==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 24-MAR-11 3R94 . COMPND 2 MOLECULE: ALDO-KETO REDUCTASE FAMILY 1 MEMBER C3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.YOSAATMADJA,R.M.TEAGUE,J.U.FLANAGAN,C.J.SQUIRE . 303 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13084.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 208 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.3 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 0 103 0, 0.0 12,-2.2 0, 0.0 13,-0.4 0.000 360.0 360.0 360.0-174.4 6.7 27.9 2.1 2 7 A C E -A 12 0A 67 10,-0.3 2,-0.4 11,-0.1 8,-0.0 -0.851 360.0-131.4-131.3 157.8 7.2 26.7 5.7 3 8 A V E -A 11 0A 50 8,-2.4 8,-2.8 -2,-0.3 2,-0.5 -0.883 31.0-118.3-107.9 145.2 7.3 23.3 7.5 4 9 A K E -A 10 0A 131 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.735 30.8-137.5 -82.2 130.4 5.2 22.9 10.7 5 10 A L > - 0 0 3 4,-3.9 3,-2.0 -2,-0.5 189,-0.1 -0.462 25.9-102.9 -86.3 162.7 7.5 22.3 13.7 6 11 A N T 3 S+ 0 0 41 187,-0.4 -1,-0.1 1,-0.3 162,-0.1 0.524 121.9 56.7 -65.4 -6.9 6.6 19.7 16.4 7 12 A D T 3 S- 0 0 42 2,-0.2 -1,-0.3 160,-0.1 3,-0.1 0.192 122.4-103.2-102.4 11.4 5.4 22.5 18.8 8 13 A G S < S+ 0 0 36 -3,-2.0 -2,-0.1 1,-0.3 2,-0.1 0.298 85.0 119.0 84.2 -6.5 2.9 23.9 16.2 9 14 A H - 0 0 68 135,-0.1 -4,-3.9 -5,-0.1 2,-0.4 -0.399 61.3-121.0 -77.4 167.5 4.9 27.0 15.0 10 15 A F E -A 4 0A 124 -6,-0.2 -6,-0.2 -2,-0.1 -1,-0.0 -0.907 18.5-163.5-116.5 134.8 6.1 27.3 11.4 11 16 A M E -A 3 0A 0 -8,-2.8 -8,-2.4 -2,-0.4 2,-0.1 -0.961 26.5-121.7-114.3 126.6 9.7 27.6 10.0 12 17 A P E -A 2 0A 17 0, 0.0 -10,-0.3 0, 0.0 29,-0.0 -0.479 20.8-132.6 -64.4 139.9 10.2 28.8 6.5 13 18 A V S S+ 0 0 25 -12,-2.2 237,-2.4 -2,-0.1 2,-0.5 0.626 89.5 58.2 -74.9 -16.7 12.2 26.1 4.6 14 19 A L E S-b 250 0B 7 -13,-0.4 28,-0.6 235,-0.2 29,-0.5 -0.967 71.8-173.1-114.9 131.6 14.8 28.5 3.1 15 20 A G E -bc 251 43B 0 235,-2.5 237,-1.9 -2,-0.5 2,-0.5 -0.908 23.7-123.1-126.5 148.6 16.9 30.6 5.5 16 21 A F E -bc 252 44B 0 27,-3.4 29,-3.3 -2,-0.3 2,-0.4 -0.782 22.3-142.3 -87.9 125.1 19.4 33.4 5.2 17 22 A G E -bc 253 45B 8 235,-1.6 237,-0.6 -2,-0.5 29,-0.1 -0.737 15.8-174.4 -88.2 129.0 22.9 32.7 6.7 18 23 A T + 0 0 0 27,-1.4 -1,-0.1 -2,-0.4 28,-0.1 0.575 39.2 118.7-104.4 -8.7 24.3 35.8 8.4 19 24 A Y + 0 0 43 26,-0.2 -2,-0.1 27,-0.0 32,-0.1 -0.331 29.2 165.2 -69.0 138.5 27.8 34.8 9.4 20 25 A A - 0 0 2 30,-0.2 9,-0.0 4,-0.1 -2,-0.0 -0.970 41.1-102.0-140.6 145.0 30.8 36.6 7.9 21 26 A P > - 0 0 13 0, 0.0 3,-2.3 0, 0.0 29,-0.0 -0.153 40.4 -99.0 -63.8 166.3 34.3 36.5 9.2 22 27 A P T 3 S+ 0 0 89 0, 0.0 4,-0.1 0, 0.0 28,-0.0 0.667 117.5 71.9 -67.9 -9.1 35.7 39.3 11.3 23 28 A E T 3 S+ 0 0 151 2,-0.1 3,-0.0 3,-0.0 0, 0.0 0.787 83.5 84.6 -69.1 -20.6 37.5 40.9 8.3 24 29 A V S < S- 0 0 36 -3,-2.3 5,-0.1 1,-0.1 -4,-0.1 -0.639 93.8-111.5 -83.8 123.5 34.0 41.9 7.1 25 30 A P > - 0 0 81 0, 0.0 3,-2.3 0, 0.0 4,-0.5 -0.304 21.2-121.7 -58.0 140.7 32.8 45.2 8.5 26 31 A R T >> S+ 0 0 60 1,-0.3 3,-0.9 2,-0.2 4,-0.6 0.800 107.7 66.4 -46.6 -38.3 29.9 44.8 10.9 27 32 A S H 3> S+ 0 0 76 1,-0.2 4,-1.6 2,-0.2 3,-0.3 0.703 85.0 72.4 -63.3 -22.2 27.7 47.2 8.8 28 33 A K H <> S+ 0 0 77 -3,-2.3 4,-2.7 1,-0.2 5,-0.3 0.934 89.8 59.0 -59.9 -41.6 27.7 44.6 5.9 29 34 A A H <> S+ 0 0 2 -3,-0.9 4,-1.9 -4,-0.5 -1,-0.2 0.848 104.2 52.6 -58.4 -32.9 25.3 42.3 7.9 30 35 A L H X S+ 0 0 41 -4,-0.6 4,-2.1 -3,-0.3 -1,-0.2 0.966 112.6 43.1 -64.2 -51.2 22.8 45.2 8.0 31 36 A E H X S+ 0 0 99 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.940 117.0 44.1 -62.5 -51.9 22.8 45.8 4.3 32 37 A V H X S+ 0 0 3 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.837 110.4 55.2 -72.7 -30.8 22.7 42.2 3.2 33 38 A T H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 0.918 108.5 47.9 -66.4 -43.3 20.0 41.2 5.7 34 39 A K H X S+ 0 0 69 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.922 113.3 49.3 -56.8 -44.9 17.7 43.9 4.3 35 40 A L H X S+ 0 0 25 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.917 108.6 53.3 -61.4 -44.8 18.6 42.7 0.7 36 41 A A H X>S+ 0 0 0 -4,-2.9 5,-2.6 2,-0.2 4,-0.9 0.925 111.6 45.1 -54.3 -46.0 17.8 39.0 1.8 37 42 A I H ><5S+ 0 0 2 -4,-2.2 3,-0.9 1,-0.2 -2,-0.2 0.940 111.6 52.1 -65.3 -43.3 14.4 40.1 3.1 38 43 A E H 3<5S+ 0 0 95 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.885 107.7 54.0 -57.5 -38.2 13.8 42.3 -0.1 39 44 A A H 3<5S- 0 0 13 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.667 130.3 -93.8 -73.0 -19.5 14.6 39.1 -2.2 40 45 A G T <<5S+ 0 0 38 -3,-0.9 -3,-0.2 -4,-0.9 2,-0.2 0.385 74.5 144.0 121.8 0.9 12.0 37.1 -0.3 41 46 A F < + 0 0 3 -5,-2.6 -1,-0.3 -6,-0.2 -26,-0.1 -0.480 15.9 172.0 -66.4 135.4 13.9 35.4 2.5 42 47 A R + 0 0 83 -28,-0.6 33,-3.5 -2,-0.2 2,-0.5 0.395 59.8 70.3-121.5 -1.4 11.7 35.1 5.7 43 48 A H E -cd 15 75B 1 -29,-0.5 -27,-3.4 31,-0.2 2,-0.4 -0.977 62.8-172.4-124.8 124.0 14.0 32.9 7.8 44 49 A I E -cd 16 76B 0 31,-2.8 33,-2.3 -2,-0.5 2,-0.6 -0.993 9.2-152.9-130.9 121.9 17.2 34.6 9.1 45 50 A D E +cd 17 77B 5 -29,-3.3 -27,-1.4 -2,-0.4 2,-0.2 -0.869 29.4 144.8-104.9 120.9 19.9 32.6 11.0 46 51 A S - 0 0 0 31,-2.1 2,-0.3 -2,-0.6 3,-0.1 -0.618 21.8-163.6-132.1-160.4 22.2 34.4 13.5 47 52 A A > - 0 0 0 31,-0.2 3,-1.2 -2,-0.2 5,-0.5 -0.916 39.6-106.4-179.4 150.0 23.9 33.6 16.9 48 53 A H G > S+ 0 0 65 31,-1.6 3,-1.6 -2,-0.3 5,-0.2 0.937 119.1 60.9 -49.9 -47.4 25.6 35.3 19.8 49 54 A L G 3 S+ 0 0 75 30,-0.3 -1,-0.2 1,-0.2 31,-0.0 0.715 91.7 66.3 -49.4 -30.5 28.9 34.0 18.3 50 55 A Y G < S- 0 0 31 -3,-1.2 -30,-0.2 1,-0.0 -1,-0.2 0.635 88.5-143.9 -80.0 -15.7 28.4 35.9 15.1 51 56 A N S < S+ 0 0 121 -3,-1.6 -3,-0.1 -4,-0.4 -2,-0.1 0.916 78.0 93.9 59.9 37.4 28.8 39.4 16.7 52 57 A N > + 0 0 1 -5,-0.5 4,-2.5 -4,-0.1 5,-0.2 0.208 37.6 111.5-143.2 12.5 26.2 40.8 14.2 53 58 A E H > S+ 0 0 8 1,-0.2 4,-2.6 -6,-0.2 5,-0.3 0.885 78.0 55.6 -66.6 -31.1 22.9 40.5 16.1 54 59 A E H > S+ 0 0 116 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.919 112.9 42.1 -59.9 -43.7 22.6 44.3 16.4 55 60 A Q H > S+ 0 0 40 2,-0.2 4,-2.6 3,-0.2 -2,-0.2 0.897 115.4 48.1 -73.4 -38.0 22.8 44.7 12.6 56 61 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.942 114.1 45.9 -70.8 -46.3 20.6 41.7 11.8 57 62 A G H X S+ 0 0 0 -4,-2.6 4,-3.1 -5,-0.2 5,-0.2 0.876 112.0 52.9 -58.2 -40.3 17.9 42.9 14.3 58 63 A L H X S+ 0 0 72 -4,-1.8 4,-2.6 -5,-0.3 -2,-0.2 0.924 108.0 50.9 -63.9 -43.3 18.2 46.4 12.9 59 64 A A H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.944 112.5 46.5 -54.5 -50.3 17.7 45.0 9.4 60 65 A I H X S+ 0 0 0 -4,-2.7 4,-1.5 2,-0.2 3,-0.4 0.951 113.8 47.2 -58.0 -51.3 14.6 43.2 10.5 61 66 A R H X S+ 0 0 84 -4,-3.1 4,-3.3 1,-0.2 -1,-0.2 0.875 110.3 53.2 -61.3 -38.1 13.2 46.2 12.4 62 67 A S H X S+ 0 0 32 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.849 108.0 49.6 -61.6 -36.8 13.9 48.5 9.4 63 68 A K H <>S+ 0 0 9 -4,-1.7 6,-1.5 -3,-0.4 5,-1.0 0.711 114.9 45.8 -80.5 -21.7 12.0 46.1 7.1 64 69 A I H ><5S+ 0 0 56 -4,-1.5 3,-1.6 4,-0.2 -2,-0.2 0.889 111.1 53.0 -72.7 -48.9 9.1 46.2 9.6 65 70 A A H 3<5S+ 0 0 86 -4,-3.3 -2,-0.2 1,-0.3 -3,-0.2 0.790 109.8 46.6 -60.5 -35.0 9.4 50.0 10.0 66 71 A D T 3<5S- 0 0 91 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.1 0.406 117.4-111.4 -90.9 3.5 9.1 50.6 6.2 67 72 A G T < 5S+ 0 0 62 -3,-1.6 -3,-0.2 2,-0.2 -2,-0.1 0.489 81.3 122.5 82.9 4.8 6.1 48.2 5.9 68 73 A S S > - 0 0 124 -2,-0.3 3,-2.3 1,-0.1 4,-0.6 -0.727 35.6-108.7-100.5 158.2 5.4 42.3 9.8 71 76 A R G >4 S+ 0 0 33 -2,-0.3 3,-1.9 1,-0.3 -1,-0.1 0.921 121.0 57.7 -49.7 -44.8 7.3 40.8 12.8 72 77 A E G 34 S+ 0 0 131 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.578 99.4 61.1 -69.5 -4.9 5.2 37.6 12.6 73 78 A D G <4 S+ 0 0 76 -3,-2.3 2,-0.4 2,-0.0 -1,-0.3 0.592 95.0 76.8 -89.1 -14.5 6.4 37.3 8.9 74 79 A I << - 0 0 3 -3,-1.9 2,-0.6 -4,-0.6 -31,-0.2 -0.792 64.6-157.9-100.7 138.1 10.0 36.9 10.0 75 80 A F E -d 43 0B 8 -33,-3.5 -31,-2.8 -2,-0.4 2,-0.5 -0.934 19.0-171.9-112.6 108.0 11.5 33.8 11.5 76 81 A Y E -d 44 0B 1 -2,-0.6 32,-1.8 -33,-0.2 31,-1.7 -0.891 4.0-166.5-110.1 129.6 14.6 34.8 13.5 77 82 A T E +de 45 108B 0 -33,-2.3 -31,-2.1 -2,-0.5 2,-0.3 -0.930 9.1 173.8-113.5 131.6 17.0 32.3 15.0 78 83 A S E - e 0 109B 0 30,-2.5 32,-1.6 -2,-0.5 2,-0.4 -0.816 17.8-140.0-123.2 177.2 19.7 32.9 17.6 79 84 A K E - e 0 110B 0 -2,-0.3 -31,-1.6 30,-0.2 2,-0.6 -0.994 13.7-120.8-142.9 144.3 21.9 30.5 19.4 80 85 A L E - e 0 111B 0 30,-3.3 32,-1.7 -2,-0.4 33,-0.4 -0.687 35.4-129.3 -82.4 116.9 23.3 29.9 22.8 81 86 A W > - 0 0 50 -2,-0.6 3,-1.9 31,-0.1 12,-0.1 -0.313 21.0-111.2 -71.7 156.4 27.1 29.9 22.7 82 87 A S G > S+ 0 0 1 1,-0.3 35,-2.6 2,-0.2 3,-0.6 0.500 112.7 66.4 -74.8 -12.2 29.0 27.0 24.4 83 88 A T G 3 S+ 0 0 34 33,-0.2 -1,-0.3 1,-0.2 3,-0.2 0.469 100.0 57.3 -74.3 -6.2 30.5 29.1 27.3 84 89 A F G < + 0 0 54 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.037 67.1 111.7-117.4 27.2 26.8 29.5 28.4 85 90 A H < + 0 0 2 -3,-0.6 -1,-0.1 32,-0.3 5,-0.1 0.760 45.3 104.1 -65.4 -31.9 25.7 25.9 28.9 86 91 A R S > S- 0 0 95 -3,-0.2 3,-2.3 1,-0.2 4,-0.5 -0.395 83.8-123.1 -57.9 130.7 25.4 26.1 32.7 87 92 A P G >> S+ 0 0 45 0, 0.0 3,-1.2 0, 0.0 4,-0.6 0.787 107.9 56.2 -53.8 -31.4 21.7 26.2 33.2 88 93 A E G 34 S+ 0 0 131 1,-0.3 -2,-0.1 2,-0.2 -3,-0.1 0.666 104.9 54.6 -79.0 -14.9 21.7 29.5 35.1 89 94 A L G <> S+ 0 0 54 -3,-2.3 4,-1.5 2,-0.1 -1,-0.3 0.584 90.3 80.3 -87.1 -6.8 23.6 31.2 32.2 90 95 A V H <> S+ 0 0 0 -3,-1.2 4,-2.1 -4,-0.5 5,-0.2 0.948 92.8 39.8 -74.8 -51.5 21.0 30.2 29.6 91 96 A R H X S+ 0 0 110 -4,-0.6 4,-3.2 1,-0.2 5,-0.3 0.921 114.6 52.9 -70.8 -39.5 18.2 32.8 30.0 92 97 A P H > S+ 0 0 68 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.895 109.0 50.1 -62.6 -32.4 20.5 35.7 30.6 93 98 A A H X S+ 0 0 11 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.885 113.4 46.3 -69.2 -36.0 22.4 34.8 27.3 94 99 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.943 111.3 51.4 -69.2 -42.7 19.0 34.7 25.5 95 100 A E H X S+ 0 0 85 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.910 109.6 51.6 -60.2 -41.9 18.0 38.0 27.1 96 101 A N H X S+ 0 0 73 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.909 108.2 49.3 -60.5 -46.9 21.2 39.5 26.0 97 102 A S H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.889 110.6 52.8 -56.1 -40.4 20.7 38.4 22.3 98 103 A L H X>S+ 0 0 12 -4,-2.5 5,-1.9 1,-0.2 4,-0.7 0.863 109.3 48.0 -65.6 -35.7 17.2 39.9 22.4 99 104 A K H <5S+ 0 0 56 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.875 110.1 51.8 -76.9 -33.8 18.5 43.2 23.7 100 105 A K H <5S+ 0 0 90 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.930 118.3 37.4 -60.6 -44.8 21.3 43.3 21.0 101 106 A A H <5S- 0 0 0 -4,-2.0 -1,-0.2 -5,-0.1 -40,-0.2 0.546 105.0-133.1 -81.0 -16.9 18.7 42.7 18.3 102 107 A Q T <5 + 0 0 124 -4,-0.7 2,-0.3 1,-0.2 -3,-0.2 0.848 58.5 137.7 55.7 43.4 16.1 44.8 20.0 103 108 A L < - 0 0 16 -5,-1.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.842 59.4-136.9-112.4 153.1 13.4 42.2 19.6 104 109 A D S S- 0 0 147 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.777 86.2 -1.3 -75.0 -27.9 10.8 41.0 22.1 105 110 A Y - 0 0 39 -7,-0.1 2,-0.4 38,-0.0 38,-0.2 -0.980 62.7-126.2-152.8 159.9 11.4 37.3 21.1 106 111 A V E - f 0 143B 0 36,-2.3 38,-2.1 -2,-0.3 39,-0.3 -0.881 17.5-139.9-101.3 150.8 13.3 35.0 18.9 107 112 A D E S+ 0 0 19 -31,-1.7 38,-1.0 -2,-0.4 2,-0.4 0.805 89.9 18.5 -72.0 -24.8 11.4 32.5 16.8 108 113 A L E -ef 77 145B 2 -32,-1.8 -30,-2.5 36,-0.2 2,-0.4 -0.994 60.7-170.5-153.7 127.0 14.1 29.9 17.5 109 114 A Y E -ef 78 146B 0 36,-1.7 38,-2.3 -2,-0.4 2,-0.4 -0.997 17.5-170.8-121.1 132.4 16.7 29.5 20.1 110 115 A L E -ef 79 147B 0 -32,-1.6 -30,-3.3 -2,-0.4 2,-0.9 -0.917 34.8-118.4-120.6 145.5 19.3 26.7 19.7 111 116 A I E -ef 80 148B 0 36,-1.8 38,-1.3 -2,-0.4 -30,-0.1 -0.777 35.9-146.2 -67.2 111.6 22.0 25.2 21.7 112 117 A H - 0 0 14 -32,-1.7 -1,-0.2 -2,-0.9 -31,-0.1 0.807 67.8 -13.6 -54.0 -40.2 24.8 26.2 19.3 113 118 A S - 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0 0 39 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.875 28.9-108.5-130.4 160.8 23.6 26.9 -11.0 235 252 A P H > S+ 0 0 32 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.907 120.4 54.1 -56.9 -38.0 25.5 24.4 -8.8 236 253 A A H > S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.928 107.8 48.3 -57.1 -47.5 24.3 26.4 -5.8 237 254 A L H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.889 109.9 52.2 -67.1 -38.1 20.7 26.2 -6.7 238 255 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.946 109.8 49.6 -60.1 -50.1 21.0 22.4 -7.3 239 256 A A H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.864 114.1 44.8 -55.2 -40.0 22.6 22.0 -3.8 240 257 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 3,-0.5 0.924 112.5 51.2 -68.5 -46.8 19.8 24.0 -2.2 241 258 A R H X S+ 0 0 37 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.889 103.0 60.3 -61.4 -39.3 17.0 22.2 -4.2 242 259 A Y H X S+ 0 0 0 -4,-2.5 4,-0.9 -5,-0.2 -1,-0.2 0.897 105.1 48.6 -50.9 -45.3 18.4 18.8 -3.2 243 260 A Q H ><>S+ 0 0 0 -4,-0.9 5,-2.7 -3,-0.5 3,-1.1 0.952 108.7 52.3 -67.3 -48.2 17.9 19.7 0.5 244 261 A L H ><5S+ 0 0 29 -4,-1.9 3,-1.7 1,-0.3 -1,-0.2 0.912 107.9 52.5 -53.5 -40.6 14.3 20.8 0.0 245 262 A Q H 3<5S+ 0 0 66 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.710 106.9 52.2 -75.9 -16.7 13.4 17.6 -1.8 246 263 A R T <<5S- 0 0 21 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.342 122.4-104.9 -96.0 6.3 14.8 15.5 1.1 247 264 A G T < 5S+ 0 0 52 -3,-1.7 2,-0.4 -4,-0.3 -51,-0.4 0.673 76.2 140.0 82.8 18.7 12.6 17.4 3.6 248 265 A V < - 0 0 2 -5,-2.7 2,-0.4 -6,-0.2 -1,-0.3 -0.830 53.8-131.4 -99.0 133.8 15.6 19.4 4.9 249 266 A V E - i 0 197B 3 -53,-2.1 -51,-3.3 -2,-0.4 2,-0.5 -0.684 33.1-151.7 -75.7 130.3 15.3 23.1 5.8 250 267 A V E -bi 14 198B 0 -237,-2.4 -235,-2.5 -2,-0.4 2,-0.2 -0.913 12.5-155.8-121.4 130.7 18.3 24.7 4.1 251 268 A L E -b 15 0B 9 -53,-2.4 2,-0.3 -2,-0.5 -50,-0.3 -0.650 8.6-168.2 -91.2 159.9 20.3 27.8 5.0 252 269 A A E -b 16 0B 3 -237,-1.9 -235,-1.6 -2,-0.2 2,-0.5 -0.875 5.5-157.8-149.7 114.1 22.2 29.8 2.4 253 270 A K E +b 17 0B 75 -2,-0.3 2,-0.3 -237,-0.2 -235,-0.1 -0.794 24.0 153.8 -88.0 133.1 24.8 32.6 3.3 254 271 A S - 0 0 8 -237,-0.6 -218,-0.1 -2,-0.5 -2,-0.1 -0.915 28.1-173.8-148.9 139.8 25.6 35.2 0.6 255 272 A Y + 0 0 41 -2,-0.3 2,-0.5 -222,-0.0 -223,-0.0 0.066 66.2 97.4-105.7 18.4 26.9 38.8 1.1 256 273 A N S > S- 0 0 53 1,-0.1 4,-2.7 -224,-0.1 5,-0.2 -0.938 71.0-141.1-114.6 126.1 26.5 39.4 -2.7 257 274 A E H > S+ 0 0 104 -2,-0.5 4,-1.8 1,-0.2 5,-0.2 0.864 100.3 45.5 -53.8 -43.5 23.4 41.1 -4.0 258 275 A Q H > S+ 0 0 67 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.921 114.9 46.3 -70.5 -44.4 23.1 39.0 -7.2 259 276 A R H > S+ 0 0 136 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.905 109.0 55.5 -67.1 -35.5 23.7 35.6 -5.4 260 277 A I H X S+ 0 0 0 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.938 112.7 43.1 -59.2 -46.0 21.2 36.6 -2.6 261 278 A R H >< S+ 0 0 122 -4,-1.8 3,-0.6 -5,-0.2 4,-0.3 0.879 113.1 53.0 -64.8 -41.0 18.5 37.2 -5.3 262 279 A Q H >< S+ 0 0 44 -4,-2.7 3,-2.1 1,-0.2 -2,-0.2 0.891 98.2 64.6 -61.5 -38.9 19.5 34.0 -7.2 263 280 A N H >< S+ 0 0 3 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.781 90.7 63.0 -63.0 -30.3 19.2 31.7 -4.1 264 281 A V G X< S+ 0 0 31 -4,-0.7 3,-1.3 -3,-0.6 -1,-0.3 0.647 83.4 80.7 -71.7 -11.2 15.4 32.3 -3.8 265 282 A Q G X + 0 0 62 -3,-2.1 3,-2.7 -4,-0.3 4,-0.3 0.571 63.1 93.9 -63.5 -9.0 15.1 30.6 -7.2 266 283 A V G X S+ 0 0 0 -3,-1.7 3,-0.7 1,-0.3 -1,-0.2 0.843 81.4 56.7 -54.1 -32.9 15.4 27.3 -5.4 267 284 A F G < S+ 0 0 92 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.547 93.4 72.0 -72.1 -8.2 11.5 27.4 -5.3 268 285 A E G < S+ 0 0 118 -3,-2.7 2,-0.3 -4,-0.1 -1,-0.2 0.533 100.7 21.5 -92.4 -5.8 11.3 27.6 -9.2 269 286 A F < - 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0 0 21 -3,-2.1 3,-0.9 -6,-0.2 4,-0.3 -0.379 43.3-142.9 -43.1 123.4 32.8 16.3 19.5 301 318 A P G > S+ 0 0 6 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.703 89.2 64.1 -73.9 -22.1 29.8 15.0 17.6 302 319 A Y G 3 S+ 0 0 36 1,-0.2 -2,-0.1 2,-0.1 -7,-0.0 0.568 80.6 76.1 -85.9 -5.5 31.7 13.4 14.7 303 320 A S G < 0 0 90 -3,-0.9 -1,-0.2 1,-0.1 -3,-0.0 0.782 360.0 360.0 -65.7 -19.6 33.4 10.8 16.8 304 321 A D < 0 0 162 -3,-0.9 -2,-0.1 -4,-0.3 -1,-0.1 0.243 360.0 360.0 101.3 360.0 29.8 9.3 16.6