==== 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 1JPI . 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) . 14727.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 9.0 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 . 16 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 12.6 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 0 3 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 . 1 1 1 1 3 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 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 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 0 114 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 35.2 21.5 46.6 67.6 2 11 A F - 0 0 61 1,-0.1 132,-0.1 136,-0.0 3,-0.1 -0.704 360.0 -77.0-110.4 165.4 21.0 48.8 64.5 3 12 A P - 0 0 37 0, 0.0 2,-0.3 0, 0.0 135,-0.2 -0.217 55.1-101.8 -60.7 150.8 22.1 48.1 60.9 4 13 A E - 0 0 176 133,-0.1 2,-0.2 1,-0.1 0, 0.0 -0.600 42.2-105.0 -76.2 135.3 25.8 48.6 60.2 5 14 A L - 0 0 39 -2,-0.3 134,-0.2 1,-0.1 3,-0.2 -0.398 33.8-175.9 -65.1 126.6 26.5 51.9 58.5 6 15 A K S S+ 0 0 172 132,-3.6 2,-0.7 1,-0.3 133,-0.2 0.924 75.4 35.2 -87.1 -56.1 27.4 51.5 54.8 7 16 A N + 0 0 43 132,-1.2 -1,-0.3 131,-0.8 3,-0.2 -0.903 60.2 161.3-104.9 112.1 28.2 55.1 53.7 8 17 A D > + 0 0 58 -2,-0.7 4,-2.4 -3,-0.2 3,-0.5 0.115 33.7 119.7-115.7 20.7 29.9 57.0 56.5 9 18 A T H > S+ 0 0 5 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.896 76.2 54.0 -51.7 -43.6 31.4 59.9 54.5 10 19 A F H > S+ 0 0 0 60,-0.5 4,-1.7 1,-0.2 -1,-0.3 0.860 110.4 45.9 -58.5 -43.8 29.5 62.4 56.5 11 20 A L H > S+ 0 0 27 -3,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.882 112.1 49.5 -69.8 -40.5 30.8 61.1 59.8 12 21 A R H X>S+ 0 0 63 -4,-2.4 5,-2.6 2,-0.2 4,-0.6 0.951 112.3 47.1 -65.1 -45.8 34.4 60.9 58.7 13 22 A A H ><5S+ 0 0 2 -4,-2.6 3,-1.1 1,-0.2 -1,-0.2 0.895 109.1 56.9 -61.3 -38.1 34.4 64.4 57.4 14 23 A A H 3<5S+ 0 0 1 -4,-1.7 277,-0.3 1,-0.3 -1,-0.2 0.819 106.6 48.0 -61.5 -36.0 32.7 65.5 60.6 15 24 A W H 3<5S- 0 0 121 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.521 126.2-102.6 -83.4 -6.6 35.6 64.1 62.6 16 25 A G T <<5S+ 0 0 25 -3,-1.1 307,-0.2 -4,-0.6 -3,-0.2 0.521 73.0 143.2 98.3 8.8 38.1 65.8 60.3 17 26 A E < - 0 0 105 -5,-2.6 -1,-0.3 -6,-0.2 2,-0.2 -0.418 55.7-102.0 -83.0 155.6 39.1 62.9 58.2 18 27 A E - 0 0 108 -2,-0.1 2,-0.3 304,-0.1 -1,-0.1 -0.494 40.8-166.3 -73.5 144.7 39.9 62.9 54.5 19 28 A T - 0 0 10 302,-0.3 3,-0.0 -2,-0.2 -10,-0.0 -0.945 34.0-117.9-134.1 154.6 37.1 61.6 52.3 20 29 A D S S+ 0 0 120 -2,-0.3 2,-0.3 1,-0.1 336,-0.1 0.743 99.9 0.5 -60.9 -25.1 36.9 60.5 48.6 21 30 A Y S S- 0 0 23 335,-0.1 328,-0.1 334,-0.0 -1,-0.1 -0.950 88.6 -85.1-155.5 169.1 34.4 63.3 48.1 22 31 A T - 0 0 1 326,-0.4 330,-0.1 -2,-0.3 303,-0.1 -0.744 43.7-133.5 -87.4 121.2 32.6 66.0 50.0 23 32 A P - 0 0 0 0, 0.0 303,-2.2 0, 0.0 2,-0.3 -0.417 25.2-162.5 -70.8 149.7 29.5 64.8 51.8 24 33 A V B +a 326 0A 1 44,-0.2 46,-3.1 301,-0.2 47,-0.3 -0.996 20.8 155.1-143.7 142.3 26.3 66.9 51.4 25 34 A W - 0 0 2 301,-1.2 2,-0.4 -2,-0.3 303,-0.3 -0.961 30.3-125.3-153.8 160.3 22.9 67.3 53.1 26 35 A C > - 0 0 0 -2,-0.3 3,-1.7 45,-0.2 4,-0.2 -0.950 19.1-121.4-121.0 132.2 20.3 70.1 53.3 27 36 A M T 3 S+ 0 0 7 -2,-0.4 305,-1.7 1,-0.3 303,-0.1 -0.486 107.9 15.0 -64.0 132.8 18.8 71.7 56.3 28 37 A R T 3 S+ 0 0 133 303,-0.2 -1,-0.3 -2,-0.1 47,-0.0 0.801 77.8 150.9 67.6 32.5 15.0 71.2 55.9 29 38 A Q S < S+ 0 0 2 -3,-1.7 2,-1.1 1,-0.2 -2,-0.1 0.812 72.8 58.5 -61.9 -29.2 15.6 68.5 53.2 30 39 A A S S+ 0 0 10 -4,-0.2 2,-0.3 44,-0.1 -1,-0.2 -0.869 93.4 124.9 -98.2 90.6 12.3 67.1 54.5 31 40 A G S > S- 0 0 8 -2,-1.1 3,-2.5 28,-0.1 6,-0.3 -0.959 78.8 -85.3-146.8 171.1 10.4 70.3 53.8 32 41 A R T 3 S+ 0 0 124 1,-0.3 6,-0.2 -2,-0.3 301,-0.1 0.593 109.8 79.7 -53.9 -15.5 7.4 71.8 52.0 33 42 A Y T 3 S+ 0 0 3 299,-0.1 -1,-0.3 4,-0.1 3,-0.1 0.717 83.1 77.2 -65.9 -19.7 9.3 72.2 48.8 34 43 A L S X> S- 0 0 0 -3,-2.5 3,-1.3 1,-0.1 4,-1.2 -0.834 76.2-149.4 -93.8 119.7 8.6 68.4 48.3 35 44 A P H 3> S+ 0 0 59 0, 0.0 4,-1.6 0, 0.0 3,-0.5 0.909 99.4 57.3 -53.6 -42.1 5.0 67.7 47.1 36 45 A E H 3> S+ 0 0 45 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.743 100.6 59.6 -60.9 -25.5 5.1 64.4 49.0 37 46 A F H <> S+ 0 0 7 -3,-1.3 4,-2.3 -6,-0.3 -1,-0.2 0.892 104.1 47.3 -70.8 -43.8 5.8 66.3 52.2 38 47 A R H X S+ 0 0 99 -4,-1.2 4,-1.9 -3,-0.5 -2,-0.2 0.882 112.1 50.9 -65.5 -40.5 2.7 68.5 52.1 39 48 A E H < S+ 0 0 158 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.944 114.4 41.9 -62.1 -51.6 0.5 65.4 51.4 40 49 A T H >< S+ 0 0 37 -4,-1.8 3,-1.4 1,-0.2 4,-0.2 0.910 116.0 50.2 -62.8 -43.5 1.9 63.4 54.3 41 50 A R H >< S+ 0 0 22 -4,-2.3 3,-1.0 1,-0.3 -1,-0.2 0.818 98.6 68.1 -66.1 -28.9 1.8 66.4 56.6 42 51 A A T 3< S+ 0 0 78 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.348 72.4 94.6 -74.5 8.6 -1.8 67.0 55.6 43 52 A A T < S- 0 0 73 -3,-1.4 -1,-0.2 2,-0.1 2,-0.2 0.925 106.9 -35.7 -64.2 -45.3 -2.8 63.9 57.5 44 53 A Q S < S- 0 0 132 -3,-1.0 4,-0.1 1,-0.3 -1,-0.1 -0.697 92.8 -43.0-153.1-158.1 -3.6 65.9 60.6 45 54 A D >> - 0 0 93 -2,-0.2 4,-1.5 2,-0.1 3,-0.6 -0.139 64.3 -93.8 -74.4 177.2 -2.2 69.0 62.4 46 55 A F H >> S+ 0 0 41 45,-0.3 2,-2.1 1,-0.3 3,-0.8 0.975 121.8 49.8 -56.1 -61.7 1.5 69.7 63.0 47 56 A F H 34 S+ 0 0 23 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 -0.376 113.3 46.2 -81.3 61.0 1.7 68.2 66.4 48 57 A S H <4 S+ 0 0 22 -2,-2.1 -1,-0.2 -3,-0.6 -2,-0.2 0.148 110.2 48.2-162.8 -38.8 0.1 64.9 65.4 49 58 A T H << S+ 0 0 3 -4,-1.5 -2,-0.2 -3,-0.8 -3,-0.1 0.337 118.7 45.7 -91.3 1.8 1.9 64.2 62.1 50 59 A C S < S+ 0 0 2 -4,-0.5 -3,-0.2 -5,-0.2 -1,-0.2 0.587 107.4 56.9-111.1 -29.8 5.0 64.9 64.2 51 60 A R S S+ 0 0 105 -5,-0.2 -2,-0.2 1,-0.1 -4,-0.1 0.458 89.9 86.6 -82.5 -3.4 3.8 62.7 67.2 52 61 A S > - 0 0 48 1,-0.2 4,-2.4 -4,-0.2 3,-0.5 -0.884 67.1-155.9-102.4 107.8 3.5 59.7 64.9 53 62 A P H > S+ 0 0 27 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.904 94.8 50.5 -46.4 -49.9 6.8 57.8 64.7 54 63 A E H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.859 111.4 49.4 -59.4 -37.3 5.9 56.3 61.3 55 64 A A H > S+ 0 0 17 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.923 112.2 45.4 -69.3 -45.6 5.0 59.7 59.9 56 65 A C H X S+ 0 0 4 -4,-2.4 4,-2.5 1,-0.2 19,-0.4 0.907 112.7 53.4 -64.4 -38.9 8.2 61.4 61.1 57 66 A C H X S+ 0 0 2 -4,-2.8 4,-2.2 -5,-0.3 -2,-0.2 0.920 109.4 47.3 -61.0 -45.6 10.1 58.4 59.7 58 67 A E H X S+ 0 0 63 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.875 111.6 50.1 -63.5 -42.7 8.5 58.7 56.3 59 68 A L H < S+ 0 0 0 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.912 110.7 50.7 -63.3 -40.8 9.1 62.5 56.1 60 69 A T H < S+ 0 0 1 -4,-2.5 4,-0.5 1,-0.2 13,-0.2 0.909 113.6 45.1 -63.1 -41.5 12.7 61.9 57.1 61 70 A L H X S+ 0 0 22 -4,-2.2 4,-0.9 1,-0.2 3,-0.4 0.739 92.4 82.6 -76.6 -24.9 13.1 59.3 54.3 62 71 A Q H >X S+ 0 0 3 -4,-1.9 3,-1.0 1,-0.2 4,-0.8 0.876 90.1 47.1 -49.7 -50.6 11.4 61.2 51.5 63 72 A P H >> S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 3,-0.8 0.875 106.8 59.8 -63.2 -32.1 14.3 63.4 50.4 64 73 A L H 34 S+ 0 0 10 -4,-0.5 -2,-0.2 -3,-0.4 -3,-0.1 0.707 98.5 58.3 -66.9 -21.8 16.6 60.4 50.4 65 74 A R H << S+ 0 0 141 -3,-1.0 -1,-0.3 -4,-0.9 -3,-0.1 0.756 115.0 36.8 -78.6 -25.1 14.4 58.7 47.8 66 75 A R H << S+ 0 0 96 -4,-0.8 -2,-0.2 -3,-0.8 -1,-0.1 0.850 123.5 31.2 -92.6 -41.7 14.9 61.7 45.5 67 76 A F S < S- 0 0 9 -4,-3.0 2,-2.5 278,-0.0 -1,-0.2 -0.935 73.5-122.0-127.4 145.1 18.6 62.6 46.1 68 77 A P + 0 0 74 0, 0.0 -44,-0.2 0, 0.0 -4,-0.1 -0.343 48.4 174.4 -76.5 58.9 21.7 60.7 47.1 69 78 A L - 0 0 5 -2,-2.5 -44,-0.2 -6,-0.2 3,-0.1 -0.339 34.4-134.3 -65.1 149.8 22.2 62.9 50.2 70 79 A D S S+ 0 0 5 -46,-3.1 -60,-0.5 1,-0.1 2,-0.3 0.256 82.7 18.6 -94.0 13.2 25.0 61.8 52.5 71 80 A A - 0 0 0 -47,-0.3 2,-0.4 69,-0.2 -45,-0.2 -0.951 65.5-139.0-171.6 155.1 23.0 62.0 55.7 72 81 A A E -b 142 0A 0 69,-2.6 71,-3.6 -2,-0.3 2,-0.4 -0.924 13.2-150.5-121.5 147.1 19.4 62.2 56.9 73 82 A I E -b 143 0A 14 -2,-0.4 71,-0.2 -13,-0.2 -43,-0.1 -0.980 28.9-107.4-119.8 132.3 18.1 64.4 59.6 74 83 A I - 0 0 5 69,-2.6 2,-0.6 -2,-0.4 -44,-0.1 -0.250 34.1-119.1 -56.1 140.1 15.2 63.4 61.8 75 84 A F + 0 0 18 -19,-0.4 2,-0.2 53,-0.1 -15,-0.1 -0.802 63.7 110.4 -85.1 125.5 12.0 65.3 61.0 76 85 A S - 0 0 16 -2,-0.6 2,-0.3 -16,-0.0 70,-0.1 -0.809 60.0 -98.7-163.9-157.6 10.8 67.3 64.0 77 86 A D > - 0 0 28 -2,-0.2 3,-1.8 68,-0.1 4,-0.3 -0.993 14.9-134.0-147.4 137.8 10.5 70.8 65.2 78 87 A I T > S+ 0 0 26 -2,-0.3 3,-1.0 1,-0.3 69,-0.3 0.759 104.4 69.3 -62.8 -20.7 12.7 72.9 67.6 79 88 A L T 3> S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.528 73.5 85.6 -76.8 -4.8 9.5 73.9 69.4 80 89 A V H <> S+ 0 0 1 -3,-1.8 4,-2.8 1,-0.2 -1,-0.2 0.838 87.0 55.1 -64.7 -31.1 8.9 70.4 70.8 81 90 A V H <> S+ 0 0 0 -3,-1.0 4,-1.2 -4,-0.3 -1,-0.2 0.948 108.1 43.8 -68.6 -52.1 11.2 71.3 73.7 82 91 A P H 4>S+ 0 0 0 0, 0.0 5,-1.8 0, 0.0 3,-0.4 0.917 116.4 50.9 -59.0 -39.9 9.3 74.5 74.9 83 92 A Q H ><5S+ 0 0 29 -4,-2.0 3,-2.7 1,-0.2 4,-0.2 0.964 107.1 51.2 -60.1 -51.6 6.1 72.5 74.4 84 93 A A H 3<5S+ 0 0 5 -4,-2.8 -1,-0.2 1,-0.3 -3,-0.2 0.710 103.7 61.9 -59.1 -21.7 7.4 69.6 76.4 85 94 A L T 3<5S- 0 0 0 -4,-1.2 28,-3.0 -3,-0.4 -1,-0.3 0.465 132.9 -87.7 -82.9 -5.6 8.2 72.2 79.1 86 95 A G T < 5S+ 0 0 28 -3,-2.7 2,-0.5 1,-0.3 -3,-0.2 0.554 83.1 134.0 112.8 9.1 4.6 73.0 79.4 87 96 A M < - 0 0 2 -5,-1.8 2,-0.3 -4,-0.2 -1,-0.3 -0.806 50.3-129.7 -97.6 132.4 4.0 75.7 76.8 88 97 A E - 0 0 135 -2,-0.5 13,-0.4 13,-0.2 2,-0.4 -0.613 19.2-157.6 -81.9 132.9 0.9 75.5 74.5 89 98 A V - 0 0 16 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.888 11.4-166.1-112.1 139.6 1.4 75.8 70.8 90 99 A T - 0 0 68 8,-2.1 2,-0.7 -2,-0.4 6,-0.2 -0.670 14.4-164.2-124.1 74.0 -1.3 76.8 68.3 91 100 A M - 0 0 46 -2,-0.3 -45,-0.3 6,-0.1 -44,-0.1 -0.465 13.2-179.1 -65.5 104.2 0.2 75.9 64.9 92 101 A V B > -H 96 0B 58 4,-1.3 4,-0.7 -2,-0.7 -2,-0.0 -0.725 35.4-122.4-103.8 155.4 -1.8 77.7 62.3 93 102 A P T 4 S+ 0 0 141 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.818 107.5 43.9 -65.5 -32.6 -1.3 77.6 58.5 94 103 A G T 4 S+ 0 0 75 2,-0.1 -3,-0.0 1,-0.0 0, 0.0 0.981 128.0 20.9 -76.9 -62.5 -0.9 81.3 58.1 95 104 A K T 4 S- 0 0 162 1,-0.2 -4,-0.1 3,-0.0 -1,-0.0 0.944 90.0-164.1 -72.8 -51.7 1.4 82.3 61.0 96 105 A G B < +H 92 0B 15 -4,-0.7 -4,-1.3 -6,-0.2 2,-0.2 -0.891 57.5 34.5 105.2-128.6 2.9 78.9 61.7 97 106 A P S S+ 0 0 53 0, 0.0 64,-0.4 0, 0.0 2,-0.3 -0.472 77.6 158.7 -66.2 124.5 4.8 78.3 65.0 98 107 A S - 0 0 18 -2,-0.2 -8,-2.1 62,-0.1 62,-0.2 -0.986 41.0-155.3-156.2 143.2 3.1 80.3 67.8 99 108 A F - 0 0 4 60,-2.8 -10,-0.2 -2,-0.3 -12,-0.0 -0.951 11.4-164.9-114.4 102.8 2.7 80.5 71.5 100 109 A P S S+ 0 0 56 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 0.764 89.5 43.2 -60.0 -23.5 -0.6 82.3 72.2 101 110 A E S S- 0 0 109 -13,-0.4 -13,-0.2 -3,-0.1 58,-0.1 -0.753 84.0-175.5-124.9 83.7 0.6 82.7 75.8 102 111 A P - 0 0 29 0, 0.0 2,-0.3 0, 0.0 55,-0.2 -0.289 35.0 -97.3 -74.6 160.4 4.3 83.8 75.8 103 112 A L + 0 0 0 53,-2.6 3,-0.1 1,-0.2 56,-0.0 -0.597 55.5 150.3 -75.5 137.5 6.5 84.2 78.8 104 113 A R + 0 0 101 1,-0.4 2,-0.3 -2,-0.3 -1,-0.2 0.516 55.7 47.4-138.2 -34.0 6.6 87.9 79.8 105 114 A E S > S- 0 0 85 1,-0.1 3,-1.2 73,-0.0 -1,-0.4 -0.777 82.9-116.2-112.7 156.9 7.1 88.2 83.5 106 115 A E G > S+ 0 0 94 -2,-0.3 3,-1.7 1,-0.3 4,-0.2 0.830 116.4 64.7 -59.1 -31.0 9.7 86.3 85.6 107 116 A Q G > S+ 0 0 128 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.812 84.2 74.3 -62.9 -29.0 6.6 84.8 87.3 108 117 A D G X S+ 0 0 39 -3,-1.2 3,-0.6 1,-0.3 -1,-0.3 0.571 80.9 72.8 -62.1 -9.6 5.8 83.1 84.0 109 118 A L G X S+ 0 0 13 -3,-1.7 3,-1.7 1,-0.2 -1,-0.3 0.754 79.6 73.7 -77.1 -23.8 8.7 80.7 84.6 110 119 A E G < S+ 0 0 158 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.735 87.1 62.0 -62.1 -24.8 6.7 78.9 87.3 111 120 A R G < S+ 0 0 96 -3,-0.6 -1,-0.3 -4,-0.3 2,-0.2 0.503 83.7 100.4 -82.2 -3.5 4.4 77.2 84.8 112 121 A L S < S- 0 0 22 -3,-1.7 -26,-0.2 1,-0.1 -27,-0.1 -0.528 76.8-112.2 -82.9 149.7 7.3 75.3 83.2 113 122 A R - 0 0 100 -28,-3.0 -1,-0.1 -2,-0.2 5,-0.1 -0.358 41.4 -86.9 -75.0 160.7 8.0 71.7 83.9 114 123 A D > - 0 0 96 1,-0.2 3,-2.3 -2,-0.1 4,-0.3 -0.541 40.6-130.3 -66.0 124.8 11.1 70.5 85.8 115 124 A P G > S+ 0 0 8 0, 0.0 3,-1.4 0, 0.0 4,-0.5 0.791 103.1 71.1 -51.2 -26.5 13.6 70.1 82.9 116 125 A E G 3 S+ 0 0 139 1,-0.3 4,-0.2 2,-0.1 3,-0.2 0.709 96.9 49.9 -64.0 -22.7 14.4 66.6 84.2 117 126 A V G <> S+ 0 0 59 -3,-2.3 4,-0.7 1,-0.2 -1,-0.3 0.443 85.5 88.2 -96.7 -1.1 11.0 65.4 83.1 118 127 A V H X> S+ 0 0 0 -3,-1.4 4,-1.0 -4,-0.3 3,-0.9 0.883 80.6 59.4 -64.4 -40.2 11.2 66.7 79.5 119 128 A A H >4 S+ 0 0 22 -4,-0.5 3,-0.7 1,-0.3 -1,-0.2 0.881 103.3 51.8 -56.5 -42.4 12.9 63.7 78.1 120 129 A S H >4 S+ 0 0 90 1,-0.2 3,-0.6 -4,-0.2 -1,-0.3 0.722 106.8 55.0 -68.2 -22.3 10.0 61.4 79.1 121 130 A E H << S+ 0 0 82 -3,-0.9 3,-0.3 -4,-0.7 -1,-0.2 0.698 104.3 54.5 -83.1 -19.0 7.6 63.8 77.4 122 131 A L T XX + 0 0 1 -4,-1.0 3,-1.7 -3,-0.7 4,-1.3 0.126 67.0 122.0-103.0 24.1 9.5 63.5 74.1 123 132 A G H <> + 0 0 21 -3,-0.6 4,-2.4 1,-0.3 5,-0.2 0.816 66.8 64.1 -54.2 -35.4 9.4 59.7 73.8 124 133 A Y H 3> S+ 0 0 23 -3,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.808 100.9 51.7 -61.5 -29.6 7.6 59.9 70.5 125 134 A V H <> S+ 0 0 4 -3,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.939 108.4 50.2 -71.6 -44.9 10.7 61.6 69.0 126 135 A F H X S+ 0 0 38 -4,-1.3 4,-2.6 1,-0.2 5,-0.2 0.931 110.2 51.2 -57.4 -44.6 13.0 58.8 70.3 127 136 A Q H X S+ 0 0 120 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.872 109.0 50.4 -61.6 -39.0 10.7 56.2 68.8 128 137 A A H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.2 -1,-0.2 0.844 110.4 50.9 -69.0 -33.1 10.7 58.0 65.4 129 138 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.947 111.3 45.4 -69.5 -49.0 14.5 58.1 65.5 130 139 A T H X S+ 0 0 50 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.935 115.7 48.9 -58.9 -45.7 14.9 54.3 66.3 131 140 A L H X S+ 0 0 34 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.921 113.1 45.6 -60.9 -46.3 12.4 53.6 63.6 132 141 A T H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.871 111.5 52.5 -66.2 -37.2 14.1 55.8 61.1 133 142 A R H X>S+ 0 0 43 -4,-2.8 4,-0.9 67,-0.2 5,-0.7 0.887 112.7 46.1 -64.4 -39.5 17.5 54.3 62.0 134 143 A Q H ><5S+ 0 0 92 -4,-2.3 3,-0.5 -5,-0.2 -2,-0.2 0.949 115.4 44.8 -67.3 -50.8 16.1 50.8 61.4 135 144 A R H 3<5S+ 0 0 124 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.748 105.5 60.1 -66.2 -30.0 14.4 51.7 58.1 136 145 A L H ><5S- 0 0 10 -4,-2.0 3,-1.3 -5,-0.2 -1,-0.2 0.830 91.7-156.2 -66.5 -29.8 17.4 53.6 56.8 137 146 A A T <<5 - 0 0 53 -4,-0.9 -133,-0.1 -3,-0.5 -3,-0.1 0.837 62.8 -56.2 56.8 39.6 19.2 50.2 57.2 138 147 A G T 3 - 0 0 1 60,-3.0 4,-2.4 -2,-0.3 5,-0.3 -0.384 34.3-103.7 -73.0 156.2 20.0 76.1 71.2 149 158 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.844 118.1 45.0 -47.2 -50.4 19.0 77.7 74.6 150 159 A W H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.963 113.1 49.8 -62.5 -53.0 18.9 81.3 73.4 151 160 A T H > S+ 0 0 2 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.885 112.1 48.1 -54.0 -41.3 17.0 80.6 70.2 152 161 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.877 108.9 55.0 -68.0 -35.7 14.4 78.6 72.1 153 162 A M H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.3 5,-0.3 0.898 102.3 56.7 -63.4 -39.7 14.1 81.4 74.6 154 163 A T H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 6,-0.4 0.875 108.7 46.7 -61.2 -37.2 13.3 83.8 71.8 155 164 A Y H X S+ 0 0 37 -4,-1.3 4,-1.3 1,-0.2 -1,-0.2 0.874 112.8 49.2 -71.0 -38.2 10.4 81.7 70.7 156 165 A M H < S+ 0 0 0 -4,-1.9 -53,-2.6 2,-0.2 -2,-0.2 0.816 121.6 33.6 -70.1 -34.4 9.1 81.4 74.2 157 166 A V H < S+ 0 0 0 -4,-2.4 -2,-0.2 -55,-0.2 -3,-0.2 0.853 123.6 42.6 -89.2 -42.4 9.3 85.1 75.0 158 167 A E H < S- 0 0 28 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.761 99.3-134.7 -74.8 -25.6 8.5 86.5 71.5 159 168 A G S < S- 0 0 6 -4,-1.3 -60,-2.8 -5,-0.3 2,-0.3 0.318 74.9 -20.2 86.4 -8.0 5.7 83.9 71.1 160 169 A G S S- 0 0 9 -6,-0.4 -2,-0.2 -62,-0.2 -1,-0.2 -0.909 110.6 -8.0 171.6-144.3 7.0 83.2 67.6 161 170 A G + 0 0 63 -64,-0.4 2,-0.3 -2,-0.3 -1,-0.1 -0.252 52.4 172.8 -77.4 166.3 9.1 85.0 65.0 162 171 A S - 0 0 41 -3,-0.0 -4,-0.0 1,-0.0 -3,-0.0 -0.922 35.1-139.8-169.5 146.3 10.4 88.6 65.1 163 172 A S S S+ 0 0 110 -2,-0.3 -1,-0.0 1,-0.1 -2,-0.0 0.538 106.2 24.5 -89.6 -6.5 12.7 90.7 63.0 164 173 A T S S- 0 0 75 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.577 82.8-139.9-129.3 -22.8 14.3 92.4 66.2 165 174 A M > + 0 0 0 3,-0.1 4,-3.5 1,-0.1 5,-0.3 0.779 45.6 156.4 59.3 28.8 13.8 90.0 69.1 166 175 A A H > + 0 0 54 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.824 67.3 46.5 -53.7 -41.2 13.0 93.2 71.1 167 176 A Q H > S+ 0 0 51 2,-0.2 4,-1.1 3,-0.2 -1,-0.2 0.876 116.4 44.2 -71.1 -40.6 11.0 91.4 73.8 168 177 A A H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 3,-0.4 0.940 116.3 46.3 -69.0 -47.1 13.6 88.6 74.2 169 178 A K H X S+ 0 0 59 -4,-3.5 4,-2.1 1,-0.3 5,-0.2 0.824 106.4 59.3 -66.6 -29.9 16.5 91.1 74.2 170 179 A R H X>S+ 0 0 115 -4,-1.7 4,-3.2 -5,-0.3 5,-0.6 0.863 103.1 54.2 -65.2 -34.6 14.7 93.3 76.7 171 180 A W H X5S+ 0 0 3 -4,-1.1 4,-2.4 -3,-0.4 8,-0.3 0.945 106.0 51.4 -63.1 -45.5 14.7 90.3 79.0 172 181 A L H <5S+ 0 0 5 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.916 119.2 35.5 -59.4 -41.2 18.4 90.0 78.7 173 182 A Y H <5S+ 0 0 162 -4,-2.1 -2,-0.2 2,-0.1 -1,-0.2 0.875 131.1 28.7 -81.5 -40.8 19.0 93.7 79.6 174 183 A Q H <5S+ 0 0 135 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.828 133.0 31.0 -89.0 -36.0 16.2 94.2 82.1 175 184 A R X< + 0 0 63 -4,-2.4 4,-2.1 -5,-0.6 -1,-0.2 -0.548 64.8 151.0-122.5 63.7 15.9 90.7 83.5 176 185 A P H > S+ 0 0 58 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.899 77.3 49.3 -62.7 -37.0 19.4 89.2 83.3 177 186 A Q H > S+ 0 0 169 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.961 113.9 43.4 -64.5 -53.9 18.8 86.9 86.3 178 187 A A H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.818 113.2 54.6 -61.0 -33.2 15.5 85.5 85.1 179 188 A S H X S+ 0 0 0 -4,-2.1 4,-2.6 -8,-0.3 -1,-0.2 0.915 108.6 47.2 -67.4 -43.7 17.1 85.2 81.6 180 189 A H H X S+ 0 0 67 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.894 112.0 51.6 -63.7 -39.8 19.9 83.1 83.0 181 190 A Q H X S+ 0 0 93 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.941 112.1 44.6 -62.0 -49.0 17.4 81.0 85.0 182 191 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.910 112.9 51.9 -62.5 -43.3 15.3 80.3 81.8 183 192 A L H X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.808 109.5 50.0 -63.7 -31.6 18.4 79.6 79.8 184 193 A R H X S+ 0 0 88 -4,-1.8 4,-3.0 2,-0.2 3,-0.5 0.950 108.3 52.0 -72.2 -45.6 19.5 77.1 82.4 185 194 A I H X S+ 0 0 38 -4,-2.4 4,-0.8 1,-0.3 -2,-0.2 0.885 110.6 50.2 -55.4 -40.6 16.1 75.4 82.4 186 195 A L H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.3 0.824 111.5 47.5 -68.6 -32.1 16.5 75.1 78.7 187 196 A T H X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.5 -2,-0.2 0.932 108.9 52.8 -74.5 -46.6 20.0 73.6 79.0 188 197 A D H < S+ 0 0 52 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.670 114.9 43.8 -62.7 -18.1 19.0 71.1 81.6 189 198 A A H X S+ 0 0 0 -4,-0.8 4,-1.3 -5,-0.3 -1,-0.2 0.804 110.9 52.1 -95.2 -36.7 16.2 69.9 79.3 190 199 A L H X S+ 0 0 0 -4,-1.8 4,-3.4 2,-0.2 5,-0.3 0.862 102.7 59.2 -67.8 -39.2 18.2 69.8 76.1 191 200 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.971 110.5 39.1 -57.0 -57.8 21.0 67.7 77.5 192 201 A P H > S+ 0 0 19 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.836 117.6 53.3 -64.0 -26.8 18.8 64.7 78.4 193 202 A Y H X S+ 0 0 3 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.949 111.9 42.1 -71.4 -49.6 16.8 65.2 75.3 194 203 A L H X S+ 0 0 1 -4,-3.4 4,-1.3 2,-0.2 -1,-0.2 0.865 114.0 52.1 -65.9 -37.5 19.9 65.2 73.0 195 204 A V H >X S+ 0 0 18 -4,-2.7 4,-2.6 -5,-0.3 3,-0.5 0.935 108.2 52.9 -64.0 -41.0 21.4 62.2 74.9 196 205 A G H 3X S+ 0 0 13 -4,-2.0 4,-1.9 1,-0.3 -1,-0.2 0.810 103.4 56.6 -63.2 -32.7 18.1 60.4 74.4 197 206 A Q H 3<>S+ 0 0 1 -4,-1.5 5,-3.0 2,-0.2 -1,-0.3 0.833 109.8 44.9 -67.3 -34.3 18.2 61.0 70.7 198 207 A V H X<5S+ 0 0 14 -4,-1.3 3,-2.0 -3,-0.5 -2,-0.2 0.932 111.1 53.0 -74.5 -44.1 21.6 59.3 70.5 199 208 A V H 3<5S+ 0 0 87 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.847 108.7 51.5 -57.0 -35.9 20.4 56.4 72.8 200 209 A A T 3<5S- 0 0 8 -4,-1.9 -1,-0.3 -5,-0.2 -67,-0.2 0.504 137.9 -82.3 -79.7 -8.1 17.5 56.0 70.3 201 210 A G T < 5S+ 0 0 2 -3,-2.0 -3,-0.2 1,-0.3 -59,-0.2 0.528 73.6 149.9 123.4 3.2 20.0 55.9 67.4 202 211 A A < - 0 0 3 -5,-3.0 -1,-0.3 1,-0.1 -59,-0.2 -0.535 26.4-164.7 -70.1 133.9 21.0 59.3 66.3 203 212 A Q S S+ 0 0 21 -61,-2.9 2,-0.3 -2,-0.2 -60,-0.2 0.359 71.2 13.5-101.6 3.7 24.6 59.2 64.9 204 213 A A E -c 143 0A 0 -62,-0.8 -60,-3.0 43,-0.2 2,-0.4 -0.945 69.5-140.7-166.1 164.0 25.3 63.0 65.0 205 214 A L E -cd 144 249A 3 43,-2.1 45,-3.3 -2,-0.3 2,-0.4 -1.000 5.6-162.5-141.6 139.8 23.6 66.1 66.6 206 215 A Q E -cd 145 250A 1 -62,-1.7 -60,-1.8 -2,-0.4 2,-0.6 -0.986 6.6-156.5-125.5 128.9 23.0 69.6 65.4 207 216 A L E -cd 146 251A 3 43,-3.0 45,-2.7 -2,-0.4 2,-0.7 -0.929 14.8-147.4-103.3 119.4 22.2 72.5 67.7 208 217 A F E +cd 147 252A 27 -62,-2.6 -60,-3.0 -2,-0.6 2,-0.7 -0.835 22.4 175.2 -94.5 109.7 20.4 75.3 65.9 209 218 A E E > + d 0 253A 0 43,-3.5 45,-1.1 -2,-0.7 3,-0.9 -0.736 18.7 160.3-108.1 69.5 21.1 78.8 67.3 210 219 A S T 3 + 0 0 24 -2,-0.7 3,-0.3 1,-0.2 -1,-0.2 0.734 67.2 50.0 -66.2 -27.5 19.0 80.3 64.5 211 220 A H T 3 S+ 0 0 23 1,-0.2 3,-0.4 -3,-0.2 -1,-0.2 -0.203 73.0 113.2-107.7 40.5 18.6 83.7 66.3 212 221 A A X + 0 0 0 -3,-0.9 3,-1.7 42,-0.5 -1,-0.2 0.871 66.4 66.3 -76.5 -38.2 22.2 84.3 67.1 213 222 A G T 3 S+ 0 0 28 41,-1.4 -1,-0.2 -3,-0.3 42,-0.1 0.619 85.7 68.4 -59.7 -21.2 22.5 87.3 64.8 214 223 A H T 3 S+ 0 0 49 -3,-0.4 -1,-0.3 2,-0.1 2,-0.2 0.710 96.2 66.7 -73.1 -19.8 20.1 89.5 66.8 215 224 A L S < S- 0 0 7 -3,-1.7 -50,-0.0 -4,-0.2 -46,-0.0 -0.585 79.9-133.7 -96.9 160.2 22.7 89.6 69.6 216 225 A G > - 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