==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 08-JAN-04 1S2C . COMPND 2 MOLECULE: ALDO-KETO REDUCTASE FAMILY 1 MEMBER C3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.L.LOVERING,J.P.RIDE,C.M.BUNCE,J.C.DESMOND,S.M.CUMMINGS, . 315 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14322.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 208 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.2 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 18 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 0 1 2 1 1 1 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 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 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 6 A Q 0 0 163 0, 0.0 12,-2.4 0, 0.0 13,-0.4 0.000 360.0 360.0 360.0 16.0 49.1 -26.5 50.4 2 7 A C E -A 12 0A 75 10,-0.3 2,-0.4 11,-0.1 8,-0.0 -0.862 360.0-140.1-126.4 161.7 49.1 -25.5 54.1 3 8 A V E -A 11 0A 44 8,-2.5 8,-2.5 -2,-0.3 2,-0.5 -0.970 24.5-120.9-120.5 139.9 48.7 -22.3 56.2 4 9 A K E -A 10 0A 133 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.695 29.3-142.0 -81.4 122.6 50.7 -21.6 59.3 5 10 A L > - 0 0 5 4,-3.2 3,-2.0 -2,-0.5 201,-0.1 -0.381 25.9-104.0 -81.4 164.8 48.4 -21.1 62.3 6 11 A N T 3 S+ 0 0 44 199,-0.4 174,-0.1 1,-0.3 -1,-0.1 0.527 120.2 55.1 -73.8 -4.1 49.1 -18.6 65.0 7 12 A D T 3 S- 0 0 42 2,-0.2 -1,-0.3 172,-0.1 3,-0.1 0.259 122.4-101.1-106.1 7.7 50.3 -21.3 67.4 8 13 A G S < S+ 0 0 36 -3,-2.0 -2,-0.1 1,-0.3 2,-0.1 0.241 85.1 117.6 94.6 -13.6 53.0 -22.6 65.0 9 14 A H - 0 0 68 147,-0.1 -4,-3.2 -5,-0.1 2,-0.4 -0.382 60.0-122.6 -80.4 166.8 51.1 -25.7 63.7 10 15 A F E -A 4 0A 123 -6,-0.2 -6,-0.2 -2,-0.1 -1,-0.0 -0.916 17.6-162.7-119.2 139.9 50.1 -26.1 60.0 11 16 A M E -A 3 0A 0 -8,-2.5 -8,-2.5 -2,-0.4 2,-0.1 -0.979 24.8-120.9-122.6 125.1 46.6 -26.6 58.5 12 17 A P E -A 2 0A 19 0, 0.0 -10,-0.3 0, 0.0 29,-0.0 -0.449 21.5-134.8 -63.4 136.7 45.9 -27.9 55.0 13 18 A V S S+ 0 0 25 -12,-2.4 249,-2.5 -2,-0.1 2,-0.5 0.597 89.1 59.1 -77.0 -12.0 43.9 -25.3 53.1 14 19 A L E S-b 262 0B 9 -13,-0.4 29,-0.6 247,-0.2 28,-0.5 -0.984 71.3-175.5-116.7 125.3 41.4 -27.9 51.6 15 20 A G E -bc 263 43B 0 247,-2.5 249,-1.8 -2,-0.5 2,-0.5 -0.877 24.4-121.9-122.8 153.2 39.4 -30.0 54.1 16 21 A F E -bc 264 44B 0 27,-3.1 29,-2.8 -2,-0.3 2,-0.4 -0.814 22.0-141.2 -96.2 122.0 37.0 -32.9 53.8 17 22 A G E -bc 265 45B 9 247,-1.8 249,-0.6 -2,-0.5 29,-0.1 -0.709 17.1-176.1 -82.2 127.6 33.5 -32.3 55.3 18 23 A T + 0 0 0 27,-1.6 2,-0.2 -2,-0.4 -1,-0.1 0.486 38.5 118.6-105.8 -5.3 32.1 -35.5 57.0 19 24 A Y + 0 0 49 26,-0.2 32,-0.1 27,-0.1 -2,-0.1 -0.470 30.5 167.4 -67.2 129.4 28.6 -34.5 58.0 20 25 A A - 0 0 2 30,-0.3 9,-0.0 -2,-0.2 -2,-0.0 -0.985 39.7-102.6-131.7 146.6 25.8 -36.5 56.5 21 26 A P > - 0 0 13 0, 0.0 3,-2.2 0, 0.0 29,-0.0 -0.183 39.4 -99.1 -65.7 160.8 22.2 -36.4 57.8 22 27 A P T 3 S+ 0 0 85 0, 0.0 4,-0.1 0, 0.0 28,-0.0 0.675 117.9 68.5 -56.0 -23.1 20.8 -39.3 59.9 23 28 A E T 3 S+ 0 0 145 2,-0.1 3,-0.0 3,-0.0 0, 0.0 0.668 83.3 85.7 -71.8 -18.5 19.1 -41.0 57.0 24 29 A V S < S- 0 0 37 -3,-2.2 -4,-0.1 1,-0.1 5,-0.1 -0.739 95.5-106.8 -80.3 126.3 22.5 -41.8 55.5 25 30 A P > - 0 0 78 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.236 21.0-126.5 -53.8 141.2 23.9 -45.1 57.0 26 31 A R T >> S+ 0 0 60 1,-0.3 3,-1.0 2,-0.2 4,-0.6 0.808 105.7 67.4 -62.5 -31.1 26.7 -44.6 59.5 27 32 A S H 3> S+ 0 0 65 1,-0.2 4,-1.6 2,-0.2 3,-0.5 0.739 85.7 71.6 -60.6 -25.7 28.9 -47.0 57.5 28 33 A K H <> S+ 0 0 71 -3,-1.5 4,-2.8 1,-0.2 5,-0.3 0.877 87.9 61.3 -61.3 -37.3 29.1 -44.6 54.6 29 34 A A H <> S+ 0 0 3 -3,-1.0 4,-1.9 -4,-0.4 -1,-0.2 0.859 104.0 50.0 -59.3 -38.3 31.4 -42.2 56.6 30 35 A L H X S+ 0 0 38 -4,-0.6 4,-1.9 -3,-0.5 -1,-0.2 0.967 113.1 45.7 -61.5 -52.8 34.0 -44.9 56.8 31 36 A E H X S+ 0 0 92 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.922 117.1 42.2 -57.8 -50.4 33.9 -45.6 53.1 32 37 A V H X S+ 0 0 3 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.828 109.3 56.4 -75.2 -31.9 34.0 -42.0 51.9 33 38 A T H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 0.907 108.4 49.5 -65.8 -38.9 36.6 -40.8 54.4 34 39 A K H X S+ 0 0 69 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.918 111.3 49.6 -60.7 -43.8 38.9 -43.5 53.0 35 40 A L H X S+ 0 0 35 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.885 108.2 53.5 -61.8 -39.3 38.1 -42.3 49.5 36 41 A A H X>S+ 0 0 0 -4,-2.5 5,-2.3 2,-0.2 4,-1.0 0.936 110.3 46.3 -62.3 -45.6 38.8 -38.7 50.5 37 42 A I H ><5S+ 0 0 3 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.908 111.1 52.6 -63.7 -41.5 42.3 -39.7 51.8 38 43 A E H 3<5S+ 0 0 116 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.890 107.4 52.6 -59.7 -38.6 42.9 -41.7 48.6 39 44 A A H 3<5S- 0 0 29 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.677 130.0 -92.8 -73.4 -21.0 42.0 -38.6 46.5 40 45 A G T <<5S+ 0 0 37 -4,-1.0 2,-0.2 -3,-0.7 -3,-0.2 0.374 74.9 143.1 123.9 -1.3 44.5 -36.4 48.4 41 46 A F < + 0 0 3 -5,-2.3 -1,-0.3 -6,-0.2 -26,-0.1 -0.530 13.8 168.5 -66.5 134.1 42.5 -34.8 51.3 42 47 A R + 0 0 80 -28,-0.5 33,-3.3 -2,-0.2 2,-0.5 0.431 59.1 74.5-122.5 -9.7 44.6 -34.5 54.4 43 48 A H E -cd 15 75B 2 -29,-0.6 -27,-3.1 31,-0.2 2,-0.4 -0.936 63.4-173.1-107.9 123.0 42.4 -32.2 56.5 44 49 A I E -cd 16 76B 0 31,-2.9 33,-2.6 -2,-0.5 2,-0.6 -0.987 8.4-155.3-124.7 123.2 39.3 -34.0 57.8 45 50 A D E +cd 17 77B 4 -29,-2.8 -27,-1.6 -2,-0.4 2,-0.2 -0.883 27.5 145.8-108.5 117.3 36.5 -32.2 59.6 46 51 A S - 0 0 0 31,-2.2 2,-0.3 -2,-0.6 3,-0.1 -0.633 20.8-165.3-131.5-170.6 34.2 -33.9 62.1 47 52 A A > > - 0 0 0 31,-0.2 3,-0.9 -2,-0.2 5,-0.5 -0.945 39.3-106.3-172.8 156.0 32.3 -33.1 65.4 48 53 A H G > 5S+ 0 0 49 31,-1.5 3,-1.6 -2,-0.3 5,-0.2 0.917 118.6 60.6 -55.0 -42.7 30.5 -34.8 68.3 49 54 A L G 3 5S+ 0 0 49 1,-0.3 -1,-0.2 30,-0.2 74,-0.0 0.772 92.3 66.3 -55.5 -30.8 27.3 -33.6 66.7 50 55 A Y G < 5S- 0 0 26 -3,-0.9 -30,-0.3 1,-0.1 -1,-0.3 0.603 89.1-142.8 -77.6 -11.5 27.9 -35.6 63.5 51 56 A N T < 5S+ 0 0 112 -3,-1.6 -3,-0.1 -4,-0.4 -2,-0.1 0.906 77.6 95.0 51.1 43.4 27.6 -39.1 65.2 52 57 A N >< + 0 0 1 -5,-0.5 4,-2.7 -4,-0.1 5,-0.3 0.288 36.6 110.7-140.9 7.7 30.4 -40.3 62.9 53 58 A E H > S+ 0 0 8 -6,-0.3 4,-2.4 1,-0.2 5,-0.2 0.840 80.4 53.1 -64.7 -33.1 33.6 -40.0 64.9 54 59 A E H > S+ 0 0 108 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 114.2 42.3 -61.2 -44.3 34.1 -43.8 65.2 55 60 A Q H > S+ 0 0 49 -3,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.910 116.6 46.1 -71.8 -44.4 33.7 -44.3 61.5 56 61 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.926 113.7 50.2 -65.7 -44.3 35.9 -41.3 60.5 57 62 A G H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.898 109.0 51.8 -58.7 -41.7 38.5 -42.3 63.1 58 63 A L H X S+ 0 0 66 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.887 107.1 53.1 -64.9 -39.1 38.5 -45.9 61.7 59 64 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.915 111.0 46.3 -60.6 -45.3 39.1 -44.6 58.2 60 65 A I H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.940 113.9 48.1 -62.0 -46.7 42.1 -42.6 59.3 61 66 A R H X S+ 0 0 81 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.854 109.4 53.5 -67.4 -32.0 43.5 -45.5 61.2 62 67 A S H X S+ 0 0 35 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.867 108.9 48.5 -66.9 -39.5 42.9 -47.9 58.3 63 68 A K H <>S+ 0 0 15 -4,-1.7 6,-1.6 2,-0.2 5,-1.1 0.726 112.4 49.1 -76.3 -23.3 44.9 -45.6 55.9 64 69 A I H ><5S+ 0 0 57 -4,-1.4 3,-1.1 4,-0.2 -2,-0.2 0.887 110.3 51.2 -75.4 -41.4 47.7 -45.4 58.5 65 70 A A H 3<5S+ 0 0 90 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.1 0.815 110.2 47.9 -69.3 -32.4 47.8 -49.1 58.9 66 71 A D T 3<5S- 0 0 97 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.352 116.7-112.2 -92.5 4.1 48.1 -49.8 55.2 67 72 A G T < 5S+ 0 0 63 -3,-1.1 -3,-0.2 2,-0.3 -2,-0.1 0.441 82.1 121.0 89.5 3.3 50.8 -47.3 54.7 68 73 A S S - 0 0 123 -2,-0.3 3,-1.4 1,-0.1 4,-0.5 -0.719 34.5-113.2 -97.7 159.2 51.3 -41.2 58.6 71 76 A R G > S+ 0 0 40 -2,-0.3 3,-1.5 1,-0.3 -1,-0.1 0.889 118.2 59.7 -57.8 -40.7 49.3 -39.7 61.5 72 77 A E G 3 S+ 0 0 147 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.630 98.7 58.6 -63.2 -16.5 51.4 -36.5 61.2 73 78 A D G < S+ 0 0 66 -3,-1.4 2,-0.4 2,-0.0 -1,-0.3 0.614 95.2 79.4 -86.7 -15.4 50.2 -36.1 57.6 74 79 A I < - 0 0 3 -3,-1.5 2,-0.6 -4,-0.5 -31,-0.2 -0.791 62.1-159.7 -99.3 136.2 46.5 -36.0 58.7 75 80 A F E -d 43 0B 8 -33,-3.3 -31,-2.9 -2,-0.4 2,-0.5 -0.947 19.0-172.4-111.8 105.4 44.9 -32.9 60.2 76 81 A Y E -d 44 0B 1 -2,-0.6 31,-1.7 -33,-0.2 32,-1.7 -0.889 3.2-165.4-108.5 129.2 41.8 -34.1 62.1 77 82 A T E +de 45 108B 0 -33,-2.6 -31,-2.2 -2,-0.5 2,-0.3 -0.913 10.7 171.8-112.6 134.6 39.2 -31.7 63.6 78 83 A S E - e 0 109B 0 30,-2.3 32,-1.8 -2,-0.4 2,-0.4 -0.843 19.1-137.7-127.3 175.3 36.5 -32.3 66.1 79 84 A K E - e 0 110B 0 -2,-0.3 -31,-1.5 30,-0.2 2,-0.5 -0.996 14.5-119.6-141.1 138.7 34.2 -29.9 67.9 80 85 A L E - e 0 111B 0 30,-3.2 32,-2.0 -2,-0.4 33,-0.4 -0.650 37.9-129.1 -71.4 117.7 32.8 -29.3 71.4 81 86 A W > - 0 0 29 -2,-0.5 3,-2.0 30,-0.1 36,-0.1 -0.333 20.5-109.8 -74.2 156.5 29.0 -29.6 71.3 82 87 A S G > S+ 0 0 1 1,-0.3 35,-2.3 2,-0.2 3,-0.7 0.582 112.6 64.7 -69.8 -14.8 27.0 -26.8 72.8 83 88 A T G 3 S+ 0 0 4 1,-0.2 -1,-0.3 33,-0.2 37,-0.2 0.459 100.6 56.8 -80.3 -1.5 25.6 -28.8 75.8 84 89 A F G < + 0 0 48 -3,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.024 67.3 110.9-119.0 24.6 29.2 -29.1 77.0 85 90 A H < + 0 0 1 -3,-0.7 -1,-0.1 32,-0.3 5,-0.1 0.769 47.3 102.3 -71.1 -28.5 30.2 -25.3 77.3 86 91 A R S > S- 0 0 99 -3,-0.2 3,-2.5 1,-0.1 4,-0.5 -0.425 85.3-122.9 -58.3 128.7 30.3 -25.4 81.1 87 92 A P G >> S+ 0 0 44 0, 0.0 3,-1.3 0, 0.0 4,-0.6 0.791 107.0 59.1 -54.5 -36.7 34.1 -25.6 81.7 88 93 A E G 34 S+ 0 0 130 1,-0.2 -2,-0.1 2,-0.1 -3,-0.1 0.658 105.5 52.1 -65.1 -17.5 34.0 -28.8 83.7 89 94 A L G <> S+ 0 0 49 -3,-2.5 4,-1.7 2,-0.1 -1,-0.2 0.536 90.4 79.4 -93.6 -9.3 32.5 -30.6 80.7 90 95 A V H <> S+ 0 0 0 -3,-1.3 4,-2.1 -4,-0.5 5,-0.2 0.954 93.3 42.5 -70.2 -53.9 35.0 -29.6 78.1 91 96 A R H X S+ 0 0 116 -4,-0.6 4,-2.7 1,-0.2 5,-0.2 0.934 115.0 50.9 -62.7 -45.9 37.9 -32.0 78.8 92 97 A P H > S+ 0 0 66 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.878 109.1 52.5 -56.6 -37.2 35.5 -35.0 79.2 93 98 A A H X S+ 0 0 13 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.908 111.3 46.2 -65.3 -42.3 33.8 -34.1 75.9 94 99 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.904 110.6 52.0 -65.4 -42.1 37.2 -34.1 74.2 95 100 A E H X S+ 0 0 81 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.889 108.8 52.0 -62.8 -37.8 38.3 -37.3 75.8 96 101 A N H X S+ 0 0 49 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.908 109.3 49.1 -61.9 -44.0 35.0 -38.9 74.6 97 102 A S H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.894 111.7 49.1 -63.2 -39.7 35.7 -37.7 71.0 98 103 A L H X>S+ 0 0 12 -4,-2.4 5,-1.7 2,-0.2 4,-1.1 0.878 111.3 49.5 -68.1 -37.2 39.3 -39.1 71.2 99 104 A K H <5S+ 0 0 125 -4,-2.2 3,-0.3 2,-0.2 -2,-0.2 0.931 111.0 49.7 -67.4 -43.9 38.0 -42.5 72.5 100 105 A K H <5S+ 0 0 77 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.926 118.0 39.0 -56.7 -47.6 35.4 -42.6 69.7 101 106 A A H <5S- 0 0 0 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.598 103.9-131.5 -82.1 -11.1 37.9 -41.9 67.0 102 107 A Q T <5 + 0 0 121 -4,-1.1 2,-0.3 -3,-0.3 -3,-0.2 0.883 60.8 136.3 55.1 43.0 40.6 -44.0 68.7 103 108 A L < - 0 0 16 -5,-1.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.844 59.1-140.2-113.8 154.3 43.2 -41.2 68.4 104 109 A D S S+ 0 0 149 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.748 86.6 2.1 -80.4 -29.7 45.7 -39.9 70.9 105 110 A Y - 0 0 40 -7,-0.1 2,-0.4 50,-0.0 -1,-0.2 -0.976 63.3-130.2-150.1 156.9 45.1 -36.3 69.9 106 111 A V E - f 0 155B 0 48,-2.2 50,-2.2 -2,-0.3 51,-0.3 -0.871 18.1-139.3-100.4 146.8 43.0 -34.1 67.6 107 112 A D E S+ 0 0 19 -31,-1.7 50,-1.2 -2,-0.4 2,-0.3 0.818 89.6 17.5 -70.0 -30.3 44.9 -31.6 65.5 108 113 A L E -ef 77 157B 2 -32,-1.7 -30,-2.3 48,-0.2 2,-0.4 -0.990 60.9-170.7-147.6 132.1 42.1 -29.0 66.1 109 114 A Y E -ef 78 158B 1 48,-1.6 50,-2.1 -2,-0.3 2,-0.3 -0.996 17.6-169.7-123.9 128.1 39.3 -28.8 68.7 110 115 A L E -ef 79 159B 0 -32,-1.8 -30,-3.2 -2,-0.4 2,-0.7 -0.873 33.7-118.4-117.1 145.1 36.6 -26.1 68.2 111 116 A I E -ef 80 160B 0 48,-1.6 50,-1.3 -2,-0.3 -30,-0.1 -0.784 35.3-147.9 -68.6 115.2 33.8 -24.6 70.2 112 117 A H - 0 0 17 -32,-2.0 -1,-0.2 -2,-0.7 -31,-0.1 0.837 68.0 -8.8 -59.8 -38.0 31.1 -25.7 67.6 113 118 A S - 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0 0 39 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.901 28.6-109.2-127.6 160.3 32.5 -27.0 37.5 247 252 A P H > S+ 0 0 34 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.883 119.9 55.8 -54.0 -40.1 30.6 -24.5 39.6 248 253 A A H > S+ 0 0 13 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.939 107.6 48.1 -58.8 -47.4 31.7 -26.4 42.7 249 254 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.877 110.1 51.9 -62.5 -38.9 35.4 -26.0 41.7 250 255 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.920 109.8 50.2 -60.3 -45.9 34.8 -22.2 41.0 251 256 A A H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.853 113.4 45.1 -62.1 -38.4 33.3 -21.8 44.5 252 257 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 3,-0.2 0.914 112.2 50.1 -72.4 -43.6 36.2 -23.6 46.2 253 258 A R H X S+ 0 0 34 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.870 102.9 62.1 -64.9 -39.0 38.9 -21.8 44.3 254 259 A Y H X S+ 0 0 0 -4,-2.3 4,-0.8 -5,-0.2 -1,-0.2 0.915 105.3 47.4 -46.8 -48.9 37.2 -18.4 45.2 255 260 A Q H ><>S+ 0 0 0 -4,-1.1 5,-2.3 -3,-0.2 3,-1.2 0.945 109.7 51.0 -65.3 -48.1 37.8 -19.1 48.9 256 261 A L H ><5S+ 0 0 32 -4,-1.8 3,-1.4 1,-0.3 -1,-0.2 0.884 107.4 54.1 -57.6 -39.2 41.5 -20.2 48.5 257 262 A Q H 3<5S+ 0 0 63 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.668 107.0 51.8 -73.6 -15.2 42.2 -17.0 46.5 258 263 A R T <<5S- 0 0 24 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.370 122.8-105.2 -92.8 1.5 40.8 -14.9 49.3 259 264 A G T < 5S+ 0 0 51 -3,-1.4 2,-0.5 -4,-0.4 -51,-0.4 0.750 76.4 138.5 77.6 27.2 43.0 -16.7 51.9 260 265 A V < - 0 0 3 -5,-2.3 2,-0.3 -6,-0.1 -1,-0.3 -0.887 54.4-129.9-105.1 128.8 40.1 -18.7 53.3 261 266 A V E - i 0 209B 4 -53,-2.1 -51,-3.0 -2,-0.5 2,-0.4 -0.640 33.4-148.0 -73.8 135.0 40.6 -22.4 54.2 262 267 A V E -bi 14 210B 0 -249,-2.5 -247,-2.5 -2,-0.3 2,-0.3 -0.910 14.0-156.6-121.2 134.6 37.8 -24.2 52.5 263 268 A L E -b 15 0B 10 -53,-2.2 -50,-0.3 -2,-0.4 2,-0.3 -0.729 8.3-170.3 -97.4 154.9 35.8 -27.4 53.4 264 269 A A E -b 16 0B 4 -249,-1.8 -247,-1.8 -2,-0.3 2,-0.5 -0.897 5.9-159.2-147.1 116.1 34.0 -29.6 51.0 265 270 A K E +b 17 0B 72 -2,-0.3 2,-0.3 -249,-0.2 -247,-0.1 -0.817 23.0 154.6 -90.3 130.7 31.6 -32.4 51.8 266 271 A S - 0 0 8 -249,-0.6 -230,-0.1 -2,-0.5 -2,-0.1 -0.910 28.6-172.8-149.7 137.2 30.9 -35.1 49.3 267 272 A Y + 0 0 37 -2,-0.3 2,-0.5 5,-0.0 -234,-0.0 0.103 67.6 95.1-105.1 18.8 29.8 -38.7 49.8 268 273 A N S > S- 0 0 52 1,-0.1 4,-2.5 -236,-0.0 5,-0.2 -0.943 70.7-142.9-113.8 126.7 30.2 -39.4 46.0 269 274 A E H > S+ 0 0 91 -2,-0.5 4,-2.0 1,-0.2 5,-0.2 0.877 100.1 48.8 -57.3 -44.1 33.4 -40.9 44.8 270 275 A Q H > S+ 0 0 124 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.924 114.0 44.9 -63.2 -45.9 33.5 -38.9 41.5 271 276 A R H > S+ 0 0 127 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.863 109.6 55.7 -70.6 -33.6 32.8 -35.5 43.3 272 277 A I H X S+ 0 0 1 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.941 111.9 43.7 -58.4 -48.0 35.4 -36.3 46.0 273 278 A R H < S+ 0 0 133 -4,-2.0 3,-0.3 -5,-0.2 4,-0.3 0.837 112.0 55.0 -66.9 -33.7 38.0 -36.8 43.4 274 279 A Q H >< S+ 0 0 37 -4,-1.9 3,-2.0 1,-0.2 -1,-0.2 0.901 98.3 61.8 -63.8 -41.0 36.8 -33.7 41.5 275 280 A N H >< S+ 0 0 5 -4,-2.1 3,-1.3 1,-0.3 -1,-0.2 0.764 91.9 63.7 -67.5 -26.0 37.2 -31.4 44.5 276 281 A V G >< S+ 0 0 34 -4,-0.8 3,-1.1 -3,-0.3 -1,-0.3 0.641 83.6 79.8 -70.1 -12.6 40.9 -31.9 44.8 277 282 A Q G X + 0 0 61 -3,-2.0 3,-2.0 -4,-0.3 4,-0.3 0.471 62.7 97.3 -70.8 -2.0 41.3 -30.3 41.3 278 283 A V G X S+ 0 0 0 -3,-1.3 3,-0.7 1,-0.3 -1,-0.2 0.804 79.7 55.2 -56.2 -29.2 40.9 -26.9 43.1 279 284 A F G < S+ 0 0 69 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.1 0.504 93.4 73.1 -80.7 -4.3 44.7 -26.6 43.0 280 285 A E G < S+ 0 0 120 -3,-2.0 2,-0.3 -4,-0.1 -1,-0.2 0.476 100.6 24.7 -92.8 -5.8 44.9 -27.1 39.2 281 286 A F < - 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0 0 145 -105,-2.0 -104,-0.2 2,-0.1 -1,-0.1 0.078 61.1-105.3-136.6 25.8 23.3 -11.3 49.3 297 302 A N + 0 0 121 1,-0.2 2,-0.8 -106,-0.2 -105,-0.2 0.832 64.9 160.2 56.9 37.3 23.7 -11.9 53.1 298 303 A L - 0 0 27 -107,-2.4 2,-0.7 -71,-0.0 -1,-0.2 -0.798 22.4-177.0-101.3 102.1 22.2 -15.4 52.7 299 304 A H - 0 0 29 -2,-0.8 15,-0.0 1,-0.2 -107,-0.0 -0.891 15.1-156.1 -92.7 116.1 23.0 -17.9 55.5 300 305 A Y S S+ 0 0 2 -2,-0.7 2,-1.0 -88,-0.1 -76,-0.4 0.895 83.3 75.9 -57.0 -43.1 21.5 -21.2 54.5 301 306 A F + 0 0 58 -78,-0.1 -78,-0.2 -3,-0.1 2,-0.1 -0.626 63.8 145.9 -71.8 105.9 21.3 -22.2 58.2 302 307 A N + 0 0 87 -80,-2.7 2,-0.3 -2,-1.0 -1,-0.1 -0.581 12.8 140.3-151.9 72.4 18.2 -20.1 59.0 303 308 A S >> - 0 0 24 -2,-0.1 4,-2.7 1,-0.1 3,-1.5 -0.904 59.3-121.2-123.8 149.7 15.9 -21.6 61.6 304 309 A D H 3> S+ 0 0 113 -2,-0.3 4,-1.8 1,-0.3 5,-0.2 0.811 112.3 66.2 -49.9 -36.6 13.8 -20.2 64.5 305 310 A S H 34 S+ 0 0 30 1,-0.2 -1,-0.3 2,-0.2 -173,-0.2 0.741 113.7 29.8 -64.2 -24.7 15.8 -22.7 66.7 306 311 A F H X4 S+ 0 0 50 -3,-1.5 3,-1.7 2,-0.1 -2,-0.2 0.834 116.0 57.4 -91.2 -47.1 19.0 -20.7 66.0 307 312 A A H 3< S+ 0 0 44 -4,-2.7 -3,-0.2 1,-0.3 -2,-0.2 0.715 103.3 53.0 -65.5 -24.9 17.6 -17.2 65.5 308 313 A S T 3< S+ 0 0 63 -4,-1.8 -1,-0.3 -5,-0.2 -3,-0.1 0.565 82.6 110.5 -86.4 -11.6 15.9 -17.0 68.9 309 314 A H S X S- 0 0 15 -3,-1.7 3,-1.8 -5,-0.2 -3,-0.0 -0.412 73.2-130.6 -66.3 136.4 19.0 -17.9 70.9 310 315 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -195,-0.1 0.774 109.2 45.4 -58.8 -26.1 20.5 -15.0 73.0 311 316 A N T 3 S+ 0 0 54 -195,-0.1 -2,-0.1 -5,-0.1 -4,-0.1 0.101 76.7 147.2-105.5 19.3 24.0 -15.8 71.5 312 317 A Y < - 0 0 45 -3,-1.8 -5,-0.1 1,-0.1 -149,-0.0 -0.376 43.1-145.6 -51.5 123.1 22.8 -16.1 67.9 313 318 A P + 0 0 9 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.701 68.9 83.0 -72.9 -21.7 25.8 -14.8 65.8 314 319 A Y 0 0 32 1,-0.1 -2,-0.0 -150,-0.1 -150,-0.0 -0.614 360.0 360.0 -94.0 145.7 23.8 -13.2 62.9 315 320 A S 0 0 172 -2,-0.3 -1,-0.1 0, 0.0 -3,-0.0 0.651 360.0 360.0-105.4 360.0 22.2 -9.7 62.9