==== 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 28-FEB-01 1I5R . COMPND 2 MOLECULE: TYPE 1 17 BETA-HYDROXYSTEROID DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.QIU,R.L.CAMPBELL,P.BOIVIN,D.POIRIER,S.-X.LIN . 285 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13563.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 20 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 41.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 0 0 1 0 0 3 0 2 1 1 0 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 141 0, 0.0 2,-0.3 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0-169.6 30.1 -0.2 21.7 2 2 A R - 0 0 90 29,-0.1 2,-0.6 0, 0.0 28,-0.2 -0.973 360.0 -84.3-159.8 163.8 28.7 1.1 18.4 3 3 A T E -a 30 0A 48 26,-4.2 28,-2.9 -2,-0.3 2,-0.6 -0.718 47.8-140.5 -77.8 116.4 25.5 2.1 16.7 4 4 A V E -a 31 0A 0 -2,-0.6 82,-2.6 26,-0.2 81,-2.0 -0.750 22.6-172.8 -86.6 122.1 24.0 -1.2 15.6 5 5 A V E -ab 32 86A 0 26,-3.5 28,-3.8 -2,-0.6 2,-0.5 -0.951 11.3-170.7-117.9 134.9 22.5 -0.9 12.2 6 6 A L E -ab 33 87A 0 80,-2.8 82,-3.3 -2,-0.4 2,-0.4 -0.997 10.8-173.6-126.6 125.0 20.5 -3.5 10.5 7 7 A I E -ab 34 88A 0 26,-2.6 28,-2.7 -2,-0.5 3,-0.3 -0.971 13.0-145.1-121.3 137.7 19.6 -2.9 6.9 8 8 A T S S+ 0 0 2 80,-2.7 82,-0.2 -2,-0.4 28,-0.1 -0.703 78.0 26.0 -97.8 152.8 17.3 -4.9 4.6 9 9 A G + 0 0 19 55,-0.4 6,-0.4 -2,-0.3 3,-0.4 0.951 66.1 153.8 67.0 55.0 17.9 -5.3 0.9 10 10 A C + 0 0 0 25,-2.7 26,-0.2 -3,-0.3 -1,-0.1 0.370 40.7 99.3 -97.4 12.1 21.7 -4.8 0.9 11 11 A S S S- 0 0 22 24,-0.2 2,-0.3 33,-0.1 33,-0.2 0.800 97.6 -19.9 -68.7 -26.5 22.4 -6.8 -2.2 12 12 A S S >> S+ 0 0 12 -3,-0.4 4,-1.8 32,-0.1 3,-0.6 -0.903 104.3 22.3-161.0-177.5 22.6 -3.7 -4.3 13 13 A G H 3> S- 0 0 0 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.031 116.3 -5.5 52.5-140.0 21.7 -0.1 -4.7 14 14 A I H 3> S+ 0 0 18 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.893 134.8 51.4 -55.4 -47.6 20.9 2.0 -1.7 15 15 A G H <> S+ 0 0 0 -3,-0.6 4,-2.7 -6,-0.4 -5,-0.2 0.923 112.8 45.6 -60.2 -46.7 21.1 -0.8 0.8 16 16 A L H X S+ 0 0 2 -4,-1.8 4,-2.3 -7,-0.3 5,-0.3 0.951 116.9 44.3 -60.1 -51.1 24.5 -1.9 -0.4 17 17 A H H X S+ 0 0 34 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.884 114.6 49.0 -63.9 -38.9 25.9 1.6 -0.5 18 18 A L H X S+ 0 0 0 -4,-3.3 4,-3.0 -5,-0.3 5,-0.3 0.932 109.0 52.8 -65.1 -46.2 24.4 2.5 2.8 19 19 A A H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.2 -2,-0.2 0.925 115.9 39.1 -53.6 -49.8 25.7 -0.6 4.5 20 20 A V H X S+ 0 0 1 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.879 112.7 56.3 -74.1 -33.4 29.2 0.0 3.3 21 21 A R H < S+ 0 0 56 -4,-2.7 4,-0.3 -5,-0.3 -1,-0.2 0.942 115.0 39.4 -58.3 -47.9 29.0 3.7 3.9 22 22 A L H >< S+ 0 0 0 -4,-3.0 3,-1.3 2,-0.2 8,-0.5 0.948 116.5 48.9 -67.0 -44.3 28.1 3.0 7.5 23 23 A A H 3< S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.870 115.9 44.1 -66.8 -34.0 30.5 0.2 8.0 24 24 A S T 3< S+ 0 0 24 -4,-2.9 -1,-0.3 30,-0.2 -2,-0.2 0.355 79.2 139.6 -91.9 4.5 33.3 2.2 6.6 25 25 A D X - 0 0 10 -3,-1.3 3,-2.9 -4,-0.3 5,-0.2 -0.273 59.8-129.2 -50.5 129.0 32.5 5.3 8.4 26 26 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.850 108.4 57.9 -49.4 -38.9 35.8 6.8 9.6 27 27 A S T 3 S- 0 0 64 1,-0.1 -2,-0.1 2,-0.0 -3,-0.0 0.619 97.2-141.5 -66.8 -17.5 34.5 7.1 13.1 28 28 A Q < + 0 0 122 -3,-2.9 -1,-0.1 1,-0.1 -5,-0.1 0.840 56.8 138.8 56.2 35.9 33.8 3.3 13.2 29 29 A S + 0 0 39 -7,-0.1 -26,-4.2 -27,-0.1 2,-0.4 0.615 47.9 76.4 -85.7 -14.3 30.6 4.2 15.1 30 30 A F E -a 3 0A 4 -8,-0.5 2,-0.6 -28,-0.2 -26,-0.2 -0.827 54.1-167.0-112.7 142.1 28.5 1.7 13.2 31 31 A K E -a 4 0A 12 -28,-2.9 -26,-3.5 -2,-0.4 2,-0.5 -0.995 27.4-155.3-116.4 115.2 28.1 -2.0 13.3 32 32 A V E -ac 5 59A 0 26,-3.2 28,-2.8 -2,-0.6 2,-0.9 -0.894 23.6-166.7-110.8 129.2 26.2 -3.0 10.3 33 33 A Y E -ac 6 60A 5 -28,-3.8 -26,-2.6 -2,-0.5 2,-0.9 -0.921 18.0-165.4-101.0 96.5 24.1 -6.0 9.7 34 34 A A E -ac 7 61A 0 26,-2.8 28,-1.6 -2,-0.9 2,-0.3 -0.819 12.7-163.2 -85.3 107.5 23.8 -5.8 6.0 35 35 A T E - c 0 62A 0 -28,-2.7 -25,-2.7 -2,-0.9 2,-0.3 -0.716 8.7-170.7-102.4 147.8 21.0 -8.2 5.3 36 36 A L E - c 0 63A 0 26,-2.3 28,-3.3 -2,-0.3 3,-0.2 -0.985 31.7-129.2-134.6 148.2 20.2 -9.7 2.0 37 37 A R S S+ 0 0 100 -2,-0.3 2,-0.4 1,-0.3 28,-0.1 0.893 105.7 21.9 -61.9 -43.8 17.3 -11.7 0.7 38 38 A D S > S- 0 0 52 26,-0.1 3,-2.2 1,-0.1 -1,-0.3 -0.979 70.5-148.9-126.9 121.0 19.7 -14.2 -0.7 39 39 A L G > S+ 0 0 66 -2,-0.4 3,-2.3 1,-0.3 -1,-0.1 0.772 93.5 76.0 -61.6 -20.7 23.3 -14.4 0.7 40 40 A K G 3 S+ 0 0 187 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.681 91.0 56.9 -62.6 -14.6 24.4 -15.5 -2.8 41 41 A T G X S+ 0 0 49 -3,-2.2 3,-0.6 1,-0.2 4,-0.5 0.410 76.9 97.4 -97.9 10.4 24.1 -11.8 -3.8 42 42 A Q T <> + 0 0 54 -3,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.434 55.9 92.3 -78.3 -1.7 26.4 -10.5 -1.1 43 43 A G H 3> S+ 0 0 44 -3,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.937 85.4 45.8 -58.5 -51.3 29.4 -10.4 -3.4 44 44 A R H <> S+ 0 0 104 -3,-0.6 4,-3.5 1,-0.2 5,-0.3 0.895 111.2 55.1 -62.9 -36.0 29.0 -6.7 -4.5 45 45 A L H > S+ 0 0 0 -4,-0.5 4,-2.9 1,-0.2 -1,-0.2 0.953 112.2 41.9 -59.8 -45.8 28.4 -5.8 -0.8 46 46 A W H X S+ 0 0 96 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.831 114.0 52.3 -70.7 -32.7 31.8 -7.4 0.1 47 47 A E H X S+ 0 0 136 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.942 114.6 42.5 -65.9 -44.7 33.5 -6.0 -2.9 48 48 A A H X S+ 0 0 22 -4,-3.5 4,-2.0 2,-0.2 -2,-0.2 0.901 112.7 53.8 -66.9 -39.9 32.2 -2.5 -1.9 49 49 A A H <>S+ 0 0 2 -4,-2.9 5,-2.9 -5,-0.3 -1,-0.2 0.922 111.4 44.9 -59.2 -47.1 33.0 -3.1 1.7 50 50 A R H ><5S+ 0 0 163 -4,-2.4 3,-1.5 3,-0.2 -1,-0.2 0.890 109.0 56.8 -64.6 -38.0 36.6 -4.0 0.8 51 51 A A H 3<5S+ 0 0 83 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.874 112.6 41.6 -62.2 -36.1 36.8 -1.0 -1.5 52 52 A L T 3<5S- 0 0 84 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.274 112.7-122.1 -92.8 6.0 35.9 1.2 1.4 53 53 A A T < 5 - 0 0 60 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.906 34.0-165.5 54.0 46.5 38.1 -0.7 3.8 54 54 A C < - 0 0 15 -5,-2.9 -1,-0.2 -6,-0.1 -30,-0.2 -0.516 27.2-112.7 -62.4 124.1 35.3 -1.6 6.1 55 55 A P > - 0 0 38 0, 0.0 3,-2.7 0, 0.0 4,-0.5 -0.228 40.3 -87.8 -57.8 146.5 37.1 -2.7 9.3 56 56 A P T 3 S+ 0 0 136 0, 0.0 4,-0.1 0, 0.0 0, 0.0 -0.314 118.1 20.5 -56.8 128.4 36.6 -6.4 10.1 57 57 A G T 3 S+ 0 0 26 2,-0.5 3,-0.1 -3,-0.1 -25,-0.1 0.354 96.8 98.2 92.2 -5.8 33.5 -6.8 12.2 58 58 A S S < S+ 0 0 4 -3,-2.7 -26,-3.2 1,-0.2 2,-0.4 0.690 89.9 37.1 -81.2 -23.8 32.1 -3.4 11.0 59 59 A L E +c 32 0A 4 -4,-0.5 -2,-0.5 -28,-0.2 2,-0.4 -0.997 64.3 172.4-136.2 128.6 29.9 -5.3 8.5 60 60 A E E -c 33 0A 78 -28,-2.8 -26,-2.8 -2,-0.4 2,-0.4 -0.991 22.3-139.9-134.8 137.3 28.2 -8.6 8.8 61 61 A T E -c 34 0A 23 -2,-0.4 2,-0.4 -28,-0.2 -26,-0.2 -0.810 19.9-179.3-101.1 141.1 25.9 -10.1 6.3 62 62 A L E -c 35 0A 5 -28,-1.6 -26,-2.3 -2,-0.4 2,-0.4 -0.965 32.6-115.1-131.0 149.3 22.8 -11.9 7.3 63 63 A Q E +c 36 0A 68 -2,-0.4 2,-0.3 -28,-0.2 -26,-0.2 -0.686 43.7 165.3 -79.1 135.4 20.2 -13.6 5.2 64 64 A L - 0 0 2 -28,-3.3 2,-0.7 -2,-0.4 -55,-0.4 -0.744 17.6-173.9-158.0 103.7 16.9 -11.7 5.7 65 65 A D > - 0 0 20 -2,-0.3 3,-2.2 3,-0.2 7,-0.4 -0.921 15.9-153.1 -99.9 113.6 14.1 -12.2 3.3 66 66 A V T 3 S+ 0 0 3 -2,-0.7 54,-0.2 1,-0.3 -1,-0.1 0.578 91.1 68.1 -68.9 -5.1 11.5 -9.7 4.4 67 67 A R T 3 S+ 0 0 88 1,-0.2 2,-0.6 53,-0.1 -1,-0.3 0.609 96.0 64.5 -80.1 -15.0 8.8 -11.9 2.9 68 68 A D X> - 0 0 68 -3,-2.2 4,-2.5 1,-0.1 3,-0.5 -0.893 62.3-165.8-119.0 109.3 9.5 -14.4 5.6 69 69 A S H 3> S+ 0 0 71 -2,-0.6 4,-3.1 1,-0.3 -1,-0.1 0.800 95.2 57.9 -60.5 -29.1 8.9 -13.5 9.3 70 70 A K H 3> S+ 0 0 159 2,-0.2 4,-2.9 1,-0.2 -1,-0.3 0.904 107.2 46.9 -66.6 -39.7 11.0 -16.5 10.2 71 71 A S H <> S+ 0 0 5 -3,-0.5 4,-2.6 -6,-0.3 5,-0.2 0.902 112.7 49.7 -66.3 -42.7 13.9 -15.0 8.3 72 72 A V H X S+ 0 0 2 -4,-2.5 4,-2.5 -7,-0.4 -2,-0.2 0.968 114.0 45.2 -57.9 -50.8 13.3 -11.7 9.9 73 73 A A H X S+ 0 0 22 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.899 112.2 51.3 -63.5 -39.7 13.2 -13.3 13.3 74 74 A A H X S+ 0 0 46 -4,-2.9 4,-1.2 1,-0.2 -1,-0.2 0.899 111.5 47.2 -65.2 -40.1 16.3 -15.4 12.6 75 75 A A H >< S+ 0 0 3 -4,-2.6 3,-0.5 2,-0.2 4,-0.5 0.929 110.2 52.7 -65.9 -42.6 18.3 -12.3 11.4 76 76 A R H >< S+ 0 0 104 -4,-2.5 3,-1.4 1,-0.3 -2,-0.2 0.920 107.2 52.6 -58.1 -41.8 17.1 -10.4 14.5 77 77 A E H 3< S+ 0 0 144 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.778 102.2 60.6 -64.4 -28.1 18.4 -13.3 16.7 78 78 A R T << S+ 0 0 155 -4,-1.2 2,-1.5 -3,-0.5 -1,-0.3 0.538 73.3 104.7 -78.4 -8.9 21.8 -13.0 14.9 79 79 A V X - 0 0 7 -3,-1.4 3,-2.0 -4,-0.5 4,-0.1 -0.637 57.5-167.8 -75.0 95.6 22.2 -9.4 16.1 80 80 A T T 3 S+ 0 0 115 -2,-1.5 -1,-0.2 1,-0.3 -2,-0.0 0.824 80.2 65.1 -59.0 -31.4 24.8 -10.3 18.7 81 81 A E T 3 S- 0 0 56 2,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.623 103.3-131.9 -64.8 -18.7 24.5 -6.9 20.4 82 82 A G S < S+ 0 0 57 -3,-2.0 2,-0.3 -6,-0.2 -2,-0.1 0.742 77.8 69.9 72.9 22.5 20.9 -7.8 21.3 83 83 A R - 0 0 67 -4,-0.1 2,-0.5 -7,-0.1 -2,-0.2 -0.974 65.4-146.4-164.8 151.3 19.8 -4.5 20.0 84 84 A V - 0 0 5 -2,-0.3 3,-0.2 41,-0.2 -79,-0.2 -0.995 11.5-178.3-125.1 117.8 19.3 -2.6 16.8 85 85 A D S S+ 0 0 29 -81,-2.0 51,-2.9 -2,-0.5 2,-0.4 0.802 79.3 28.3 -82.2 -35.9 19.9 1.1 17.1 86 86 A V E -bd 5 136A 5 -82,-2.6 -80,-2.8 49,-0.2 2,-0.5 -0.976 67.5-169.9-132.9 117.2 19.1 1.8 13.5 87 87 A L E -bd 6 137A 0 49,-3.3 51,-3.2 -2,-0.4 2,-0.6 -0.949 6.7-164.4-107.5 124.1 16.8 -0.3 11.5 88 88 A V E -bd 7 138A 0 -82,-3.3 -80,-2.7 -2,-0.5 2,-1.0 -0.962 4.8-162.3-115.3 110.7 16.8 0.5 7.8 89 89 A C E + d 0 139A 2 49,-3.2 51,-2.8 -2,-0.6 -80,-0.1 -0.846 39.0 136.3 -92.4 99.5 13.9 -1.0 5.9 90 90 A N + 0 0 23 -2,-1.0 -1,-0.2 -82,-0.2 -75,-0.2 0.464 22.7 122.0-122.5 -14.8 15.2 -0.8 2.4 91 91 A A + 0 0 17 -3,-0.2 2,-0.3 22,-0.1 27,-0.1 -0.280 41.8 151.1 -52.7 133.0 14.2 -4.2 1.0 92 92 A G - 0 0 48 25,-0.1 2,-0.3 26,-0.0 18,-0.1 -0.998 38.5-144.3-164.0 162.2 12.0 -3.5 -2.0 93 93 A L - 0 0 55 -2,-0.3 2,-0.3 17,-0.3 21,-0.0 -0.933 14.9-145.1-126.1 150.3 10.7 -4.6 -5.3 94 94 A G - 0 0 25 -2,-0.3 2,-0.3 2,-0.0 100,-0.1 -0.722 11.4-171.6-106.8 166.2 9.9 -2.6 -8.4 95 95 A L + 0 0 12 -2,-0.3 60,-0.7 15,-0.0 2,-0.4 -0.829 8.2 177.7-160.7 113.2 7.0 -3.4 -10.7 96 96 A L + 0 0 21 -2,-0.3 56,-0.2 98,-0.3 55,-0.1 -0.986 30.6 70.2-125.6 135.3 6.7 -1.6 -13.9 97 97 A G S S- 0 0 1 54,-2.9 56,-0.3 -2,-0.4 5,-0.1 -0.744 85.5 -40.0 147.7 167.9 4.1 -2.1 -16.7 98 98 A P >> - 0 0 2 0, 0.0 3,-1.8 0, 0.0 4,-0.7 -0.381 59.0-122.5 -54.2 134.5 0.5 -1.7 -17.6 99 99 A L G >4 S+ 0 0 91 1,-0.3 3,-1.7 2,-0.2 8,-0.1 0.911 112.3 51.9 -49.0 -46.6 -1.5 -2.8 -14.6 100 100 A E G 34 S+ 0 0 105 1,-0.3 -1,-0.3 3,-0.0 107,-0.0 0.690 105.6 56.3 -67.6 -14.9 -3.3 -5.5 -16.6 101 101 A A G <4 S+ 0 0 14 -3,-1.8 2,-0.4 2,-0.1 -1,-0.3 0.515 86.1 101.0 -91.5 -9.6 0.1 -6.9 -17.8 102 102 A L S << S- 0 0 24 -3,-1.7 2,-0.1 -4,-0.7 -5,-0.1 -0.665 78.8-119.0 -81.5 134.6 1.3 -7.3 -14.3 103 103 A G > - 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0 0 67 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.488 40.1-111.4 -88.7 161.8 -3.7 -3.0 -25.6 209 209 A I H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.796 116.5 53.1 -62.9 -31.5 -1.5 -1.3 -28.3 210 210 A H H > S+ 0 0 137 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.936 111.5 44.2 -71.8 -45.6 -2.4 2.2 -26.9 211 211 A T H > S+ 0 0 33 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.922 113.7 52.1 -61.9 -42.2 -1.4 1.4 -23.4 212 212 A F H X S+ 0 0 47 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.931 109.1 49.8 -59.8 -44.1 1.7 -0.3 -24.8 213 213 A H H X S+ 0 0 93 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.935 111.4 48.4 -58.7 -45.5 2.5 2.9 -26.7 214 214 A R H X S+ 0 0 93 -4,-2.7 4,-2.9 2,-0.2 -1,-0.2 0.856 107.8 56.2 -63.6 -36.8 2.0 4.9 -23.6 215 215 A F H X S+ 0 0 8 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.948 107.0 49.0 -60.3 -45.0 4.3 2.5 -21.7 216 216 A Y H X S+ 0 0 155 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.932 111.4 49.9 -56.1 -49.5 7.0 3.1 -24.3 217 217 A Q H X S+ 0 0 46 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.909 111.2 48.6 -57.1 -45.5 6.4 6.9 -23.8 218 218 A Y H X S+ 0 0 15 -4,-2.9 4,-3.9 2,-0.2 5,-0.2 0.945 111.3 50.1 -59.7 -47.1 6.7 6.4 -20.0 219 219 A L H X S+ 0 0 56 -4,-3.1 4,-3.0 2,-0.2 -2,-0.2 0.941 111.9 47.7 -58.2 -44.8 9.8 4.4 -20.4 220 220 A A H X S+ 0 0 41 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.933 114.8 46.8 -61.1 -43.6 11.3 7.0 -22.7 221 221 A H H X S+ 0 0 31 -4,-2.8 4,-2.8 -5,-0.2 -2,-0.2 0.945 112.1 49.9 -61.5 -48.8 10.3 9.7 -20.1 222 222 A S H X S+ 0 0 22 -4,-3.9 4,-3.0 1,-0.2 5,-0.3 0.912 107.7 53.8 -59.4 -43.5 11.7 7.6 -17.2 223 223 A K H X S+ 0 0 138 -4,-3.0 4,-3.1 -5,-0.2 -1,-0.2 0.914 110.7 47.5 -56.4 -43.1 15.0 7.2 -19.0 224 224 A Q H X S+ 0 0 68 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.933 110.2 51.4 -65.3 -43.7 15.2 11.0 -19.4 225 225 A V H X S+ 0 0 25 -4,-2.8 4,-3.0 2,-0.2 5,-0.4 0.923 114.7 43.3 -60.2 -44.2 14.3 11.5 -15.8 226 226 A F H X S+ 0 0 82 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.952 112.0 52.9 -65.0 -46.4 17.0 9.1 -14.7 227 227 A R H < S+ 0 0 162 -4,-3.1 -2,-0.2 -5,-0.3 -1,-0.2 0.869 123.0 30.8 -56.3 -36.5 19.5 10.5 -17.2 228 228 A E H < S+ 0 0 116 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.738 136.0 19.5 -94.5 -27.6 18.8 14.0 -15.8 229 229 A A H < S+ 0 0 16 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.483 78.0 127.4-126.1 -7.2 18.0 13.4 -12.1 230 230 A A < - 0 0 16 -4,-2.6 -42,-0.3 -5,-0.4 2,-0.2 -0.357 47.9-147.5 -59.5 131.7 19.3 10.0 -11.1 231 231 A Q B -g 188 0B 20 -44,-2.4 -42,-3.2 -2,-0.1 -2,-0.1 -0.668 19.8-103.7 -96.5 153.6 21.4 10.5 -8.0 232 232 A N >> - 0 0 94 -2,-0.2 4,-1.9 -44,-0.2 3,-0.6 -0.514 29.8-121.9 -68.4 147.8 24.4 8.4 -7.1 233 233 A P H 3> S+ 0 0 8 0, 0.0 4,-3.8 0, 0.0 5,-0.3 0.819 112.1 62.4 -61.8 -28.5 23.6 5.9 -4.3 234 234 A E H 3> S+ 0 0 109 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.913 104.2 46.1 -64.7 -40.0 26.4 7.5 -2.2 235 235 A E H <> S+ 0 0 108 -3,-0.6 4,-0.9 2,-0.2 -1,-0.2 0.933 116.9 44.8 -67.4 -43.3 24.5 10.8 -2.2 236 236 A V H >X S+ 0 0 0 -4,-1.9 4,-1.1 1,-0.2 3,-1.0 0.935 110.3 53.6 -65.5 -44.6 21.3 9.0 -1.3 237 237 A A H 3X S+ 0 0 1 -4,-3.8 4,-1.9 1,-0.3 3,-0.5 0.888 102.8 59.7 -57.5 -36.9 22.9 6.8 1.3 238 238 A E H 3X S+ 0 0 69 -4,-1.8 4,-2.8 -5,-0.3 -1,-0.3 0.846 96.3 60.7 -63.6 -29.5 24.3 10.0 2.9 239 239 A V H S+ 0 0 128 -2,-0.3 3,-1.1 1,-0.2 -1,-0.0 0.340 73.4 105.2-103.9 4.6 13.9 18.6 -3.9 258 258 A R T 3 S+ 0 0 117 1,-0.3 4,-0.3 2,-0.1 -1,-0.2 0.774 84.8 38.5 -53.7 -38.1 13.6 18.2 -7.6 259 259 A F T 3> S+ 0 0 20 -3,-0.2 4,-2.7 1,-0.1 -1,-0.3 0.540 85.9 97.6 -97.8 -2.0 10.1 16.8 -7.3 260 260 A L H <> S+ 0 0 37 -3,-1.1 4,-3.3 1,-0.2 5,-0.2 0.897 83.1 54.2 -52.1 -48.5 8.8 19.0 -4.5 261 261 A P H > S+ 0 0 86 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.933 110.2 44.0 -51.7 -54.8 7.1 21.3 -7.0 262 262 A L H > S+ 0 0 29 -4,-0.3 4,-0.7 1,-0.2 -2,-0.2 0.892 116.3 50.6 -57.2 -40.5 5.1 18.4 -8.7 263 263 A L H >X S+ 0 0 26 -4,-2.7 3,-1.0 2,-0.2 4,-0.8 0.892 103.9 55.6 -62.5 -43.2 4.4 17.2 -5.1 264 264 A R H >X S+ 0 0 173 -4,-3.3 4,-2.6 1,-0.3 3,-0.7 0.897 99.9 63.4 -57.8 -39.8 3.2 20.7 -4.0 265 265 A M H 3X S+ 0 0 57 -4,-1.9 4,-1.3 -5,-0.2 10,-0.3 0.814 93.6 62.0 -54.4 -34.8 0.7 20.5 -6.9 266 266 A R H << S+ 0 0 95 -3,-1.0 6,-0.3 -4,-0.7 -1,-0.2 0.881 111.5 35.4 -63.1 -41.8 -1.0 17.5 -5.3 267 267 A L H << S+ 0 0 146 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.848 107.8 64.9 -83.5 -28.5 -2.0 19.4 -2.1 268 268 A D H < S+ 0 0 122 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.880 118.7 30.2 -54.9 -34.3 -2.7 22.6 -4.0 269 269 A D >< + 0 0 19 -4,-1.3 3,-2.3 -5,-0.2 6,-0.3 -0.750 66.4 179.8-129.6 92.0 -5.4 20.4 -5.6 270 270 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.785 81.8 71.0 -62.3 -19.6 -6.8 17.7 -3.4 271 271 A S T 3 S- 0 0 90 1,-0.1 -4,-0.1 -4,-0.1 -5,-0.1 0.674 101.6-136.8 -66.8 -20.4 -9.1 16.7 -6.3 272 272 A G S <> S+ 0 0 24 -3,-2.3 4,-2.8 -6,-0.3 5,-0.2 0.295 72.0 116.8 80.8 -4.1 -5.9 15.4 -7.8 273 273 A S H > S+ 0 0 56 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.867 72.3 51.9 -62.8 -41.2 -6.8 16.8 -11.2 274 274 A N H > S+ 0 0 83 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.947 113.4 43.8 -62.7 -48.1 -3.9 19.2 -11.4 275 275 A Y H > S+ 0 0 16 -6,-0.3 4,-3.5 -10,-0.3 5,-0.4 0.945 114.5 48.9 -61.4 -52.1 -1.4 16.5 -10.6 276 276 A V H X S+ 0 0 94 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.929 116.1 43.4 -54.1 -47.7 -3.0 14.0 -13.0 277 277 A T H X S+ 0 0 83 -4,-2.8 4,-2.4 -5,-0.2 5,-0.2 0.950 117.1 45.9 -63.7 -47.4 -3.1 16.5 -15.8 278 278 A A H X S+ 0 0 24 -4,-3.1 4,-2.9 -5,-0.3 -2,-0.2 0.900 115.8 45.2 -62.5 -44.7 0.4 17.8 -15.1 279 279 A M H X S+ 0 0 7 -4,-3.5 4,-3.4 -5,-0.2 5,-0.4 0.901 110.2 54.2 -70.0 -36.3 2.0 14.4 -14.7 280 280 A H H X S+ 0 0 84 -4,-2.5 4,-3.4 -5,-0.4 -2,-0.2 0.959 114.9 41.2 -59.8 -46.9 0.2 13.1 -17.8 281 281 A R H X S+ 0 0 162 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.896 114.2 53.2 -65.4 -40.3 1.7 16.0 -19.7 282 282 A E H < S+ 0 0 99 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.952 120.9 31.0 -60.6 -47.5 5.0 15.6 -18.0 283 283 A V H < S+ 0 0 7 -4,-3.4 -2,-0.2 1,-0.2 -62,-0.2 0.922 131.3 32.9 -78.3 -46.4 5.2 11.9 -18.9 284 284 A F H < 0 0 26 -4,-3.4 -3,-0.2 -5,-0.4 -2,-0.2 0.258 360.0 360.0-100.0 14.3 3.4 11.8 -22.2 285 285 A G < 0 0 82 -4,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.776 360.0 360.0 78.4 360.0 4.4 15.3 -23.5