.4 -19.3 17.7 45.2 -0.5 26 26 A D T 3 S+ 0 0 76 -24,-0.1 -23,-2.8 -5,-0.0 2,-0.3 0.435 105.5 65.6 -92.1 -0.3 14.7 44.9 -2.9 27 27 A L E < -a 3 0A 9 -3,-1.0 2,-0.3 -6,-0.3 -23,-0.2 -0.870 54.2-171.1-126.8 159.1 12.6 47.1 -0.6 28 28 A E E -a 4 0A 81 -25,-1.9 -23,-3.2 -2,-0.3 2,-0.7 -0.977 20.8-137.3-148.2 127.2 12.4 50.6 0.7 29 29 A L E +a 5 0A 8 -2,-0.3 -23,-0.2 18,-0.2 3,-0.1 -0.787 29.0 166.9 -87.9 116.3 10.1 51.9 3.4 30 30 A V E + 0 0 12 -25,-2.1 20,-1.4 -2,-0.7 2,-0.3 0.585 60.1 20.1-107.8 -12.1 8.7 55.3 2.3 31 31 A V E -ac 6 50A 2 -26,-1.0 -24,-3.0 18,-0.2 2,-0.4 -0.935 52.3-164.0-162.3 137.0 5.9 55.9 4.8 32 32 A I E -ac 7 51A 0 18,-1.8 20,-2.4 -2,-0.3 2,-0.4 -0.982 13.4-163.4-121.6 128.8 4.7 54.8 8.2 33 33 A A E +ac 8 52A 3 -26,-2.7 -24,-3.1 -2,-0.4 20,-0.2 -0.937 23.1 143.2-117.9 136.6 1.2 55.5 9.4 34 34 A D - 0 0 28 18,-1.6 6,-0.3 -2,-0.4 20,-0.1 -0.807 49.7-130.6-168.7 123.2 -0.1 55.4 13.0 35 35 A P S S+ 0 0 110 0, 0.0 2,-2.0 0, 0.0 3,-0.1 0.865 103.5 75.6 -45.5 -38.0 -2.7 57.5 14.8 36 36 A F S > S- 0 0 121 1,-0.2 4,-1.6 -3,-0.1 3,-0.4 -0.585 74.4-173.9 -76.7 86.6 -0.1 57.9 17.5 37 37 A I H > S+ 0 0 43 -2,-2.0 4,-3.1 1,-0.2 5,-0.3 0.867 73.9 55.4 -54.0 -47.3 2.0 60.3 15.4 38 38 A E H > S+ 0 0 92 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.898 107.8 51.9 -56.3 -40.1 5.0 60.6 17.7 39 39 A G H > S+ 0 0 14 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.916 112.4 45.0 -61.7 -43.3 5.4 56.9 17.6 40 40 A A H X S+ 0 0 0 -4,-1.6 4,-2.9 -6,-0.3 -2,-0.2 0.911 112.4 50.4 -67.1 -44.4 5.3 56.9 13.8 41 41 A Q H X S+ 0 0 93 -4,-3.1 4,-2.4 1,-0.2 5,-0.2 0.910 108.7 53.9 -60.7 -41.7 7.7 59.8 13.5 42 42 A R H X S+ 0 0 148 -4,-2.5 4,-0.8 -5,-0.3 -1,-0.2 0.919 114.7 38.9 -58.5 -48.4 10.2 58.1 15.8 43 43 A L H < S+ 0 0 10 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.878 113.7 56.6 -71.9 -38.1 10.2 54.9 13.7 44 44 A A H ><>S+ 0 0 2 -4,-2.9 3,-1.9 1,-0.2 5,-1.3 0.930 105.6 47.9 -59.9 -50.5 10.2 56.8 10.4 45 45 A E H ><5S+ 0 0 142 -4,-2.4 3,-0.7 1,-0.3 -1,-0.2 0.778 105.0 61.7 -64.1 -24.8 13.3 58.9 11.0 46 46 A A T 3<5S+ 0 0 73 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.474 116.4 31.6 -79.3 -1.4 15.1 55.8 12.2 47 47 A N T < 5S- 0 0 42 -3,-1.9 -1,-0.2 2,-0.1 -18,-0.2 0.119 115.4-105.4-140.4 19.5 14.5 54.4 8.7 48 48 A G T < 5S+ 0 0 70 -3,-0.7 2,-0.3 1,-0.2 -3,-0.2 0.963 77.8 120.0 52.0 63.7 14.6 57.5 6.5 49 49 A A < - 0 0 23 -5,-1.3 -18,-0.2 -8,-0.2 -1,-0.2 -0.954 63.1 -97.2-149.8 166.5 10.8 57.8 5.8 50 50 A E E -c 31 0A 115 -20,-1.4 -18,-1.8 -2,-0.3 2,-0.4 -0.401 29.8-144.6 -82.6 163.4 7.8 60.0 6.3 51 51 A A E +c 32 0A 28 -20,-0.2 2,-0.3 -2,-0.1 -18,-0.2 -0.994 21.5 168.9-134.6 126.9 5.3 59.7 9.1 52 52 A V E -c 33 0A 13 -20,-2.4 -18,-1.6 -2,-0.4 -12,-0.0 -0.885 30.6-142.5-130.6 163.9 1.6 60.3 8.9 53 53 A A S S+ 0 0 38 -2,-0.3 -20,-0.1 -20,-0.2 -1,-0.1 0.659 78.6 56.9-102.1 -18.1 -1.3 59.6 11.2 54 54 A S S > S- 0 0 35 -20,-0.1 4,-0.8 1,-0.1 3,-0.5 -0.860 70.2-134.5-120.3 150.1 -4.0 58.7 8.7 55 55 A P H > S+ 0 0 30 0, 0.0 4,-2.8 0, 0.0 3,-0.4 0.825 106.9 66.4 -66.7 -27.9 -4.4 56.1 6.0 56 56 A D H 4 S+ 0 0 107 1,-0.3 4,-0.4 2,-0.2 0, 0.0 0.899 99.3 51.2 -56.8 -41.5 -5.8 58.8 3.8 57 57 A E H 4 S+ 0 0 99 -3,-0.5 -1,-0.3 2,-0.2 4,-0.2 0.776 110.7 49.5 -67.7 -27.6 -2.3 60.4 3.8 58 58 A V H >< S+ 0 0 0 -4,-0.8 3,-2.2 -3,-0.4 -2,-0.2 0.967 111.6 45.5 -73.0 -57.3 -0.8 57.1 2.8 59 59 A F T 3< S+ 0 0 24 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.444 95.2 78.4 -67.8 0.5 -3.2 56.5 -0.1 60 60 A A T 3 S+ 0 0 82 -4,-0.4 -1,-0.3 -5,-0.2 -2,-0.2 0.727 82.5 84.6 -78.7 -21.6 -2.6 60.1 -1.2 61 61 A R < - 0 0 56 -3,-2.2 -3,-0.0 -4,-0.2 3,-0.0 -0.304 64.6-158.8 -75.7 163.4 0.7 58.8 -2.6 62 62 A D S S+ 0 0 147 1,-0.1 -1,-0.1 -2,-0.0 -3,-0.1 0.162 79.7 69.9-128.5 16.3 0.9 57.3 -6.1 63 63 A D + 0 0 43 -58,-0.0 2,-0.6 0, 0.0 -59,-0.3 0.293 60.1 128.3-115.9 5.7 4.2 55.4 -5.6 64 64 A I + 0 0 16 1,-0.2 -59,-0.2 -6,-0.1 3,-0.1 -0.549 26.1 174.6 -72.1 112.9 3.2 52.6 -3.2 65 65 A D + 0 0 65 -61,-2.0 2,-0.3 -2,-0.6 -60,-0.2 0.731 68.0 1.1 -86.0 -27.0 4.2 49.2 -4.6 66 66 A G E -b 5 0A 0 -62,-1.6 -60,-2.7 22,-0.1 2,-0.4 -0.987 60.2-141.8-163.0 152.3 3.1 47.3 -1.5 67 67 A I E -bd 6 90A 0 22,-2.1 24,-3.1 -2,-0.3 2,-0.5 -0.927 3.2-158.6-122.4 143.4 1.6 47.6 2.0 68 68 A V E -bd 7 91A 0 -62,-2.2 -60,-2.7 -2,-0.4 2,-0.9 -0.983 12.1-152.6-118.5 122.9 2.3 45.9 5.3 69 69 A I E +bd 8 92A 0 22,-3.1 24,-2.0 -2,-0.5 -60,-0.1 -0.796 35.3 147.1-103.1 97.5 -0.5 45.9 7.8 70 70 A G + 0 0 10 -62,-2.5 -56,-0.4 -2,-0.9 -59,-0.3 0.047 42.5 106.2-113.5 23.1 0.8 45.7 11.4 71 71 A S S S- 0 0 20 1,-0.2 22,-0.1 -62,-0.1 5,-0.1 -0.379 82.8 -54.7 -93.3 175.9 -1.9 47.8 13.0 72 72 A P > - 0 0 89 0, 0.0 3,-2.5 0, 0.0 4,-0.3 -0.084 49.7-112.5 -54.1 149.3 -4.8 46.5 15.2 73 73 A T G > S+ 0 0 38 1,-0.3 3,-2.2 2,-0.2 4,-0.5 0.837 113.2 67.8 -49.1 -40.6 -7.1 43.8 14.0 74 74 A S G 3 S+ 0 0 103 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.628 101.5 49.2 -59.8 -12.5 -10.0 46.2 13.9 75 75 A T G <> S+ 0 0 40 -3,-2.5 4,-2.2 1,-0.1 -1,-0.3 0.413 86.7 89.8-106.1 0.5 -8.3 48.0 11.0 76 76 A H H <> S+ 0 0 3 -3,-2.2 4,-2.3 -4,-0.3 5,-0.2 0.905 85.8 45.9 -67.3 -45.5 -7.5 45.0 8.9 77 77 A V H > S+ 0 0 21 -4,-0.5 4,-2.1 19,-0.2 -1,-0.2 0.893 115.4 49.6 -65.2 -38.0 -10.6 44.7 6.7 78 78 A D H > S+ 0 0 73 -4,-0.2 4,-2.5 2,-0.2 5,-0.2 0.965 114.3 41.7 -64.7 -54.3 -10.5 48.5 6.0 79 79 A L H X S+ 0 0 5 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.877 113.7 52.9 -63.0 -39.5 -6.8 48.6 5.0 80 80 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.2 0.957 111.9 46.3 -60.0 -49.5 -7.0 45.4 3.0 81 81 A T H X S+ 0 0 14 -4,-2.1 4,-2.9 -5,-0.2 5,-0.2 0.939 112.9 47.6 -58.7 -53.4 -10.0 46.8 1.0 82 82 A R H X S+ 0 0 69 -4,-2.5 4,-0.8 2,-0.2 -1,-0.2 0.913 115.3 45.7 -56.1 -46.7 -8.5 50.2 0.3 83 83 A A H ><>S+ 0 0 0 -4,-2.3 5,-2.9 -5,-0.2 3,-1.1 0.957 115.2 45.6 -63.1 -51.6 -5.2 48.8 -0.8 84 84 A V H ><5S+ 0 0 10 -4,-2.7 3,-2.4 -5,-0.3 -2,-0.2 0.886 106.3 59.5 -60.3 -40.3 -6.7 46.1 -3.0 85 85 A E H 3<5S+ 0 0 127 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.732 108.6 46.5 -62.2 -20.8 -9.2 48.6 -4.5 86 86 A R T <<5S- 0 0 121 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.204 120.7-110.9-103.5 14.0 -6.1 50.5 -5.7 87 87 A G T < 5S+ 0 0 37 -3,-2.4 -3,-0.2 1,-0.2 -2,-0.1 0.721 71.6 143.3 65.6 20.7 -4.4 47.4 -7.0 88 88 A I < - 0 0 9 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.2 -0.840 50.9-125.9 -97.4 121.0 -1.8 47.6 -4.3 89 89 A P - 0 0 14 0, 0.0 -22,-2.1 0, 0.0 2,-0.4 -0.242 27.1-156.1 -59.9 150.8 -0.7 44.3 -2.8 90 90 A A E -de 67 117A 0 26,-2.7 28,-2.8 -24,-0.2 2,-0.7 -0.975 18.2-158.3-141.5 127.4 -1.0 43.9 0.9 91 91 A L E -de 68 118A 1 -24,-3.1 -22,-3.1 -2,-0.4 2,-0.4 -0.903 28.2-168.2 -98.9 114.0 0.7 41.7 3.5 92 92 A C E -de 69 119A 1 26,-2.7 28,-3.3 -2,-0.7 -22,-0.1 -0.910 21.5-125.5-115.5 132.2 -1.6 41.6 6.5 93 93 A E - 0 0 25 -24,-2.0 28,-0.1 -2,-0.4 -22,-0.1 -0.404 61.1 -56.5 -65.1 145.9 -1.0 40.3 10.0 94 94 A K S S+ 0 0 25 26,-0.4 -1,-0.1 -2,-0.1 2,-0.1 -0.278 103.1 42.6 -64.6 149.1 -3.6 37.7 11.0 95 95 A P - 0 0 4 0, 0.0 3,-0.2 0, 0.0 -19,-0.1 0.722 53.5-149.3-102.7 179.8 -6.6 37.7 11.1 96 96 A I S S- 0 0 2 1,-0.4 2,-0.3 212,-0.2 -19,-0.2 0.926 87.3 -38.6 -65.9 -40.2 -8.6 39.3 8.3 97 97 A D - 0 0 24 -21,-0.1 -1,-0.4 -20,-0.1 -23,-0.1 -0.930 50.5-118.1-172.9 162.3 -11.1 40.0 11.1 98 98 A L S S+ 0 0 46 -2,-0.3 2,-0.8 -3,-0.2 3,-0.1 0.716 98.2 75.7 -84.3 -21.2 -12.4 38.2 14.2 99 99 A D >> - 0 0 78 1,-0.2 4,-2.1 -3,-0.0 3,-0.6 -0.823 69.3-156.0 -96.3 108.6 -15.9 38.2 12.7 100 100 A I H 3> S+ 0 0 24 -2,-0.8 4,-2.0 1,-0.2 -1,-0.2 0.802 94.5 58.5 -52.5 -30.8 -16.3 35.6 10.0 101 101 A E H 3> S+ 0 0 112 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.923 105.8 46.3 -66.9 -44.2 -19.2 37.7 8.6 102 102 A X H <> S+ 0 0 91 -3,-0.6 4,-3.0 2,-0.2 -2,-0.2 0.882 110.6 54.7 -63.9 -37.0 -17.1 40.8 8.1 103 103 A V H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.909 110.5 46.2 -61.5 -41.3 -14.5 38.5 6.5 104 104 A R H X S+ 0 0 96 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.916 111.5 50.7 -67.2 -44.4 -17.2 37.3 4.1 105 105 A A H X S+ 0 0 47 -4,-2.8 4,-2.3 1,-0.2 3,-0.4 0.947 110.6 49.8 -58.6 -49.0 -18.4 40.9 3.4 106 106 A C H X S+ 0 0 5 -4,-3.0 4,-2.3 1,-0.2 5,-0.3 0.922 106.9 54.9 -55.9 -46.5 -14.8 42.0 2.7 107 107 A K H X S+ 0 0 78 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.838 109.5 48.2 -57.2 -35.3 -14.3 39.0 0.3 108 108 A E H < S+ 0 0 157 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.929 110.3 49.2 -72.1 -47.2 -17.4 40.0 -1.7 109 109 A K H < S+ 0 0 155 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.1 0.928 119.2 37.5 -59.9 -46.1 -16.5 43.7 -2.0 110 110 A I H >< S+ 0 0 17 -4,-2.3 3,-2.8 1,-0.2 -1,-0.2 0.753 83.1 167.5 -79.2 -25.2 -13.0 43.1 -3.2 111 111 A G G >< S+ 0 0 38 -4,-1.4 3,-1.7 -5,-0.3 -1,-0.2 -0.233 73.6 8.2 51.3-120.3 -13.8 40.0 -5.3 112 112 A D G > S+ 0 0 154 1,-0.3 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T 3 S- 0 0 142 -104,-2.9 1020,-0.3 1,-0.3 2,-0.3 0.249 127.2 -43.5-120.8 13.8 8.4 5.8 7.3 246 246 A G E < -L 243 0B 0 -3,-1.1 -3,-3.5 -105,-0.6 2,-0.4 -0.941 55.3 -88.7 154.0-176.6 9.6 8.0 10.1 247 247 A X E -LM 2421263B 7 1016,-2.5 1016,-2.6 -2,-0.3 2,-0.4 -0.985 17.0-162.4-134.9 147.2 9.2 11.2 12.1 248 248 A L E +LM 2411262B 0 -7,-2.6 -7,-3.3 -2,-0.4 2,-0.3 -0.998 19.5 174.9-126.6 125.0 10.4 14.7 11.7 249 249 A A E -LM 2401261B 18 1012,-2.3 1012,-2.4 -2,-0.4 2,-0.5 -0.970 21.9-141.8-134.5 150.7 10.3 17.0 14.7 250 250 A A E -LM 2391260B 3 -11,-2.5 -11,-1.0 -2,-0.3 1010,-0.2 -0.950 15.8-149.1-114.5 129.1 11.5 20.5 15.5 251 251 A D - 0 0 53 1008,-1.6 1008,-0.2 -2,-0.5 2,-0.1 -0.291 29.1 -92.2 -84.6 175.6 13.0 21.4 18.8 252 252 A N - 0 0 22 -2,-0.1 2,-0.4 -14,-0.0 -1,-0.2 -0.358 40.7-116.1 -82.6 168.1 12.8 24.8 20.5 253 253 A I - 0 0 48 20,-0.1 20,-2.3 -2,-0.1 -1,-0.0 -0.904 23.9-165.9-115.0 140.2 15.5 27.5 20.0 254 254 A R - 0 0 47 -2,-0.4 18,-0.1 18,-0.2 3,-0.0 -0.778 31.7-116.8-116.7 160.0 17.8 28.9 22.6 255 255 A P S S+ 0 0 69 0, 0.0 2,-0.3 0, 0.0 875,-0.1 0.747 97.1 16.3 -70.1 -23.0 20.0 32.1 22.5 256 256 A T S S- 0 0 19 2,-0.1 14,-0.3 873,-0.1 -2,-0.1 -0.934 70.4-123.8-143.1 164.8 23.2 30.0 22.9 257 257 A T + 0 0 18 -2,-0.3 996,-1.4 996,-0.2 2,-0.2 0.143 64.9 138.2 -95.5 18.7 24.3 26.4 22.6 258 258 A V E -P 1252 0C 0 994,-0.2 12,-0.5 992,-0.1 2,-0.4 -0.416 30.2-175.5 -72.0 136.9 25.6 26.5 26.2 259 259 A R E -PQ1251 269C 33 992,-2.4 992,-2.4 -2,-0.2 2,-0.4 -0.998 9.6-153.1-132.7 135.2 25.1 23.6 28.5 260 260 A K E -PQ1250 268C 29 8,-2.2 8,-2.4 -2,-0.4 2,-0.4 -0.869 7.3-170.1-110.8 142.2 26.0 23.4 32.2 261 261 A H E +P 1249 0C 20 988,-2.6 988,-2.8 -2,-0.4 5,-0.2 -0.989 24.4 132.8-133.1 122.9 26.8 20.2 34.2 262 262 A N S S- 0 0 17 3,-1.9 986,-0.1 -2,-0.4 881,-0.0 -0.750 70.9 -67.7-147.0-165.1 27.1 20.1 37.9 263 263 A A S S+ 0 0 69 984,-0.4 3,-0.1 -2,-0.2 985,-0.1 0.709 126.9 55.7 -67.9 -20.1 26.0 18.1 41.0 264 264 A E S S- 0 0 150 1,-0.3 2,-0.3 674,-0.1 -1,-0.2 0.898 124.1 -40.0 -80.2 -43.3 22.4 19.3 40.5 265 265 A S - 0 0 7 673,-0.2 -3,-1.9 -3,-0.0 -1,-0.3 -0.959 52.0-120.7-175.9 162.9 21.9 18.1 36.9 266 266 A T B S+Y 937 0D 1 671,-1.7 671,-2.9 -2,-0.3 -5,-0.2 -0.579 83.1 34.5-110.0 174.9 23.5 17.8 33.5 267 267 A E S S+ 0 0 48 1,-0.2 2,-0.5 669,-0.2 -6,-0.2 0.711 71.0 174.4 55.1 24.3 22.7 19.1 30.0 268 268 A Q E -Q 260 0C 14 -8,-2.4 -8,-2.2 -3,-0.3 2,-0.2 -0.482 7.0-177.0 -66.1 114.9 21.4 22.4 31.5 269 269 A A E -QR 259 934C 4 665,-2.9 665,-2.3 -2,-0.5 -10,-0.2 -0.635 32.8 -82.7-108.4 168.3 20.6 24.6 28.6 270 270 A D - 0 0 21 -12,-0.5 -1,-0.1 -14,-0.3 663,-0.1 -0.241 53.3 -94.4 -65.6 157.9 19.3 28.2 28.5 271 271 A P - 0 0 47 0, 0.0 -37,-0.2 0, 0.0 3,-0.1 -0.425 56.7-102.4 -65.4 154.8 15.6 28.8 28.9 272 272 A I - 0 0 12 -39,-1.6 -18,-0.2 1,-0.2 -36,-0.1 -0.286 54.9 -60.3 -77.9 168.7 14.2 29.0 25.3 273 273 A F - 0 0 46 -20,-2.3 -38,-3.2 -39,-0.2 -1,-0.2 -0.169 45.3-162.2 -49.2 136.4 13.4 32.3 23.6 274 274 A N + 0 0 69 -40,-0.3 2,-0.4 -3,-0.1 -1,-0.1 0.685 66.3 61.8 -95.6 -24.1 10.7 34.2 25.4 275 275 A F S >> S- 0 0 117 1,-0.1 4,-2.2 -40,-0.1 3,-0.9 -0.890 70.9-138.9-113.5 138.0 9.5 36.6 22.8 276 276 A F H 3> S+ 0 0 85 -2,-0.4 4,-2.9 1,-0.3 -1,-0.1 0.881 103.1 61.7 -57.8 -38.6 7.9 35.8 19.4 277 277 A L H 34 S+ 0 0 56 1,-0.2 -1,-0.3 2,-0.2 7,-0.1 0.830 110.1 41.4 -59.1 -32.2 9.9 38.5 17.7 278 278 A E H X4 S+ 0 0 80 -3,-0.9 3,-1.3 2,-0.2 4,-0.3 0.903 113.8 49.5 -81.3 -45.6 13.1 36.7 18.7 279 279 A R H 3< S+ 0 0 9 -4,-2.2 3,-0.3 1,-0.3 4,-0.2 0.905 120.5 38.0 -60.3 -40.3 12.0 33.1 18.0 280 280 A Y T 3X S+ 0 0 1 -4,-2.9 4,-2.5 -5,-0.2 -1,-0.3 0.048 76.1 120.6-103.4 28.5 10.7 34.1 14.6 281 281 A D H <> S+ 0 0 81 -3,-1.3 4,-1.5 1,-0.2 3,-0.2 0.963 83.4 41.0 -53.8 -57.5 13.4 36.6 13.5 282 282 A A H > S+ 0 0 48 -4,-0.3 4,-2.5 -3,-0.3 5,-0.2 0.893 112.2 57.5 -58.8 -41.1 14.3 34.6 10.4 283 283 A A H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.902 104.6 49.6 -58.3 -45.0 10.7 33.8 9.7 284 284 A Y H X S+ 0 0 10 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.874 112.3 48.4 -64.5 -35.7 9.6 37.4 9.5 285 285 A K H X S+ 0 0 86 -4,-1.5 4,-2.2 -5,-0.2 -1,-0.2 0.901 113.2 46.7 -69.4 -41.1 12.5 38.2 7.1 286 286 A A H X S+ 0 0 40 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.876 110.7 53.4 -68.7 -36.2 11.7 35.2 4.9 287 287 A E H X S+ 0 0 0 -4,-2.7 4,-1.5 -5,-0.2 -1,-0.2 0.916 108.9 49.0 -64.1 -42.3 8.0 36.2 4.9 288 288 A L H X S+ 0 0 1 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.922 109.1 52.2 -63.4 -44.1 8.9 39.7 3.8 289 289 A A H X S+ 0 0 45 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.891 108.5 50.9 -59.2 -41.6 11.1 38.4 0.9 290 290 A T H X S+ 0 0 57 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.830 108.1 53.6 -65.7 -31.4 8.3 36.2 -0.3 291 291 A F H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.929 108.0 50.0 -67.9 -45.6 6.0 39.2 -0.2 292 292 A A H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.915 110.3 49.1 -59.1 -45.6 8.5 41.1 -2.4 293 293 A Q H X S+ 0 0 96 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.847 109.2 53.3 -65.2 -32.8 8.7 38.3 -4.9 294 294 A G H X S+ 0 0 8 -4,-1.7 4,-2.5 2,-0.2 6,-0.5 0.847 107.4 51.3 -69.7 -33.2 4.9 38.1 -5.1 295 295 A I H < S+ 0 0 29 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.901 114.4 43.7 -69.0 -39.6 4.8 41.8 -5.8 296 296 A R H < S+ 0 0 97 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.864 119.4 42.0 -72.7 -38.1 7.3 41.3 -8.7 297 297 A D H < S- 0 0 84 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.856 81.2-155.2 -78.0 -39.3 5.7 38.1 -10.0 298 298 A G < + 0 0 62 -4,-2.5 -3,-0.1 -5,-0.2 -4,-0.1 0.685 59.7 121.1 68.3 15.5 2.0 39.2 -9.8 299 299 A Q S S- 0 0 171 1,-0.3 2,-0.1 -5,-0.3 -1,-0.1 0.309 78.3 -96.8 -92.3 6.1 1.4 35.4 -9.7 300 300 A G - 0 0 34 -6,-0.5 -1,-0.3 -184,-0.0 2,-0.3 -0.369 39.3 -85.2 105.3 174.6 -0.4 35.6 -6.3 301 301 A F - 0 0 25 -186,-0.3 -184,-0.1 -184,-0.3 4,-0.1 -0.831 25.5-125.5-125.3 162.7 0.6 35.0 -2.6 302 302 A S S S+ 0 0 68 1,-0.3 2,-0.2 -2,-0.3 -184,-0.1 -0.912 100.2 38.5-154.3 120.6 0.9 32.2 -0.1 303 303 A P S S- 0 0 0 0, 0.0 -184,-1.9 0, 0.0 -1,-0.3 0.480 100.5-167.5 -61.9 146.1 -0.5 32.1 2.5 304 304 A N B >> -F 118 0A 61 -186,-0.2 4,-1.2 -2,-0.2 3,-0.5 -0.429 37.4 -89.3-104.5-179.6 -3.4 33.7 0.6 305 305 A F H >> S+ 0 0 5 -188,-0.6 4,-1.6 -191,-0.5 3,-0.8 0.911 125.2 56.3 -53.3 -46.5 -6.7 35.4 1.6 306 306 A E H 3> S+ 0 0 68 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.836 100.3 56.9 -57.9 -37.4 -8.4 32.0 1.6 307 307 A D H <> S+ 0 0 12 -3,-0.5 4,-1.7 1,-0.2 -1,-0.3 0.839 106.7 51.9 -64.5 -29.9 -6.0 30.6 4.1 308 308 A G H S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.9 0.938 112.0 50.0 -64.0 -46.2 -16.8 22.0 19.6 322 322 A A H <5S+ 0 0 14 -4,-3.0 -128,-0.3 1,-0.2 -2,-0.2 0.868 113.1 46.6 -61.2 -37.0 -15.3 23.1 22.9 323 323 A Q H <5S+ 0 0 129 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.716 120.4 38.3 -78.1 -20.0 -18.6 24.6 24.0 324 324 A T H <5S- 0 0 61 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.609 96.0-126.3-108.9 -15.0 -20.6 21.6 22.9 325 325 A G T <5S+ 0 0 24 -4,-2.3 336,-3.2 -133,-0.2 2,-0.3 0.850 74.6 94.5 73.1 32.3 -18.7 18.5 23.8 326 326 A R B S- 0 0 40 59,-0.2 4,-2.0 3,-0.0 5,-0.1 0.300 95.2 -58.4 -78.7-150.4 4.6 -17.6 26.6 346 12 B R H > S+ 0 0 181 2,-0.2 4,-1.2 1,-0.2 3,-0.1 0.962 136.9 38.4 -60.3 -58.6 6.5 -14.4 26.1 347 13 B I H > S+ 0 0 27 1,-0.2 4,-2.1 57,-0.2 3,-0.3 0.888 114.3 57.0 -63.0 -37.9 5.3 -12.5 29.2 348 14 B G H > S+ 0 0 0 56,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.896 101.9 55.9 -60.4 -39.0 5.5 -15.7 31.2 349 15 B H H X S+ 0 0 92 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.859 107.5 49.5 -61.9 -36.0 9.2 -16.1 30.3 350 16 B V H X S+ 0 0 27 -4,-1.2 4,-2.3 -3,-0.3 -2,-0.2 0.943 111.5 45.3 -69.9 -49.9 9.9 -12.7 31.7 351 17 B H H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.923 112.3 54.0 -60.4 -42.6 8.2 -13.1 35.0 352 18 B A H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 3,-0.2 0.968 109.9 45.1 -55.1 -56.9 9.8 -16.6 35.4 353 19 B A H X S+ 0 0 54 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.874 116.1 48.1 -56.3 -38.4 13.4 -15.2 34.9 354 20 B N H X S+ 0 0 11 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.815 107.9 53.7 -73.7 -32.0 12.6 -12.4 37.2 355 21 B I H < S+ 0 0 0 -4,-2.7 6,-0.3 -3,-0.2 -2,-0.2 0.952 111.4 46.8 -66.2 -45.1 11.2 -14.6 39.9 356 22 B A H < S+ 0 0 57 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.962 113.5 48.0 -57.3 -55.3 14.3 -16.7 39.8 357 23 B A H < S+ 0 0 73 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.882 93.4 88.2 -53.7 -44.8 16.5 -13.6 39.9 358 24 B N S >< S- 0 0 25 -4,-2.5 3,-0.9 1,-0.1 261,-0.0 -0.402 70.5-150.1 -62.4 126.0 14.6 -12.1 42.8 359 25 B P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -23,-0.1 0.723 92.4 55.8 -69.4 -25.2 16.1 -13.4 46.1 360 26 B D T 3 S+ 0 0 76 -24,-0.1 -23,-2.7 -25,-0.0 2,-0.3 0.488 104.5 62.8 -87.4 -4.0 12.8 -13.3 48.0 361 27 B L E < -a 337 0F 9 -3,-0.9 2,-0.3 -6,-0.3 -23,-0.2 -0.828 54.8-167.9-124.7 162.7 10.9 -15.5 45.6 362 28 B E E -a 338 0F 76 -25,-1.7 -23,-3.3 -2,-0.3 2,-0.7 -0.974 19.7-137.6-148.2 128.6 11.0 -19.0 44.2 363 29 B L E +a 339 0F 10 -2,-0.3 -23,-0.2 18,-0.2 3,-0.1 -0.803 28.2 168.1 -89.7 115.4 9.0 -20.4 41.2 364 30 B V E + 0 0 9 -25,-2.3 20,-2.2 -2,-0.7 2,-0.3 0.704 61.0 15.0-102.2 -22.5 7.6 -23.8 42.1 365 31 B V E -ac 340 384F 1 -26,-1.1 -24,-2.7 18,-0.2 2,-0.4 -0.969 52.3-161.9-158.3 139.6 5.2 -24.4 39.3 366 32 B I E -ac 341 385F 0 18,-2.2 20,-2.4 -2,-0.3 2,-0.4 -0.961 15.4-157.3-119.1 135.9 4.4 -23.2 35.8 367 33 B A E +ac 342 386F 4 -26,-2.5 -24,-3.0 -2,-0.4 20,-0.2 -0.959 26.0 141.7-121.6 132.5 1.0 -24.0 34.1 368 34 B D - 0 0 30 18,-1.7 6,-0.2 -2,-0.4 7,-0.1 -0.893 49.4-132.2-164.4 130.7 0.2 -24.0 30.4 369 35 B P S S+ 0 0 115 0, 0.0 2,-2.1 0, 0.0 3,-0.1 0.871 104.8 73.1 -54.1 -34.4 -2.0 -26.3 28.3 370 36 B F S >> S- 0 0 122 1,-0.2 4,-1.5 -3,-0.1 3,-1.0 -0.598 74.7-175.7 -80.6 81.8 0.9 -26.4 25.9 371 37 B I H 3> S+ 0 0 37 -2,-2.1 4,-3.1 1,-0.2 5,-0.3 0.778 71.2 64.1 -51.6 -37.5 2.8 -28.6 28.3 372 38 B E H 3> S+ 0 0 105 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.893 105.9 45.0 -57.6 -41.5 6.1 -28.7 26.3 373 39 B G H <> S+ 0 0 14 -3,-1.0 4,-2.7 2,-0.2 5,-0.2 0.905 113.3 48.8 -69.6 -42.0 6.6 -25.0 26.8 374 40 B A H X S+ 0 0 0 -4,-1.5 4,-3.3 2,-0.2 5,-0.2 0.933 115.3 45.5 -62.5 -44.9 5.7 -25.1 30.5 375 41 B Q H X S+ 0 0 91 -4,-3.1 4,-3.0 2,-0.2 5,-0.2 0.935 112.3 51.0 -62.6 -47.3 8.1 -28.0 30.9 376 42 B R H X S+ 0 0 174 -4,-2.7 4,-0.9 -5,-0.3 -2,-0.2 0.913 117.2 39.6 -57.3 -44.5 10.8 -26.3 28.9 377 43 B L H < S+ 0 0 11 -4,-2.7 3,-0.3 2,-0.2 -2,-0.2 0.919 115.7 50.0 -72.8 -45.2 10.5 -23.2 30.9 378 44 B A H ><>S+ 0 0 2 -4,-3.3 3,-2.8 1,-0.2 5,-2.0 0.937 106.7 55.7 -57.2 -49.6 10.1 -24.9 34.3 379 45 B E H ><5S+ 0 0 153 -4,-3.0 3,-0.8 1,-0.3 -1,-0.2 0.834 103.9 55.1 -52.3 -36.1 13.1 -27.0 33.6 380 46 B A T 3<5S+ 0 0 74 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.271 116.3 38.2 -82.8 11.1 15.1 -23.9 33.1 381 47 B N T < 5S- 0 0 43 -3,-2.8 -1,-0.2 2,-0.2 -18,-0.2 0.184 109.7-112.1-144.5 14.4 14.0 -22.7 36.5 382 48 B G T < 5S+ 0 0 77 -3,-0.8 -3,-0.2 -4,-0.3 2,-0.2 0.786 78.6 123.5 55.9 29.5 14.1 -25.8 38.7 383 49 B A < - 0 0 18 -5,-2.0 -18,-0.2 -6,-0.1 2,-0.2 -0.577 63.3-104.4-111.7 176.6 10.3 -25.7 38.9 384 50 B E E -c 365 0F 120 -20,-2.2 -18,-2.2 -2,-0.2 2,-0.4 -0.622 26.9-140.8 -99.2 161.8 7.6 -28.2 38.1 385 51 B A E +c 366 0F 31 -20,-0.2 2,-0.3 -2,-0.2 -18,-0.2 -0.990 22.0 169.9-129.5 131.4 5.3 -28.0 35.0 386 52 B V E -c 367 0F 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S+ 0 0 146 1,-0.1 -1,-0.1 -2,-0.1 -3,-0.1 0.193 77.6 72.6-125.4 14.8 -1.0 -26.1 49.5 397 63 B D + 0 0 40 -58,-0.0 2,-0.6 2,-0.0 -59,-0.3 0.209 59.8 126.0-114.4 13.5 2.2 -24.1 49.5 398 64 B I + 0 0 21 1,-0.2 -59,-0.2 -6,-0.1 3,-0.1 -0.663 28.6 177.2 -82.5 118.0 1.5 -21.3 47.1 399 65 B D + 0 0 65 -61,-2.1 2,-0.3 -2,-0.6 -60,-0.2 0.657 69.2 0.8 -88.4 -20.5 2.1 -17.8 48.5 400 66 B G E -b 339 0F 0 -62,-1.3 -60,-2.1 22,-0.2 2,-0.4 -0.960 60.3-140.1-168.6 149.5 1.3 -15.9 45.3 401 67 B I E -bd 340 424F 0 22,-3.0 24,-2.8 -2,-0.3 2,-0.5 -0.890 5.6-157.3-117.8 144.3 0.2 -16.3 41.7 402 68 B V E -bd 341 425F 0 -62,-2.5 -60,-2.8 -2,-0.4 2,-0.9 -0.982 11.4-152.9-120.5 119.4 1.3 -14.5 38.6 403 69 B I E +bd 342 426F 0 22,-3.0 24,-1.8 -2,-0.5 -60,-0.1 -0.799 35.5 146.6 -99.7 103.0 -1.1 -14.5 35.7 404 70 B G + 0 0 12 -62,-2.7 -56,-0.4 -2,-0.9 -59,-0.2 0.114 42.5 109.1-117.0 18.2 0.6 -14.2 32.3 405 71 B S S S- 0 0 17 1,-0.2 22,-0.1 -62,-0.1 5,-0.1 -0.435 81.8 -59.1 -90.6 167.2 -1.9 -16.4 30.4 406 72 B P > 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0 64 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.885 115.1 46.7 -57.0 -40.7 -9.9 -19.2 42.2 417 83 B A H <>S+ 0 0 0 -4,-1.7 5,-3.1 -5,-0.2 3,-0.4 0.919 114.0 46.2 -69.2 -44.0 -6.8 -17.7 43.7 418 84 B V H ><5S+ 0 0 11 -4,-2.6 3,-1.9 1,-0.2 -2,-0.2 0.875 107.1 55.9 -68.0 -39.5 -8.6 -15.1 45.8 419 85 B E H 3<5S+ 0 0 118 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.722 110.0 48.7 -67.2 -17.6 -11.2 -17.5 47.1 420 86 B R T 3<5S- 0 0 124 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 0.288 121.0-112.0-100.7 7.5 -8.2 -19.5 48.4 421 87 B G T < 5 + 0 0 37 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.588 69.4 143.6 74.2 12.1 -6.6 -16.4 49.9 422 88 B I < - 0 0 13 -5,-3.1 -1,-0.2 -6,-0.2 -22,-0.2 -0.730 50.9-125.2 -90.6 124.4 -3.7 -16.4 47.4 423 89 B P - 0 0 16 0, 0.0 -22,-3.0 0, 0.0 2,-0.4 -0.373 29.1-159.6 -63.6 143.9 -2.5 -13.0 46.2 424 90 B A E -de 401 451F 0 26,-2.9 28,-2.8 -24,-0.2 2,-0.7 -0.984 18.4-158.5-135.7 127.5 -2.5 -12.7 42.5 425 91 B L E -de 402 452F 2 -24,-2.8 -22,-3.0 -2,-0.4 2,-0.4 -0.909 26.7-168.3 -99.2 115.7 -0.6 -10.3 40.1 426 92 B C E -de 403 453F 0 26,-2.7 28,-3.6 -2,-0.7 -22,-0.1 -0.923 18.8-119.4-116.3 135.0 -2.6 -10.2 36.9 427 93 B E E - e 0 454F 27 -24,-1.8 28,-0.1 -2,-0.4 -22,-0.0 -0.257 61.7 -52.3 -63.8 154.0 -1.6 -8.8 33.5 428 94 B K S S+ 0 0 31 26,-0.6 -1,-0.2 25,-0.1 81,-0.0 0.160 112.0 35.9 -30.3 138.5 -3.7 -5.9 31.9 429 95 B P - 0 0 3 0, 0.0 3,-0.2 0, 0.0 -19,-0.1 0.798 53.7-152.4 69.9 114.4 -7.5 -6.6 31.7 430 96 B I S S- 0 0 1 1,-0.5 -19,-0.4 212,-0.2 2,-0.3 0.872 90.6 -33.1 -67.3 -38.7 -9.3 -8.5 34.3 431 97 B D - 0 0 27 -21,-0.1 -1,-0.5 -20,-0.1 -23,-0.1 -0.932 55.2-117.9-169.3 166.3 -11.4 -9.2 31.3 432 98 B L S S+ 0 0 44 -2,-0.3 2,-0.7 -3,-0.2 3,-0.1 0.686 97.9 76.5 -88.0 -20.1 -12.4 -7.3 28.1 433 99 B D > - 0 0 76 1,-0.1 4,-2.2 -3,-0.0 3,-0.4 -0.835 68.8-156.1 -96.7 112.5 -16.1 -7.4 29.1 434 100 B I H > S+ 0 0 23 -2,-0.7 4,-2.3 1,-0.2 -1,-0.1 0.796 95.1 55.9 -56.5 -31.2 -17.0 -4.9 31.8 435 101 B E H > S+ 0 0 107 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.907 107.8 46.3 -69.0 -41.9 -20.0 -7.0 32.8 436 102 B X H > S+ 0 0 96 -3,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.868 111.5 54.1 -66.4 -35.2 -17.8 -10.0 33.4 437 103 B V H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.932 110.4 45.3 -62.5 -45.7 -15.5 -7.7 35.3 438 104 B R H X S+ 0 0 96 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.861 110.0 54.9 -66.1 -36.4 -18.4 -6.6 37.5 439 105 B A H X S+ 0 0 45 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.931 108.2 49.3 -61.8 -44.7 -19.5 -10.2 37.9 440 106 B C H X S+ 0 0 3 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.950 110.1 50.3 -59.0 -50.6 -16.0 -11.1 39.2 441 107 B K H X S+ 0 0 87 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.893 109.4 51.5 -55.2 -43.9 -16.0 -8.2 41.6 442 108 B E H < S+ 0 0 153 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.903 112.6 46.6 -60.3 -43.4 -19.5 -9.2 43.0 443 109 B K H < S+ 0 0 144 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.883 117.0 38.8 -70.1 -41.4 -18.3 -12.7 43.6 444 110 B I H >< S+ 0 0 16 -4,-2.4 3,-3.1 1,-0.2 -1,-0.2 0.638 79.8 173.5 -87.2 -14.7 -15.0 -12.1 45.3 445 111 B G G >< S+ 0 0 43 -4,-1.6 3,-1.6 -5,-0.3 -1,-0.2 -0.179 74.3 5.6 48.1-122.2 -16.1 -9.1 47.4 446 112 B D G > S+ 0 0 153 1,-0.3 3,-1.3 2,-0.1 -1,-0.3 0.527 114.9 84.9 -69.4 -5.8 -13.3 -8.1 49.8 447 113 B G G X + 0 0 17 -3,-3.1 3,-2.1 1,-0.3 -1,-0.3 0.679 67.9 82.0 -69.8 -15.5 -11.1 -10.7 48.1 448 114 B A G X S+ 0 0 18 -3,-1.6 3,-2.1 1,-0.3 191,-0.4 0.803 74.2 74.6 -58.3 -28.4 -10.3 -8.0 45.5 449 115 B S G < S+ 0 0 75 -3,-1.3 -1,-0.3 1,-0.3 186,-0.3 0.617 88.6 60.2 -61.9 -12.6 -7.7 -6.6 47.9 450 116 B K G < S+ 0 0 78 -3,-2.1 -26,-2.9 184,-0.1 2,-0.5 0.227 87.7 92.2 -99.9 14.3 -5.5 -9.6 47.0 451 117 B V E < -e 424 0F 1 -3,-2.1 188,-0.5 -28,-0.2 2,-0.5 -0.928 52.7-170.5-113.5 126.9 -5.2 -8.6 43.4 452 118 B X E -e 425 0F 0 -28,-2.8 -26,-2.7 -2,-0.5 2,-0.5 -0.955 20.3-134.9-112.2 133.3 -2.5 -6.5 42.0 453 119 B L E -e 426 0F 1 184,-1.9 2,-1.9 -2,-0.5 -26,-0.2 -0.778 13.1-130.8 -92.9 130.7 -2.9 -5.3 38.4 454 120 B G E +e 427 0F 0 -28,-3.6 2,-2.2 -2,-0.5 -26,-0.6 -0.286 48.5 147.7 -77.1 53.4 0.2 -5.5 36.2 455 121 B F > - 0 0 1 -2,-1.9 3,-2.0 1,-0.2 4,-0.3 -0.537 25.0-178.7 -83.9 72.0 0.3 -2.0 34.7 456 122 B N G > + 0 0 4 -2,-2.2 3,-1.4 1,-0.3 4,-0.3 0.655 64.3 77.3 -48.4 -23.6 4.1 -2.3 34.6 457 123 B R G > S+ 0 0 13 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.855 83.4 63.5 -62.3 -31.9 4.6 1.1 33.1 458 124 B R G < S+ 0 0 21 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.776 101.8 54.6 -60.6 -22.7 4.0 2.7 36.5 459 125 B F G < S+ 0 0 34 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.457 75.9 118.5 -91.6 -1.0 7.1 0.9 37.6 460 126 B D <> - 0 0 4 -3,-1.8 4,-3.0 -4,-0.3 5,-0.4 -0.456 69.7-131.2 -62.9 130.5 9.4 2.3 34.9 461 127 B P H > S+ 0 0 55 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.894 104.5 44.8 -52.9 -40.4 12.2 4.2 36.7 462 128 B S H > S+ 0 0 4 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.965 116.7 41.4 -70.3 -53.2 11.7 7.2 34.4 463 129 B F H > S+ 0 0 8 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.908 117.7 49.8 -62.8 -38.3 7.9 7.4 34.4 464 130 B A H X S+ 0 0 31 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.889 107.9 53.3 -65.7 -40.5 7.9 6.7 38.2 465 131 B A H X S+ 0 0 27 -4,-2.0 4,-2.5 -5,-0.4 -1,-0.2 0.915 110.2 47.5 -61.2 -43.5 10.5 9.4 38.9 466 132 B I H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.914 110.1 52.3 -64.4 -42.4 8.4 11.9 37.1 467 133 B N H X S+ 0 0 25 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.911 113.3 44.5 -61.1 -40.4 5.2 10.9 38.9 468 134 B A H X S+ 0 0 57 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.879 112.2 50.7 -71.6 -40.2 7.0 11.3 42.3 469 135 B R H <>S+ 0 0 57 -4,-2.5 5,-2.2 2,-0.2 6,-0.2 0.891 111.3 48.4 -67.3 -37.5 8.6 14.6 41.4 470 136 B V H ><5S+ 0 0 14 -4,-2.4 3,-2.2 1,-0.2 5,-0.2 0.939 109.8 52.3 -65.6 -46.1 5.3 16.0 40.3 471 137 B A H 3<5S+ 0 0 66 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.810 103.8 58.5 -58.9 -29.3 3.7 14.8 43.5 472 138 B N T 3<5S- 0 0 129 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.236 119.6-113.2 -85.5 14.6 6.5 16.6 45.4 473 139 B Q T X 5 + 0 0 119 -3,-2.2 3,-1.7 3,-0.2 -3,-0.2 0.593 69.1 144.9 67.2 14.5 5.4 19.8 43.7 474 140 B E T 3 > - 0 0 99 0, 0.0 4,-2.3 0, 0.0 3,-0.8 -0.312 51.6-109.4 -62.8 149.5 -0.8 -10.9 14.5 493 159 B K H 3> S+ 0 0 79 1,-0.3 4,-2.5 2,-0.2 -2,-0.1 0.892 117.0 51.4 -43.2 -57.8 -4.2 -11.1 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D F H < S+ 0 0 0 -4,-1.9 4,-0.5 1,-0.2 -2,-0.2 0.783 107.4 53.2 -68.5 -24.7 34.2 48.6 18.3 1294 292 D A H X S+ 0 0 0 -4,-1.3 4,-1.9 2,-0.2 3,-0.3 0.852 107.1 49.1 -77.1 -37.5 31.5 51.3 18.5 1295 293 D Q H X S+ 0 0 86 -4,-1.1 4,-0.9 1,-0.2 -2,-0.2 0.859 107.3 55.1 -70.7 -35.9 31.5 51.4 22.3 1296 294 D G H X S+ 0 0 10 -4,-2.0 4,-0.6 1,-0.2 6,-0.5 0.686 109.9 47.4 -70.7 -18.2 35.3 51.7 22.4 1297 295 D I H 4 S+ 0 0 31 -4,-0.5 -2,-0.2 -3,-0.3 -1,-0.2 0.839 107.0 53.7 -88.2 -40.6 35.1 54.7 20.1 1298 296 D R H < S+ 0 0 136 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.1 0.705 126.7 27.7 -65.8 -17.4 32.3 56.4 22.1 1299 297 D D H < S- 0 0 83 -4,-0.9 -3,-0.2 -5,-0.1 -2,-0.2 0.709 79.2-153.1-104.5 -89.5 34.7 55.9 25.0 1300 298 D G < + 0 0 57 -4,-0.6 -3,-0.1 2,-0.2 3,-0.1 0.499 55.4 122.7 119.3 13.2 38.4 55.8 24.2 1301 299 D Q S S- 0 0 167 1,-0.3 2,-0.2 -5,-0.1 -4,-0.1 0.654 83.2 -92.8 -76.3 -17.1 39.6 53.7 27.1 1302 300 D G - 0 0 29 -6,-0.5 -1,-0.3 -184,-0.1 2,-0.3 -0.533 40.9 -82.9 124.6 168.5 41.0 51.2 24.5 1303 301 D F - 0 0 11 -186,-1.2 -184,-0.1 -187,-0.3 -10,-0.1 -0.789 33.1-122.7-113.0 154.8 39.9 48.1 22.7 1304 302 D S S S+ 0 0 74 -2,-0.3 2,-0.1 1,-0.2 -184,-0.1 -0.976 99.3 36.7-141.9 124.3 39.8 44.4 23.6 1305 303 D P S S- 0 0 0 0, 0.0 -184,-2.3 0, 0.0 -1,-0.2 0.485 96.9-173.0 -66.3 146.6 41.2 42.3 22.1 1306 304 D N B >> -I 1120 0K 48 -186,-0.3 4,-1.3 -2,-0.1 3,-0.9 -0.569 41.8 -87.2-109.6 174.3 44.0 44.7 21.4 1307 305 D F H 3> S+ 0 0 0 -188,-1.0 4,-1.3 -191,-0.7 -190,-0.1 0.804 126.3 57.0 -46.9 -37.3 47.1 44.8 19.2 1308 306 D E H 3> S+ 0 0 64 -192,-0.3 4,-2.4 1,-0.2 5,-0.3 0.903 98.3 58.7 -64.3 -43.1 49.0 43.1 22.1 1309 307 D D H <> S+ 0 0 16 -3,-0.9 4,-2.1 1,-0.3 -1,-0.2 0.882 107.3 48.7 -54.5 -39.0 46.6 40.2 22.2 1310 308 D G H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -1,-0.3 0.836 106.9 56.1 -70.3 -32.6 47.5 39.5 18.6 1311 309 D V H X S+ 0 0 1 -4,-1.3 4,-1.8 -3,-0.2 -2,-0.2 0.945 112.3 40.9 -63.0 -49.1 51.2 39.8 19.4 1312 310 D I H X S+ 0 0 29 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.862 109.9 58.7 -68.5 -37.8 51.0 37.0 22.0 1313 311 D A H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.949 109.7 43.8 -56.9 -48.7 48.7 34.9 19.9 1314 312 D L H X S+ 0 0 2 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.895 111.5 54.3 -63.3 -38.9 51.3 34.8 17.1 1315 313 D E H X S+ 0 0 46 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.843 108.3 49.9 -63.0 -33.7 54.0 34.2 19.8 1316 314 D L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.892 109.4 51.7 -70.4 -40.8 51.9 31.2 21.0 1317 315 D A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.938 110.9 45.7 -61.6 -49.4 51.6 29.9 17.5 1318 316 D N H X S+ 0 0 34 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.926 112.3 52.5 -61.6 -41.7 55.4 30.0 16.8 1319 317 D A H X S+ 0 0 14 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.887 108.2 51.6 -60.8 -38.4 56.0 28.4 20.2 1320 318 D C H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.939 108.7 50.5 -63.1 -46.5 53.6 25.6 19.2 1321 319 D L H X S+ 0 0 37 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.880 109.6 50.3 -58.9 -40.9 55.4 25.0 16.0 1322 320 D E H X S+ 0 0 92 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.875 110.9 49.6 -65.3 -39.1 58.8 24.8 17.8 1323 321 D S H X>S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 5,-0.8 0.906 109.7 50.9 -66.4 -42.1 57.3 22.3 20.2 1324 322 D A H <5S+ 0 0 13 -4,-2.4 -128,-0.3 1,-0.2 -2,-0.2 0.886 113.9 44.3 -64.0 -38.4 55.9 20.2 17.4 1325 323 D Q H <5S+ 0 0 120 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.689 120.1 40.8 -80.3 -17.6 59.2 20.1 15.6 1326 324 D T H <5S- 0 0 55 -4,-1.3 -2,-0.2 2,-0.2 -1,-0.2 0.617 94.3-129.9-108.2 -13.3 61.3 19.4 18.8 1327 325 D G T <5S+ 0 0 22 -4,-2.0 -332,-3.0 -133,-0.2 2,-0.3 0.860 74.0 95.4 67.6 34.8 59.3 16.9 20.8 1328 326 D R B