==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 02-AUG-01 1JPH . COMPND 2 MOLECULE: UROPORPHYRINOGEN DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.D.PHILLIPS,T.L.PARKER,H.L.SCHUBERT,F.G.WHITBY,C.P.HILL, . 357 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14733.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 246 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 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 . 15 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 37.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.2 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 3 1 1 2 1 1 1 0 0 0 2 1 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 1 1 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 . 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 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 10 A G 0 0 115 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 50.0 21.5 46.8 68.9 2 11 A F - 0 0 60 1,-0.1 132,-0.1 135,-0.0 3,-0.1 -0.755 360.0 -75.8-116.3 164.5 21.0 48.7 65.7 3 12 A P - 0 0 42 0, 0.0 2,-0.2 0, 0.0 135,-0.2 -0.214 56.8-100.5 -59.0 147.0 22.1 48.0 62.0 4 13 A E - 0 0 178 133,-0.1 2,-0.2 1,-0.1 0, 0.0 -0.518 42.1-104.9 -71.9 136.0 25.8 48.7 61.3 5 14 A L - 0 0 36 -2,-0.2 3,-0.2 1,-0.1 134,-0.2 -0.433 35.0-176.9 -65.4 124.5 26.5 52.0 59.6 6 15 A K S S+ 0 0 173 132,-3.5 2,-0.7 1,-0.3 133,-0.2 0.925 75.5 36.3 -86.5 -56.2 27.3 51.6 55.9 7 16 A N + 0 0 44 132,-0.9 -1,-0.3 131,-0.8 3,-0.2 -0.887 62.0 159.8-103.3 107.2 28.1 55.2 54.9 8 17 A D >> + 0 0 57 -2,-0.7 4,-2.2 -3,-0.2 3,-0.6 0.149 32.9 118.7-112.4 18.8 29.9 57.0 57.7 9 18 A T H 3> S+ 0 0 4 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.897 74.6 53.9 -50.3 -48.2 31.4 59.8 55.7 10 19 A F H 3> S+ 0 0 0 60,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.851 110.2 47.7 -56.7 -38.5 29.5 62.5 57.6 11 20 A L H <> S+ 0 0 28 -3,-0.6 4,-1.6 2,-0.2 -1,-0.2 0.904 111.2 48.8 -72.1 -42.3 30.8 61.2 60.9 12 21 A R H <>S+ 0 0 64 -4,-2.2 5,-2.5 2,-0.2 4,-0.3 0.918 113.3 47.5 -64.6 -40.5 34.4 60.9 59.8 13 22 A A H ><5S+ 0 0 3 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.894 108.3 57.0 -66.2 -36.8 34.3 64.5 58.5 14 23 A A H 3<5S+ 0 0 1 -4,-1.8 277,-0.3 1,-0.3 -1,-0.2 0.821 107.5 46.9 -62.7 -35.0 32.7 65.5 61.8 15 24 A W T 3<5S- 0 0 120 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.434 124.2-104.8 -86.5 -2.8 35.7 64.2 63.7 16 25 A G T < 5S+ 0 0 23 -3,-1.2 307,-0.3 -4,-0.3 -3,-0.2 0.466 71.8 142.9 94.6 4.1 38.1 65.9 61.4 17 26 A E < - 0 0 107 -5,-2.5 -1,-0.3 -6,-0.2 306,-0.2 -0.336 56.4 -99.2 -77.8 157.3 39.2 62.9 59.4 18 27 A E - 0 0 108 304,-0.1 2,-0.3 305,-0.1 -1,-0.1 -0.507 42.0-167.2 -74.4 143.2 39.9 62.9 55.7 19 28 A T - 0 0 13 302,-0.3 3,-0.1 -2,-0.2 -9,-0.0 -0.902 33.8-118.4-131.5 160.6 37.2 61.6 53.4 20 29 A D S S- 0 0 120 -2,-0.3 2,-0.3 1,-0.1 336,-0.1 0.739 99.3 -0.5 -66.9 -26.4 36.9 60.5 49.7 21 30 A Y S S- 0 0 26 335,-0.1 328,-0.1 334,-0.0 -1,-0.1 -0.933 89.2 -85.2-153.4 170.8 34.3 63.3 49.1 22 31 A T - 0 0 0 326,-0.4 330,-0.1 -2,-0.3 303,-0.1 -0.775 43.0-133.7 -89.4 121.7 32.6 66.0 51.1 23 32 A P - 0 0 0 0, 0.0 303,-2.2 0, 0.0 2,-0.3 -0.424 26.9-166.7 -71.2 150.1 29.4 64.7 52.9 24 33 A V B +a 326 0A 0 301,-0.2 46,-2.9 44,-0.2 47,-0.4 -0.998 20.4 157.9-146.0 145.3 26.3 66.9 52.6 25 34 A W - 0 0 0 301,-1.4 2,-0.4 -2,-0.3 303,-0.2 -0.926 30.1-124.9-151.8 166.4 22.9 67.3 54.2 26 35 A C > - 0 0 0 -2,-0.3 3,-1.7 45,-0.2 4,-0.2 -0.983 19.6-119.8-126.7 130.9 20.4 70.2 54.4 27 36 A M T 3 S+ 0 0 6 -2,-0.4 305,-1.9 1,-0.3 303,-0.1 -0.437 107.6 17.1 -62.7 136.1 18.7 71.8 57.4 28 37 A R T 3 S+ 0 0 141 303,-0.2 -1,-0.3 2,-0.1 47,-0.0 0.768 77.4 149.9 68.3 28.1 15.0 71.2 56.9 29 38 A Q S < S+ 0 0 2 -3,-1.7 2,-1.0 1,-0.2 -2,-0.1 0.818 72.6 56.9 -59.5 -29.0 15.6 68.5 54.3 30 39 A A S S+ 0 0 11 -4,-0.2 2,-0.3 43,-0.1 -1,-0.2 -0.885 94.5 120.2 -99.6 95.1 12.3 67.1 55.6 31 40 A G S > S- 0 0 9 -2,-1.0 3,-2.5 28,-0.1 6,-0.3 -0.971 80.4 -81.4-152.9 173.9 10.3 70.2 54.9 32 41 A R T 3 S+ 0 0 127 -2,-0.3 6,-0.2 1,-0.3 301,-0.1 0.606 110.1 78.7 -54.9 -16.5 7.3 71.8 53.1 33 42 A Y T 3 S+ 0 0 3 299,-0.1 -1,-0.3 4,-0.1 3,-0.1 0.701 84.4 75.7 -67.0 -18.0 9.4 72.2 49.9 34 43 A L S X> S- 0 0 0 -3,-2.5 4,-1.3 1,-0.2 3,-0.9 -0.848 76.6-149.0 -95.6 123.7 8.6 68.5 49.4 35 44 A P H 3> S+ 0 0 59 0, 0.0 4,-1.8 0, 0.0 3,-0.4 0.921 99.5 56.7 -56.7 -42.6 5.0 67.7 48.3 36 45 A E H 3> S+ 0 0 45 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.754 101.2 58.8 -60.9 -26.1 5.1 64.4 50.1 37 46 A F H <> S+ 0 0 8 -3,-0.9 4,-2.4 -6,-0.3 -1,-0.2 0.910 104.5 48.4 -69.5 -45.3 5.9 66.3 53.3 38 47 A R H X S+ 0 0 100 -4,-1.3 4,-1.6 -3,-0.4 -2,-0.2 0.899 111.2 51.0 -62.2 -42.1 2.7 68.4 53.2 39 48 A E H < S+ 0 0 158 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.937 113.1 43.7 -61.1 -49.9 0.5 65.4 52.5 40 49 A T H >< S+ 0 0 35 -4,-1.8 3,-1.5 1,-0.2 4,-0.2 0.919 113.6 50.8 -62.8 -44.8 1.9 63.4 55.5 41 50 A R H >< S+ 0 0 24 -4,-2.4 3,-0.9 1,-0.3 -1,-0.2 0.799 97.4 69.6 -65.3 -26.1 1.8 66.4 57.8 42 51 A A T 3< S+ 0 0 80 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.364 71.8 94.2 -74.7 7.4 -1.8 67.0 56.8 43 52 A A T < S- 0 0 71 -3,-1.5 -1,-0.2 2,-0.1 2,-0.2 0.933 107.5 -37.1 -63.0 -46.9 -2.8 63.8 58.7 44 53 A Q S < S- 0 0 131 -3,-0.9 4,-0.1 1,-0.3 -1,-0.1 -0.685 92.4 -42.5-153.0-157.2 -3.6 65.8 61.8 45 54 A D >> - 0 0 93 -2,-0.2 4,-1.5 2,-0.1 3,-0.6 -0.129 65.0 -92.8 -74.8 178.1 -2.2 68.9 63.6 46 55 A F H >> S+ 0 0 40 45,-0.3 2,-2.1 1,-0.3 3,-0.7 0.978 122.1 49.3 -56.1 -62.4 1.5 69.7 64.2 47 56 A F H 34 S+ 0 0 24 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 -0.384 113.4 46.5 -81.4 62.1 1.7 68.1 67.6 48 57 A S H <4 S+ 0 0 24 -2,-2.1 -1,-0.2 -3,-0.6 -2,-0.2 0.149 111.1 46.5-162.9 -40.8 0.1 64.8 66.6 49 58 A T H << S+ 0 0 4 -4,-1.5 -2,-0.2 -3,-0.7 -3,-0.1 0.329 119.4 47.2 -91.2 2.6 1.8 64.0 63.3 50 59 A C S < S+ 0 0 3 -4,-0.5 -3,-0.2 -5,-0.2 -1,-0.2 0.587 106.3 55.2-111.8 -28.4 4.9 64.9 65.4 51 60 A R S S+ 0 0 104 -5,-0.2 -2,-0.2 25,-0.0 -4,-0.1 0.355 91.0 89.8 -87.1 0.9 3.9 62.7 68.4 52 61 A S > - 0 0 45 1,-0.2 4,-2.3 -4,-0.0 3,-0.3 -0.908 66.3-155.4-103.7 111.9 3.6 59.7 66.1 53 62 A P H > S+ 0 0 28 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.909 96.2 50.1 -51.3 -45.6 6.9 57.7 65.7 54 63 A E H > S+ 0 0 98 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.857 109.9 51.4 -63.9 -35.6 5.9 56.3 62.3 55 64 A A H > S+ 0 0 15 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.929 112.5 44.2 -67.2 -46.4 5.0 59.8 61.1 56 65 A C H X S+ 0 0 3 -4,-2.3 4,-2.8 2,-0.2 19,-0.4 0.887 112.8 52.6 -65.2 -40.0 8.3 61.3 62.1 57 66 A C H X S+ 0 0 2 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.929 110.0 48.4 -61.5 -45.9 10.2 58.4 60.7 58 67 A E H X S+ 0 0 63 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.895 112.9 47.4 -61.4 -43.6 8.4 58.7 57.4 59 68 A L H < S+ 0 0 0 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.913 111.5 51.2 -65.6 -41.0 9.1 62.4 57.2 60 69 A T H X S+ 0 0 1 -4,-2.8 4,-0.5 1,-0.2 13,-0.2 0.924 113.5 45.3 -61.2 -43.2 12.8 61.9 58.1 61 70 A L H X S+ 0 0 24 -4,-2.5 4,-0.9 1,-0.2 3,-0.3 0.747 92.4 81.6 -74.1 -26.9 13.1 59.2 55.3 62 71 A Q H >X S+ 0 0 2 -4,-1.8 3,-1.2 1,-0.2 4,-0.8 0.895 92.1 46.1 -48.9 -52.9 11.3 61.2 52.6 63 72 A P H >> S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 3,-0.9 0.878 107.1 59.5 -61.4 -33.9 14.3 63.4 51.5 64 73 A L H 3< S+ 0 0 10 -4,-0.5 -2,-0.2 -3,-0.3 -3,-0.1 0.701 99.5 57.9 -66.4 -19.0 16.6 60.4 51.5 65 74 A R H << S+ 0 0 142 -3,-1.2 -1,-0.3 -4,-0.9 -3,-0.1 0.746 114.8 36.6 -81.3 -24.4 14.4 58.7 48.9 66 75 A R H << S+ 0 0 96 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.1 0.807 123.8 31.7 -94.2 -36.8 14.9 61.7 46.6 67 76 A F S < S- 0 0 9 -4,-2.8 2,-2.3 278,-0.0 -1,-0.2 -0.961 73.4-122.3-131.3 143.6 18.6 62.6 47.3 68 77 A P + 0 0 77 0, 0.0 -44,-0.2 0, 0.0 2,-0.1 -0.397 48.1 174.4 -78.7 63.5 21.7 60.7 48.3 69 78 A L - 0 0 4 -2,-2.3 -44,-0.2 -6,-0.1 -2,-0.0 -0.457 34.4-135.4 -70.5 144.5 22.2 62.8 51.4 70 79 A D S S+ 0 0 4 -46,-2.9 -60,-0.5 -2,-0.1 2,-0.3 0.378 82.9 22.8 -86.3 5.0 25.0 61.8 53.7 71 80 A A - 0 0 0 -47,-0.4 2,-0.4 69,-0.2 -45,-0.2 -0.977 64.2-142.3-163.2 155.4 23.0 62.1 56.9 72 81 A A E -b 142 0B 0 69,-2.5 71,-3.7 -2,-0.3 2,-0.4 -0.912 13.3-152.9-119.7 147.0 19.4 62.1 58.1 73 82 A I E -b 143 0B 16 -2,-0.4 71,-0.2 -13,-0.2 -43,-0.1 -0.993 29.0-107.1-123.0 131.1 18.1 64.4 60.8 74 83 A I - 0 0 4 69,-2.7 2,-0.5 -2,-0.4 -17,-0.1 -0.264 34.0-118.3 -56.2 137.0 15.1 63.3 62.9 75 84 A F + 0 0 24 -19,-0.4 2,-0.3 53,-0.1 -15,-0.1 -0.727 64.5 109.1 -80.4 127.5 12.0 65.2 62.1 76 85 A S - 0 0 15 -2,-0.5 2,-0.3 -3,-0.0 3,-0.1 -0.858 60.6 -94.9-167.6-161.3 10.8 67.2 65.1 77 86 A D > - 0 0 32 -2,-0.3 3,-1.3 1,-0.1 4,-0.2 -0.993 14.3-135.2-140.5 143.7 10.5 70.7 66.4 78 87 A I T > S+ 0 0 26 -2,-0.3 3,-1.2 1,-0.2 69,-0.4 0.831 104.1 67.8 -65.2 -28.9 12.7 72.8 68.7 79 88 A L T 3> S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.522 72.8 88.4 -71.2 -5.3 9.6 73.9 70.5 80 89 A V H <> S+ 0 0 1 -3,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.827 85.4 55.9 -62.5 -29.4 9.0 70.3 72.0 81 90 A V H <> S+ 0 0 0 -3,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.948 106.6 44.3 -69.6 -52.8 11.2 71.2 74.9 82 91 A P H 4>S+ 0 0 0 0, 0.0 5,-2.0 0, 0.0 4,-0.3 0.882 115.7 52.3 -59.7 -34.3 9.3 74.4 76.2 83 92 A Q H ><5S+ 0 0 28 -4,-1.8 3,-2.2 1,-0.2 -2,-0.2 0.954 107.3 49.0 -64.8 -48.8 6.1 72.4 75.7 84 93 A A H 3<5S+ 0 0 6 -4,-2.4 -1,-0.2 1,-0.3 -3,-0.2 0.746 104.6 63.4 -62.6 -22.3 7.5 69.4 77.7 85 94 A L T 3<5S- 0 0 0 -4,-1.4 28,-3.2 -5,-0.1 -1,-0.3 0.586 131.7 -90.0 -77.9 -11.2 8.3 72.1 80.3 86 95 A G T < 5S+ 0 0 28 -3,-2.2 2,-0.4 1,-0.3 -3,-0.2 0.474 82.4 132.4 118.3 2.1 4.7 73.0 80.7 87 96 A M < - 0 0 1 -5,-2.0 2,-0.3 1,-0.0 -1,-0.3 -0.717 50.7-128.9 -92.6 136.9 4.0 75.7 78.1 88 97 A E - 0 0 133 -2,-0.4 13,-0.4 13,-0.2 2,-0.3 -0.663 19.7-158.3 -85.1 134.9 0.9 75.4 75.8 89 98 A V - 0 0 17 -2,-0.3 10,-0.2 10,-0.2 2,-0.2 -0.849 11.9-164.9-112.6 146.3 1.4 75.8 72.1 90 99 A T - 0 0 67 8,-2.3 2,-0.6 -2,-0.3 6,-0.2 -0.579 14.9-164.7-129.5 69.3 -1.3 76.8 69.5 91 100 A M - 0 0 47 -2,-0.2 -45,-0.3 4,-0.1 -44,-0.1 -0.396 13.2-179.5 -61.6 104.0 0.2 75.9 66.2 92 101 A V B > -H 96 0C 57 4,-1.5 4,-0.8 -2,-0.6 -2,-0.0 -0.715 35.9-122.0-104.6 156.4 -1.9 77.6 63.5 93 102 A P T 4 S+ 0 0 140 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.820 107.6 44.0 -66.2 -32.5 -1.4 77.5 59.7 94 103 A G T 4 S+ 0 0 75 2,-0.1 -3,-0.0 1,-0.0 0, 0.0 0.983 128.3 20.6 -76.7 -63.6 -0.9 81.3 59.3 95 104 A K T 4 S- 0 0 160 1,-0.2 66,-0.1 3,-0.0 -4,-0.1 0.932 90.4-164.1 -72.4 -48.6 1.3 82.3 62.2 96 105 A G B < +H 92 0C 15 -4,-0.8 -4,-1.5 -6,-0.2 -1,-0.2 -0.878 57.8 35.8 101.7-127.0 2.8 78.9 62.8 97 106 A P S S+ 0 0 53 0, 0.0 64,-0.4 0, 0.0 2,-0.3 -0.451 76.3 158.4 -66.0 127.7 4.7 78.3 66.1 98 107 A S - 0 0 18 -2,-0.2 -8,-2.3 62,-0.1 62,-0.2 -0.957 39.6-157.2-160.6 139.0 3.1 80.2 69.0 99 108 A F - 0 0 4 60,-2.5 -10,-0.2 -2,-0.3 -12,-0.0 -0.940 12.1-164.7-112.0 104.4 2.7 80.4 72.8 100 109 A P S S+ 0 0 58 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 0.774 88.3 43.1 -60.3 -26.8 -0.6 82.3 73.6 101 110 A E S S- 0 0 108 -13,-0.4 -13,-0.2 -3,-0.1 58,-0.1 -0.745 84.7-174.9-121.9 81.5 0.6 82.8 77.2 102 111 A P - 0 0 30 0, 0.0 2,-0.4 0, 0.0 55,-0.2 -0.195 35.0 -96.2 -72.1 164.5 4.3 83.7 77.1 103 112 A L + 0 0 0 53,-2.8 3,-0.1 1,-0.2 56,-0.0 -0.708 57.9 147.5 -81.2 127.2 6.6 84.2 80.1 104 113 A R + 0 0 97 -2,-0.4 2,-0.3 1,-0.3 -1,-0.2 0.575 56.3 47.4-132.1 -29.7 6.7 87.9 80.9 105 114 A E S > S- 0 0 86 1,-0.1 3,-1.3 73,-0.0 -1,-0.3 -0.800 82.8-116.9-115.5 155.1 7.2 88.2 84.7 106 115 A E G > S+ 0 0 96 -2,-0.3 3,-1.8 1,-0.3 4,-0.2 0.855 114.3 64.7 -57.8 -35.4 9.7 86.3 86.9 107 116 A Q G > S+ 0 0 129 1,-0.3 3,-1.7 2,-0.2 -1,-0.3 0.754 85.2 74.0 -60.1 -25.5 6.7 84.7 88.6 108 117 A D G X S+ 0 0 38 -3,-1.3 3,-1.2 1,-0.3 -1,-0.3 0.683 79.2 73.4 -64.0 -18.1 5.8 83.0 85.4 109 118 A L G X S+ 0 0 9 -3,-1.8 3,-1.5 -4,-0.3 -1,-0.3 0.736 80.4 75.1 -67.9 -21.5 8.7 80.6 85.8 110 119 A E G < S+ 0 0 155 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.668 85.5 61.4 -65.2 -19.7 6.7 78.8 88.6 111 120 A R G < S+ 0 0 95 -3,-1.2 -1,-0.3 -4,-0.2 2,-0.2 0.546 84.5 101.9 -85.9 -4.4 4.5 77.1 86.1 112 121 A L S < S- 0 0 20 -3,-1.5 -26,-0.2 -4,-0.2 -27,-0.1 -0.470 75.5-113.9 -81.5 147.6 7.4 75.2 84.5 113 122 A R - 0 0 100 -28,-3.2 -1,-0.1 -2,-0.2 5,-0.1 -0.347 41.3 -88.7 -73.1 161.1 8.1 71.6 85.2 114 123 A D > - 0 0 97 1,-0.2 3,-2.4 -2,-0.1 4,-0.3 -0.575 38.7-128.4 -68.4 126.4 11.2 70.5 87.0 115 124 A P G > S+ 0 0 15 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.731 104.3 73.0 -52.3 -21.0 13.7 70.1 84.1 116 125 A E G 3 S+ 0 0 123 1,-0.2 4,-0.2 2,-0.1 3,-0.2 0.723 96.7 48.5 -65.8 -24.3 14.5 66.6 85.6 117 126 A V G <> S+ 0 0 60 -3,-2.4 4,-0.8 1,-0.1 -1,-0.2 0.414 86.1 89.0 -98.4 2.5 11.1 65.4 84.3 118 127 A V H X> S+ 0 0 0 -3,-1.1 4,-1.0 -4,-0.3 3,-0.5 0.871 80.2 57.9 -68.3 -39.2 11.3 66.7 80.8 119 128 A A H 34 S+ 0 0 23 -4,-0.4 3,-0.4 1,-0.3 -1,-0.2 0.861 104.1 53.2 -60.3 -36.9 13.0 63.7 79.2 120 129 A S H >4 S+ 0 0 88 1,-0.2 3,-0.7 -4,-0.2 -1,-0.3 0.786 107.0 52.8 -69.0 -27.4 10.1 61.4 80.3 121 130 A E H << S+ 0 0 80 -4,-0.8 3,-0.3 -3,-0.5 -1,-0.2 0.685 106.8 53.8 -78.9 -20.0 7.7 63.8 78.6 122 131 A L T >X + 0 0 0 -4,-1.0 3,-1.7 -3,-0.4 4,-1.2 0.139 68.0 119.9-102.4 21.3 9.7 63.6 75.4 123 132 A G H <> + 0 0 19 -3,-0.7 4,-2.4 1,-0.3 5,-0.2 0.812 67.3 64.2 -54.2 -34.6 9.6 59.8 75.1 124 133 A Y H 3> S+ 0 0 24 -3,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.786 100.1 52.7 -62.1 -28.3 7.8 59.9 71.8 125 134 A V H <> S+ 0 0 4 -3,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.918 108.7 49.5 -72.2 -42.5 10.8 61.6 70.3 126 135 A F H X S+ 0 0 38 -4,-1.2 4,-2.5 1,-0.2 -2,-0.2 0.902 110.1 51.3 -61.8 -41.1 13.1 58.8 71.5 127 136 A Q H X S+ 0 0 118 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.887 109.8 49.4 -63.9 -39.6 10.7 56.2 70.0 128 137 A A H X S+ 0 0 2 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.853 110.5 51.2 -68.1 -35.3 10.8 58.0 66.7 129 138 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.943 111.5 45.7 -67.1 -47.2 14.6 58.1 66.8 130 139 A T H X S+ 0 0 50 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.934 114.8 48.8 -61.4 -45.3 14.9 54.4 67.5 131 140 A L H X S+ 0 0 32 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.908 113.3 45.9 -62.1 -44.3 12.3 53.6 64.8 132 141 A T H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.897 110.3 53.4 -66.3 -40.8 14.1 55.8 62.3 133 142 A R H X>S+ 0 0 45 -4,-2.7 4,-0.7 67,-0.2 5,-0.6 0.885 112.1 46.7 -60.9 -38.0 17.5 54.3 63.2 134 143 A Q H ><5S+ 0 0 93 -4,-2.1 3,-0.6 -5,-0.2 -2,-0.2 0.943 114.7 44.9 -68.6 -49.4 16.1 50.8 62.6 135 144 A R H 3<5S+ 0 0 126 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.764 103.9 62.2 -67.6 -31.0 14.4 51.7 59.3 136 145 A L H ><5S- 0 0 8 -4,-2.3 3,-1.4 -5,-0.2 -1,-0.2 0.810 90.9-155.7 -63.3 -29.3 17.4 53.6 57.9 137 146 A A T <<5 - 0 0 56 -4,-0.7 -3,-0.1 -3,-0.6 -133,-0.1 0.837 62.7 -57.2 55.6 39.3 19.1 50.2 58.2 138 147 A G T 3 - 0 0 0 60,-3.0 4,-2.7 -2,-0.3 5,-0.2 -0.392 33.3-105.2 -73.3 155.7 19.9 76.2 72.4 149 158 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.865 118.4 46.8 -48.0 -49.9 18.9 77.7 75.7 150 159 A W H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.954 113.7 47.9 -61.6 -50.1 18.9 81.4 74.5 151 160 A T H > S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.896 112.7 48.9 -58.5 -39.7 16.9 80.5 71.4 152 161 A L H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.894 108.6 54.9 -67.0 -37.7 14.4 78.5 73.4 153 162 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 5,-0.3 0.896 102.8 55.9 -61.7 -40.7 14.1 81.4 75.9 154 163 A T H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 6,-0.4 0.884 108.7 46.8 -60.7 -40.5 13.2 83.8 73.0 155 164 A Y H X S+ 0 0 44 -4,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.882 113.4 49.2 -68.0 -38.1 10.3 81.7 72.0 156 165 A M H < S+ 0 0 0 -4,-1.9 -53,-2.8 2,-0.2 -2,-0.2 0.831 121.4 33.3 -70.3 -34.3 9.1 81.3 75.5 157 166 A V H < S+ 0 0 0 -4,-2.3 -2,-0.2 -55,-0.2 -3,-0.2 0.859 124.1 41.7 -89.2 -42.8 9.3 85.1 76.3 158 167 A E H < S- 0 0 27 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.810 97.6-134.6 -74.4 -31.7 8.4 86.5 72.9 159 168 A G S < S- 0 0 5 -4,-1.5 -60,-2.5 -5,-0.4 2,-0.3 0.354 73.7 -18.9 90.9 -5.0 5.6 83.9 72.3 160 169 A G S S- 0 0 9 -6,-0.4 -1,-0.2 -62,-0.2 -2,-0.2 -0.948 108.0 -9.2 169.6-150.1 6.8 83.4 68.8 161 170 A G + 0 0 63 -64,-0.4 2,-0.3 -2,-0.3 -1,-0.0 -0.220 53.6 174.1 -72.4 165.7 9.0 85.0 66.1 162 171 A S - 0 0 41 -3,-0.0 -4,-0.0 1,-0.0 -3,-0.0 -0.916 35.2-142.3-170.1 144.2 10.3 88.5 66.3 163 172 A S S S+ 0 0 111 -2,-0.3 -1,-0.0 1,-0.1 -2,-0.0 0.564 105.4 24.2 -89.1 -7.6 12.6 90.7 64.2 164 173 A T S S- 0 0 78 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.598 81.9-140.3-128.5 -22.2 14.1 92.4 67.4 165 174 A M > + 0 0 0 1,-0.1 4,-3.2 3,-0.1 5,-0.3 0.821 45.4 156.9 56.7 32.4 13.7 90.0 70.3 166 175 A A H > + 0 0 55 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.827 67.2 45.6 -57.0 -40.0 12.9 93.2 72.3 167 176 A Q H > S+ 0 0 54 2,-0.2 4,-1.2 3,-0.1 -1,-0.2 0.899 116.0 45.2 -72.3 -42.4 11.0 91.4 75.0 168 177 A A H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.914 115.7 46.4 -67.6 -43.4 13.6 88.6 75.5 169 178 A K H X S+ 0 0 59 -4,-3.2 4,-2.1 1,-0.2 5,-0.2 0.823 106.1 59.5 -69.6 -29.4 16.5 91.1 75.5 170 179 A R H X>S+ 0 0 118 -4,-1.4 4,-3.0 -5,-0.3 5,-0.5 0.866 102.7 54.4 -65.1 -33.6 14.6 93.3 77.9 171 180 A W H X5S+ 0 0 3 -4,-1.2 4,-2.4 3,-0.2 8,-0.3 0.932 106.1 51.5 -63.7 -44.3 14.7 90.3 80.2 172 181 A L H <5S+ 0 0 3 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.914 119.0 35.1 -59.3 -44.3 18.5 90.1 79.9 173 182 A Y H <5S+ 0 0 162 -4,-2.1 -2,-0.2 2,-0.1 -1,-0.2 0.878 131.5 28.3 -79.0 -41.2 19.0 93.8 80.8 174 183 A Q H <5S+ 0 0 133 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.774 132.1 31.6 -92.1 -31.4 16.1 94.2 83.4 175 184 A R X< + 0 0 63 -4,-2.4 4,-2.3 -5,-0.5 -1,-0.2 -0.464 65.9 151.7-125.3 59.3 15.8 90.7 84.8 176 185 A P H > S+ 0 0 55 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.905 76.9 48.4 -56.8 -42.4 19.4 89.2 84.5 177 186 A Q H > S+ 0 0 174 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.939 114.0 44.4 -62.5 -51.0 18.8 86.9 87.5 178 187 A A H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.813 112.1 55.3 -63.2 -32.8 15.5 85.5 86.2 179 188 A S H X S+ 0 0 0 -4,-2.3 4,-2.6 -8,-0.3 -1,-0.2 0.927 108.8 45.8 -66.2 -45.9 17.1 85.2 82.8 180 189 A H H X S+ 0 0 63 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.863 111.5 53.9 -64.8 -36.1 19.9 83.1 84.2 181 190 A Q H X S+ 0 0 93 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.943 111.8 43.5 -63.2 -48.1 17.3 81.0 86.1 182 191 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.904 113.3 51.6 -63.8 -42.8 15.3 80.3 82.9 183 192 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.820 110.5 48.9 -64.0 -33.0 18.5 79.6 80.9 184 193 A R H X S+ 0 0 88 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.871 109.0 52.5 -73.8 -38.9 19.6 77.1 83.6 185 194 A I H X S+ 0 0 26 -4,-2.0 4,-0.8 1,-0.2 -2,-0.2 0.929 111.1 48.1 -60.4 -45.4 16.2 75.4 83.6 186 195 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 3,-0.5 0.888 111.6 49.5 -63.1 -40.2 16.4 75.1 79.8 187 196 A T H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.938 108.3 52.3 -65.4 -46.7 20.0 73.7 80.1 188 197 A D H < S+ 0 0 45 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.635 114.4 44.3 -65.1 -15.7 19.0 71.1 82.7 189 198 A A H X S+ 0 0 0 -4,-0.8 4,-1.4 -3,-0.5 -1,-0.2 0.787 111.0 52.6 -95.6 -37.1 16.2 69.9 80.5 190 199 A L H X S+ 0 0 0 -4,-2.3 4,-3.3 2,-0.2 5,-0.3 0.879 102.0 59.4 -67.0 -41.0 18.2 69.8 77.3 191 200 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.960 110.7 38.5 -55.8 -58.7 21.1 67.7 78.6 192 201 A P H > S+ 0 0 20 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.836 116.8 54.1 -64.7 -26.2 18.9 64.7 79.6 193 202 A Y H X S+ 0 0 3 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.960 112.4 41.8 -69.2 -49.8 16.9 65.2 76.4 194 203 A L H X S+ 0 0 2 -4,-3.3 4,-1.4 2,-0.2 -1,-0.2 0.871 114.1 51.9 -64.7 -39.3 19.9 65.1 74.2 195 204 A V H X S+ 0 0 18 -4,-2.6 4,-2.5 -5,-0.3 3,-0.4 0.932 109.0 52.1 -62.7 -42.3 21.5 62.2 76.1 196 205 A G H X S+ 0 0 14 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.815 103.9 56.7 -62.9 -33.5 18.2 60.4 75.6 197 206 A Q H <>S+ 0 0 0 -4,-1.6 5,-3.2 2,-0.2 -1,-0.2 0.847 109.6 45.3 -66.6 -35.5 18.3 61.0 71.9 198 207 A V H ><5S+ 0 0 14 -4,-1.4 3,-1.6 -3,-0.4 -2,-0.2 0.919 111.3 51.9 -73.6 -42.2 21.7 59.3 71.7 199 208 A V H 3<5S+ 0 0 85 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.897 109.3 52.4 -58.7 -37.4 20.5 56.4 73.9 200 209 A A T 3<5S- 0 0 8 -4,-2.2 -1,-0.3 -5,-0.2 -67,-0.2 0.531 137.7 -81.0 -76.9 -9.2 17.6 56.1 71.5 201 210 A G T < 5S+ 0 0 0 -3,-1.6 -59,-0.3 1,-0.3 -3,-0.2 0.462 74.5 149.2 127.2 -3.5 19.9 55.9 68.5 202 211 A A < - 0 0 3 -5,-3.2 -1,-0.3 1,-0.1 -59,-0.2 -0.458 26.3-165.6 -65.2 134.3 21.1 59.4 67.5 203 212 A Q S S+ 0 0 24 -61,-3.1 2,-0.3 1,-0.2 -60,-0.2 0.418 71.7 12.3-101.4 -0.9 24.6 59.2 66.0 204 213 A A E -c 143 0B 0 -62,-0.8 -60,-2.9 43,-0.2 2,-0.4 -0.943 69.7-140.7-165.5 159.6 25.3 63.0 66.1 205 214 A L E -cd 144 249B 2 43,-2.2 45,-3.1 -2,-0.3 2,-0.4 -0.995 6.4-162.8-135.8 140.4 23.7 66.0 67.8 206 215 A Q E -cd 145 250B 1 -62,-1.9 -60,-1.6 -2,-0.4 2,-0.6 -0.985 7.5-154.5-125.3 128.7 23.1 69.6 66.6 207 216 A L E -cd 146 251B 3 43,-3.1 45,-2.4 -2,-0.4 2,-0.7 -0.925 15.2-147.4-102.3 118.0 22.3 72.5 68.9 208 217 A F E +cd 147 252B 24 -62,-2.7 -60,-3.0 -2,-0.6 2,-0.7 -0.796 22.2 175.6 -91.4 109.1 20.3 75.2 67.1 209 218 A E E > + d 0 253B 0 43,-3.3 45,-1.2 -2,-0.7 3,-1.1 -0.686 17.8 160.7-107.4 69.3 21.0 78.8 68.3 210 219 A S T 3 + 0 0 20 -2,-0.7 3,-0.2 1,-0.2 -1,-0.2 0.678 67.9 49.7 -66.3 -21.4 18.9 80.3 65.6 211 220 A H T > S+ 0 0 24 1,-0.2 3,-0.5 -3,-0.2 -1,-0.2 -0.108 72.4 113.9-112.4 36.1 18.4 83.6 67.4 212 221 A A G X + 0 0 0 -3,-1.1 3,-1.9 42,-0.4 43,-0.2 0.885 64.8 68.1 -70.8 -41.2 22.1 84.3 68.2 213 222 A G G 3 S+ 0 0 31 41,-1.5 -1,-0.2 1,-0.3 42,-0.1 0.643 85.8 66.9 -54.9 -23.8 22.3 87.3 65.9 214 223 A H G < S+ 0 0 49 -3,-0.5 -1,-0.3 2,-0.1 2,-0.3 0.714 95.4 69.0 -71.8 -21.1 20.0 89.5 68.0 215 224 A L S < S- 0 0 4 -3,-1.9 -50,-0.0 -4,-0.2 -46,-0.0 -0.664 79.2-138.3 -95.8 149.3 22.6 89.5 70.8 216 225 A G > - 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