==== 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-MAY-97 1AK5 . COMPND 2 MOLECULE: INOSINE-5'-MONOPHOSPHATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRITRICHOMONAS FOETUS; . AUTHOR F.G.WHITBY . 329 4 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14939.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 7.3 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 0.6 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 . 21 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 0 0 1 1 1 1 1 1 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 3 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 0 PARALLEL BRIDGES PER LADDER . 1 2 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 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 2 A A 0 0 123 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 159.9 56.9 75.2 36.3 2 3 A K - 0 0 130 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.975 360.0-159.1-116.1 124.3 60.0 73.2 37.5 3 4 A Y - 0 0 196 -2,-0.5 2,-0.4 0, 0.0 0, 0.0 -0.769 7.9-139.0-107.8 154.3 63.3 74.4 36.1 4 5 A Y - 0 0 133 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.935 4.9-148.7-115.2 133.7 66.7 72.7 35.8 5 6 A N S S+ 0 0 172 -2,-0.4 -1,-0.2 2,-0.1 0, 0.0 0.993 79.0 49.3 -60.2 -75.8 70.0 74.4 36.5 6 7 A E S S- 0 0 124 1,-0.1 2,-0.1 0, 0.0 -2,-0.0 -0.413 86.3-123.3 -71.5 141.4 72.5 72.7 34.2 7 8 A P - 0 0 83 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.429 32.9 -99.5 -78.1 161.2 71.6 72.4 30.6 8 9 A C - 0 0 60 -2,-0.1 2,-0.3 191,-0.0 190,-0.1 -0.608 37.7-149.0 -85.5 146.3 71.6 69.0 29.0 9 10 A H - 0 0 12 188,-0.3 191,-1.4 -2,-0.2 190,-0.9 -0.783 4.8-131.3-114.1 158.3 74.5 67.8 26.9 10 11 A T > - 0 0 63 -2,-0.3 3,-1.6 188,-0.2 187,-0.1 -0.527 36.9 -99.5 -99.4 171.0 74.9 65.6 23.9 11 12 A F G > S+ 0 0 3 216,-0.3 3,-0.9 1,-0.3 225,-0.0 0.648 117.6 69.3 -64.5 -18.0 77.5 62.8 23.5 12 13 A N G 3 S+ 0 0 70 1,-0.2 -1,-0.3 3,-0.0 221,-0.0 0.608 89.1 62.3 -76.3 -14.1 79.7 65.1 21.4 13 14 A E G < S+ 0 0 46 -3,-1.6 314,-2.8 313,-0.1 2,-0.3 0.250 94.7 80.5 -95.1 11.3 80.5 67.3 24.5 14 15 A Y E < -A 326 0A 28 -3,-0.9 2,-0.3 312,-0.2 312,-0.2 -0.873 50.7-175.2-123.1 155.9 82.2 64.5 26.3 15 16 A L E -A 325 0A 81 310,-2.2 310,-2.8 -2,-0.3 2,-0.4 -0.994 24.3-128.1-145.8 143.0 85.7 62.9 26.3 16 17 A L E -A 324 0A 15 -2,-0.3 308,-0.2 308,-0.2 306,-0.0 -0.792 21.2-145.4 -92.2 130.9 87.1 59.9 28.2 17 18 A I E -A 323 0A 76 306,-2.8 306,-0.6 -2,-0.4 -2,-0.0 -0.867 31.1-104.8 -96.3 129.9 90.4 60.7 29.9 18 19 A P - 0 0 83 0, 0.0 292,-0.3 0, 0.0 2,-0.2 -0.129 33.3-163.0 -56.0 149.5 92.7 57.7 29.9 19 20 A G - 0 0 27 290,-2.3 2,-0.4 289,-0.1 292,-0.3 -0.520 45.0 -57.1-117.6-172.0 93.3 55.5 33.0 20 21 A L - 0 0 143 290,-0.3 2,-0.5 -2,-0.2 -1,-0.0 -0.596 49.0-151.2 -78.2 124.9 96.1 53.1 33.6 21 22 A S - 0 0 58 -2,-0.4 2,-0.2 288,-0.1 288,-0.1 -0.828 10.0-150.7 -94.3 125.5 96.4 50.3 31.0 22 23 A T > - 0 0 64 -2,-0.5 3,-1.7 286,-0.1 289,-0.1 -0.528 28.6-109.0 -90.0 162.8 97.9 47.1 32.3 23 24 A V T 3 S+ 0 0 144 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.788 117.4 60.7 -62.2 -26.0 99.9 44.7 30.1 24 25 A D T 3 S+ 0 0 89 1,-0.1 2,-1.0 5,-0.0 -1,-0.3 0.417 79.5 96.3 -82.5 0.2 96.9 42.3 30.2 25 26 A a < + 0 0 14 -3,-1.7 -1,-0.1 283,-0.1 286,-0.1 -0.806 46.2 143.8 -97.5 99.1 94.5 44.7 28.6 26 27 A I >> - 0 0 72 -2,-1.0 3,-2.8 1,-0.1 4,-0.6 -0.973 62.1-109.7-130.8 144.5 94.4 43.9 24.9 27 28 A P G >4 S+ 0 0 47 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.848 117.8 59.9 -40.9 -45.1 91.3 44.1 22.7 28 29 A S G 34 S+ 0 0 96 1,-0.3 -3,-0.0 -3,-0.0 273,-0.0 0.727 103.8 51.4 -58.8 -25.4 91.2 40.3 22.4 29 30 A N G <4 S+ 0 0 86 -3,-2.8 2,-0.3 2,-0.1 -1,-0.3 0.531 84.5 109.2 -89.6 -9.1 90.8 40.0 26.2 30 31 A V << - 0 0 12 -3,-1.7 2,-0.6 -4,-0.6 284,-0.2 -0.529 57.5-149.8 -75.0 131.5 87.9 42.5 26.5 31 32 A N B -b 314 0B 83 282,-3.0 284,-0.7 -2,-0.3 20,-0.1 -0.908 13.1-175.3-104.8 120.9 84.5 40.9 27.4 32 33 A L + 0 0 8 -2,-0.6 2,-0.1 18,-0.4 -1,-0.1 0.139 34.0 134.0-102.7 20.4 81.5 42.7 26.0 33 34 A S + 0 0 43 18,-0.1 282,-0.3 19,-0.1 17,-0.2 -0.450 28.1 177.1 -71.4 144.7 78.7 40.7 27.7 34 35 A T E -C 49 0C 5 15,-1.5 15,-3.3 17,-0.1 2,-0.2 -0.987 32.7-104.2-145.8 151.4 75.8 42.6 29.3 35 36 A P E -C 48 0C 22 0, 0.0 13,-0.3 0, 0.0 3,-0.1 -0.540 23.7-171.0 -77.0 140.3 72.5 41.7 31.0 36 37 A L + 0 0 0 11,-2.9 2,-0.3 -2,-0.2 12,-0.1 0.770 68.2 38.0 -97.9 -34.2 69.4 42.3 28.9 37 38 A V S S- 0 0 0 10,-0.9 10,-0.2 1,-0.1 151,-0.2 -0.883 91.3 -89.1-123.4 153.8 66.7 41.7 31.7 38 39 A K + 0 0 38 149,-1.9 8,-0.3 -2,-0.3 2,-0.3 -0.125 44.1 166.4 -59.4 150.2 66.4 42.5 35.4 39 40 A F E -D 219 0D 48 180,-1.4 180,-2.9 6,-0.1 2,-0.2 -0.929 30.3-106.3-154.5 166.9 67.6 40.2 38.1 40 41 A Q E > -D 218 0D 106 -2,-0.3 3,-2.2 178,-0.2 178,-0.2 -0.628 49.2 -68.2-105.0 165.1 68.3 40.6 41.8 41 42 A K T 3 S+ 0 0 162 176,-2.6 -1,-0.1 1,-0.3 3,-0.1 -0.201 121.0 25.4 -49.9 125.4 71.4 40.9 44.0 42 43 A G T 3 S+ 0 0 85 1,-0.4 -1,-0.3 -3,-0.1 2,-0.2 0.312 108.5 89.1 100.8 -7.0 73.3 37.6 43.9 43 44 A Q < - 0 0 113 -3,-2.2 -1,-0.4 0, 0.0 2,-0.3 -0.710 68.9-124.8-120.0 170.0 72.0 36.4 40.6 44 45 A Q - 0 0 152 -2,-0.2 -4,-0.2 -3,-0.1 2,-0.1 -0.740 41.9 -93.2-106.0 158.1 72.9 36.7 36.9 45 46 A S - 0 0 6 -2,-0.3 -6,-0.1 1,-0.1 -7,-0.1 -0.470 27.3-129.0 -70.5 146.0 70.4 37.9 34.3 46 47 A E S S+ 0 0 143 -8,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.810 100.3 37.9 -64.0 -29.5 68.4 35.2 32.6 47 48 A I + 0 0 26 -10,-0.2 -11,-2.9 -9,-0.1 -10,-0.9 -0.989 69.9 179.2-127.9 124.6 69.5 36.7 29.3 48 49 A N E -C 35 0C 54 -2,-0.4 2,-0.2 -13,-0.3 -15,-0.1 -0.985 21.5-136.5-125.1 132.5 73.0 38.2 28.7 49 50 A L E -C 34 0C 0 -15,-3.3 -15,-1.5 -2,-0.4 26,-0.2 -0.559 4.3-145.7 -83.4 150.9 74.0 39.6 25.4 50 51 A K S S+ 0 0 69 24,-2.4 -18,-0.4 1,-0.3 25,-0.2 0.693 91.4 27.3 -86.6 -25.6 77.5 38.8 24.0 51 52 A I S S- 0 0 12 23,-1.4 2,-0.4 2,-0.2 -1,-0.3 -0.989 84.5-123.3-132.8 143.3 77.8 42.3 22.4 52 53 A P S S+ 0 0 2 0, 0.0 193,-2.9 0, 0.0 2,-0.4 0.092 76.5 105.6 -78.0 29.8 76.0 45.5 23.7 53 54 A L E +e 245 0E 1 -2,-0.4 23,-0.9 191,-0.2 2,-0.3 -0.907 39.5 173.5-115.8 134.9 74.3 46.2 20.5 54 55 A V E -ef 246 76E 0 191,-2.3 193,-2.1 -2,-0.4 2,-0.3 -0.977 30.3-117.9-133.7 144.3 70.6 45.7 19.6 55 56 A S E -ef 247 77E 0 21,-1.5 23,-0.8 -2,-0.3 193,-0.2 -0.650 35.3-100.6 -87.3 144.1 68.7 46.8 16.5 56 57 A A - 0 0 5 191,-2.4 2,-2.2 -2,-0.3 6,-0.4 -0.128 29.8-108.7 -59.3 154.3 65.9 49.3 16.5 57 58 A I S S+ 0 0 5 4,-0.1 2,-0.3 22,-0.1 24,-0.2 -0.483 75.5 128.5 -83.4 71.0 62.2 48.4 16.4 58 59 A M >> - 0 0 22 -2,-2.2 4,-1.9 20,-0.2 3,-1.0 -0.954 67.8-129.6-132.8 156.5 61.8 49.7 12.8 59 60 A Q T 34 S+ 0 0 50 -2,-0.3 -1,-0.1 1,-0.3 215,-0.1 0.817 110.3 50.9 -68.2 -36.6 60.5 48.6 9.4 60 61 A S T 34 S+ 0 0 0 213,-0.4 199,-0.5 198,-0.1 -1,-0.3 0.415 125.6 21.5 -83.7 2.0 63.7 49.7 7.7 61 62 A V T <4 S+ 0 0 0 -3,-1.0 2,-1.3 196,-0.2 -2,-0.2 0.660 105.3 63.8-134.2 -48.8 66.0 47.8 10.1 62 63 A S < + 0 0 0 -4,-1.9 18,-1.4 -6,-0.4 2,-0.2 -0.581 62.7 131.7 -96.1 84.8 64.6 44.9 12.1 63 64 A G S > S- 0 0 6 -2,-1.3 4,-2.4 193,-0.2 5,-0.1 -0.455 71.8 -86.3-112.2-172.6 63.5 42.1 9.8 64 65 A E H > S+ 0 0 68 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.883 125.6 50.5 -68.8 -36.5 64.2 38.4 9.9 65 66 A K H > S+ 0 0 108 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.914 113.2 46.6 -67.6 -38.9 67.5 38.6 8.0 66 67 A M H > S+ 0 0 0 190,-0.5 4,-2.6 1,-0.2 5,-0.3 0.924 110.4 53.7 -65.9 -44.5 68.8 41.3 10.3 67 68 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.890 111.7 44.3 -57.9 -42.9 67.6 39.3 13.4 68 69 A I H X S+ 0 0 4 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.938 114.9 47.9 -68.6 -46.6 69.6 36.2 12.3 69 70 A A H < S+ 0 0 9 -4,-2.3 4,-0.4 1,-0.2 -2,-0.2 0.810 115.6 44.3 -63.7 -37.2 72.7 38.1 11.3 70 71 A L H >X>S+ 0 0 0 -4,-2.6 5,-2.3 2,-0.2 3,-1.2 0.899 110.6 52.7 -75.6 -43.1 72.8 40.1 14.6 71 72 A A H ><5S+ 0 0 0 -4,-2.2 34,-2.7 -5,-0.3 3,-1.1 0.889 103.7 60.2 -60.2 -35.8 72.0 37.1 16.8 72 73 A R T 3<5S+ 0 0 82 -4,-2.0 31,-0.5 1,-0.3 -1,-0.3 0.741 106.5 45.7 -62.0 -27.3 75.0 35.4 15.2 73 74 A E T <45S- 0 0 46 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.502 129.2 -93.5 -93.7 -8.0 77.3 38.1 16.4 74 75 A G T <<5S+ 0 0 0 -3,-1.1 -24,-2.4 -4,-0.7 -23,-1.4 0.458 91.9 100.1 112.1 -0.5 75.9 38.1 19.9 75 76 A G < - 0 0 0 -5,-2.3 -1,-0.3 -25,-0.2 2,-0.3 -0.313 60.0-127.1-102.5-168.1 73.3 40.9 19.7 76 77 A I E -f 54 0E 0 -23,-0.9 -21,-1.5 -2,-0.1 2,-0.3 -0.993 7.8-145.2-145.6 147.5 69.5 40.8 19.4 77 78 A S E -f 55 0E 0 36,-0.4 38,-2.7 -2,-0.3 2,-0.7 -0.845 9.9-142.2-112.0 151.5 66.9 42.4 17.1 78 79 A F E -g 115 0E 0 -23,-0.8 38,-0.3 -2,-0.3 -20,-0.2 -0.874 26.1-134.5-113.2 93.3 63.4 43.5 18.0 79 80 A I E -g 116 0E 0 36,-2.2 38,-2.8 -2,-0.7 -16,-0.2 -0.179 34.5-100.1 -46.6 131.9 61.2 42.6 15.0 80 81 A F - 0 0 23 -18,-1.4 -1,-0.1 -22,-0.4 -22,-0.1 -0.296 23.4-156.6 -61.1 140.6 59.0 45.7 14.2 81 82 A G + 0 0 13 -24,-0.2 2,-1.3 1,-0.2 -1,-0.1 0.284 69.5 102.0 -99.4 7.5 55.4 45.6 15.4 82 83 A S S S+ 0 0 42 36,-0.1 2,-0.3 -25,-0.0 -1,-0.2 -0.355 76.2 64.2 -87.6 53.3 54.3 48.1 12.8 83 84 A Q S S- 0 0 43 -2,-1.3 -24,-0.0 -3,-0.0 0, 0.0 -0.872 102.8 -56.9-156.5 179.0 52.8 45.3 10.8 84 85 A S > - 0 0 48 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.305 44.9-119.2 -67.8 157.5 50.0 42.8 11.3 85 86 A I H > S+ 0 0 29 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.872 116.1 53.4 -63.0 -34.4 50.1 40.4 14.3 86 87 A E H > S+ 0 0 143 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.881 109.7 46.1 -68.8 -40.5 50.2 37.5 11.8 87 88 A S H > S+ 0 0 53 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.924 113.3 48.1 -68.1 -48.1 53.2 38.9 9.9 88 89 A Q H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.910 112.5 48.6 -60.4 -44.1 55.3 39.8 13.0 89 90 A A H X S+ 0 0 16 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.891 109.8 53.3 -64.1 -37.6 54.6 36.3 14.5 90 91 A A H X S+ 0 0 57 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.926 109.3 48.3 -62.2 -45.6 55.6 34.7 11.2 91 92 A M H X S+ 0 0 26 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.902 111.2 49.9 -62.3 -41.3 58.9 36.6 11.3 92 93 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.939 112.2 48.2 -62.2 -45.5 59.6 35.7 14.9 93 94 A H H X S+ 0 0 100 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.868 106.9 57.3 -62.0 -39.9 58.9 32.0 14.0 94 95 A A H < S+ 0 0 27 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.901 109.9 43.4 -59.3 -43.3 61.2 32.2 11.0 95 96 A V H >< S+ 0 0 1 -4,-1.9 3,-1.3 2,-0.2 17,-0.5 0.932 113.2 51.1 -69.1 -46.1 64.1 33.3 13.1 96 97 A K H 3< S+ 0 0 2 -4,-2.3 3,-0.3 1,-0.3 -2,-0.2 0.885 119.0 36.7 -58.2 -41.6 63.5 30.8 15.9 97 98 A N T 3< S+ 0 0 90 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.175 83.1 110.2 -99.6 18.8 63.3 27.9 13.4 98 99 A F < + 0 0 77 -3,-1.3 2,-1.7 1,-0.2 -1,-0.2 0.880 56.4 83.0 -60.3 -43.0 66.0 29.1 11.0 99 100 A K 0 0 87 -3,-0.3 -1,-0.2 -4,-0.3 -4,-0.0 -0.492 360.0 360.0 -70.7 84.8 68.4 26.3 12.0 100 101 A A 0 0 144 -2,-1.7 -1,-0.2 0, 0.0 -2,-0.1 -0.666 360.0 360.0 128.3 360.0 67.1 23.4 9.8 101 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 102 222 A H 0 0 166 0, 0.0 -29,-0.1 0, 0.0 -30,-0.0 0.000 360.0 360.0 360.0 131.2 81.0 32.3 17.3 103 223 A N + 0 0 87 -31,-0.5 -53,-0.2 2,-0.1 -52,-0.1 -0.147 360.0 166.6 -99.6 36.2 79.3 34.6 19.8 104 224 A E - 0 0 47 -31,-0.2 2,-0.9 1,-0.1 -32,-0.3 -0.231 37.4-134.3 -55.9 133.1 75.9 33.5 18.6 105 225 A L + 0 0 7 -34,-2.7 8,-1.9 -30,-0.2 2,-0.3 -0.871 45.8 160.5 -91.8 106.9 73.1 34.5 21.0 106 226 A V B -M 112 0F 35 -2,-0.9 6,-0.2 6,-0.2 2,-0.1 -0.865 31.3-130.8-131.2 158.0 71.3 31.2 21.2 107 227 A D > - 0 0 26 4,-2.4 3,-2.2 -2,-0.3 6,-0.0 -0.266 46.4 -74.7 -96.5-168.9 68.8 29.6 23.6 108 228 A S T 3 S+ 0 0 100 1,-0.3 -2,-0.0 2,-0.2 -1,-0.0 0.894 133.7 47.9 -54.0 -46.9 68.5 26.2 25.3 109 229 A Q T 3 S- 0 0 129 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.184 121.2-110.0 -81.7 17.8 67.4 24.5 22.0 110 230 A K S < S+ 0 0 135 -3,-2.2 2,-0.3 1,-0.2 -2,-0.2 0.779 72.8 142.9 59.8 29.1 70.3 26.3 20.3 111 231 A R - 0 0 62 1,-0.1 -4,-2.4 -13,-0.0 -1,-0.2 -0.747 59.2 -96.9 -99.1 147.5 67.9 28.5 18.4 112 232 A Y B -M 106 0F 13 -17,-0.5 -6,-0.2 -2,-0.3 2,-0.2 -0.330 41.2-116.2 -60.7 144.1 68.8 32.2 17.7 113 233 A L - 0 0 10 -8,-1.9 -36,-0.4 -38,-0.2 2,-0.3 -0.590 35.4-177.7 -83.6 144.7 67.3 34.7 20.2 114 234 A V - 0 0 0 20,-0.3 22,-2.9 -2,-0.2 23,-1.2 -0.998 14.2-159.4-145.1 146.5 64.7 37.3 19.0 115 235 A G E -gh 78 137E 0 -38,-2.7 -36,-2.2 -2,-0.3 2,-0.4 -0.735 11.2-152.3-115.6 166.0 62.8 40.2 20.5 116 236 A A E -gh 79 138E 0 21,-1.6 23,-1.8 -38,-0.3 2,-0.3 -0.996 14.4-124.0-142.6 143.7 59.6 41.8 19.2 117 237 A G E - 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0 0 2 -2,-0.6 -32,-0.2 -11,-0.2 2,-0.1 -0.928 18.1-132.5-108.3 116.8 67.2 46.9 35.9 221 354 A P - 0 0 0 0, 0.0 -32,-2.0 0, 0.0 2,-0.3 -0.468 21.0-149.5 -67.2 139.7 69.3 47.1 32.7 222 355 A V E -k 189 0E 0 19,-0.3 21,-2.0 -34,-0.2 22,-1.2 -0.878 2.4-149.2-113.0 148.9 68.9 50.4 30.8 223 356 A C E -kl 190 244E 0 -34,-2.5 -32,-3.4 -2,-0.3 2,-0.7 -0.962 8.9-142.2-121.1 126.3 69.2 50.9 27.0 224 357 A S E -kl 191 245E 0 20,-1.9 22,-2.8 -2,-0.5 2,-0.7 -0.791 22.3-160.0 -86.7 116.7 70.4 54.1 25.4 225 358 A D E - l 0 246E 40 -34,-2.8 22,-0.2 -2,-0.7 20,-0.0 -0.898 48.3 -31.7-104.5 111.4 68.2 54.4 22.3 226 359 A G S S+ 0 0 26 20,-2.1 3,-0.1 -2,-0.7 20,-0.1 0.117 84.5 100.5 74.5 172.7 69.7 56.7 19.6 227 360 A G + 0 0 45 1,-0.3 2,-0.7 -35,-0.1 -216,-0.3 0.401 54.1 127.8 91.7 -3.2 71.9 59.7 19.6 228 361 A I + 0 0 28 1,-0.2 -1,-0.3 -4,-0.1 22,-0.1 -0.806 22.3 163.1 -91.5 114.1 74.9 57.7 18.7 229 362 A V + 0 0 90 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.630 64.0 23.2-103.9 -19.5 76.7 59.3 15.8 230 363 A Y S >> S- 0 0 149 1,-0.1 3,-0.9 0, 0.0 4,-0.8 -0.940 80.4-105.8-143.8 165.4 80.1 57.6 16.1 231 364 A D H >> S+ 0 0 29 -2,-0.3 4,-1.4 1,-0.3 3,-1.0 0.873 118.4 60.5 -59.8 -36.9 81.8 54.4 17.6 232 365 A Y H 3> S+ 0 0 68 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.823 97.7 58.4 -59.5 -34.1 83.3 56.6 20.3 233 366 A H H <> S+ 0 0 8 -3,-0.9 4,-2.6 2,-0.2 -1,-0.3 0.785 99.6 59.1 -65.5 -30.5 79.8 57.5 21.4 234 367 A M H S+ 0 0 0 -4,-2.6 5,-2.1 2,-0.2 4,-0.2 0.932 113.8 44.0 -59.0 -46.4 77.1 55.6 26.5 238 371 A L H ><5S+ 0 0 1 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.928 111.9 52.8 -64.2 -45.9 78.3 52.3 28.1 239 372 A A H 3<5S+ 0 0 4 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.864 104.3 57.0 -57.7 -39.1 80.8 54.2 30.4 240 373 A M T 3<5S- 0 0 13 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.529 132.7 -88.7 -71.3 -7.4 78.0 56.5 31.5 241 374 A G T < 5S+ 0 0 4 -3,-1.8 -19,-0.3 1,-0.4 -3,-0.2 0.377 79.2 138.2 120.8 -9.6 76.1 53.5 32.7 242 375 A A < - 0 0 0 -5,-2.1 -1,-0.4 1,-0.1 -19,-0.2 -0.541 40.6-152.9 -70.1 137.6 73.9 52.2 29.8 243 376 A D S S- 0 0 3 -21,-2.0 2,-0.3 1,-0.2 -20,-0.2 0.837 73.4 -3.9 -79.0 -38.2 74.1 48.4 29.6 244 377 A F E - l 0 223E 0 -22,-1.2 -20,-1.9 -7,-0.1 2,-0.4 -0.950 69.3-124.9-149.8 167.7 73.4 48.1 25.9 245 378 A I E -el 53 224E 0 -193,-2.9 -191,-2.3 -2,-0.3 2,-0.5 -0.933 8.0-146.4-122.9 143.3 72.6 50.4 23.0 246 379 A M E -el 54 225E 1 -22,-2.8 -20,-2.1 -2,-0.4 2,-0.4 -0.926 22.8-175.4-108.1 129.4 69.8 50.5 20.4 247 380 A L E +e 55 0E 7 -193,-2.1 -191,-2.4 -2,-0.5 -22,-0.0 -0.976 19.4 170.0-130.2 140.9 70.6 51.7 16.9 248 381 A G S >> S+ 0 0 12 -2,-0.4 4,-1.7 -193,-0.2 3,-1.1 0.771 80.4 37.6-107.1 -75.1 68.6 52.3 13.8 249 382 A R H 3> S+ 0 0 156 1,-0.3 4,-0.7 2,-0.2 -2,-0.1 0.830 111.3 63.4 -49.1 -39.2 70.5 54.1 11.0 250 383 A Y H 34 S+ 0 0 31 1,-0.2 3,-0.4 2,-0.2 -1,-0.3 0.884 110.5 36.1 -53.9 -46.6 73.6 52.1 11.9 251 384 A F H X4 S+ 0 0 0 -3,-1.1 3,-1.3 1,-0.2 6,-0.3 0.741 103.4 71.9 -81.8 -24.3 72.1 48.8 11.0 252 385 A A H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.3 34,-0.2 0.627 88.8 64.9 -66.6 -14.7 70.0 50.1 8.0 253 386 A R T 3< S+ 0 0 55 -4,-0.7 36,-2.2 -3,-0.4 37,-0.7 0.675 86.8 98.6 -78.9 -23.2 73.2 50.5 6.0 254 387 A F B X S-n 290 0G 0 -3,-1.3 3,-1.6 34,-0.2 37,-0.2 -0.290 84.8-117.1 -73.5 157.1 73.8 46.7 6.0 255 388 A E T 3 S+ 0 0 65 35,-3.0 36,-0.2 1,-0.3 -1,-0.1 0.805 113.7 57.4 -56.2 -32.5 73.1 44.1 3.4 256 389 A E T 3 S+ 0 0 24 34,-0.3 -190,-0.5 -5,-0.1 -1,-0.3 0.529 76.8 106.5 -81.2 -13.4 70.7 42.4 5.9 257 390 A S S < S- 0 0 6 -3,-1.6 -196,-0.2 -6,-0.3 -195,-0.1 -0.388 80.4-117.4 -64.9 151.4 68.4 45.4 6.6 258 391 A P S S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 -197,-0.1 0.603 80.6 99.0 -68.3 -8.9 64.9 44.8 4.9 259 392 A T S S- 0 0 14 -199,-0.5 2,-0.2 12,-0.2 13,-0.1 -0.126 77.2 -93.4 -80.6 171.0 65.2 47.9 2.6 260 393 A R - 0 0 152 1,-0.0 11,-1.7 10,-0.0 2,-0.4 -0.595 28.3-127.1 -85.3 143.7 66.1 48.2 -1.1 261 394 A K E -O 270 0H 98 -2,-0.2 2,-0.4 9,-0.2 9,-0.3 -0.720 29.8-167.3 -85.9 136.7 69.6 49.0 -2.3 262 395 A V E -O 269 0H 27 7,-2.9 7,-3.3 -2,-0.4 2,-0.7 -0.992 16.3-145.0-132.8 126.1 69.5 52.0 -4.6 263 396 A T E -O 268 0H 102 -2,-0.4 2,-0.7 5,-0.2 5,-0.3 -0.824 17.8-174.1 -93.2 114.0 72.3 53.2 -6.9 264 397 A I E > -O 267 0H 59 3,-3.3 3,-2.1 -2,-0.7 -2,-0.0 -0.912 66.6 -47.1-113.3 101.6 72.3 57.0 -7.1 265 398 A N T 3 S- 0 0 149 -2,-0.7 -1,-0.1 1,-0.3 3,-0.1 0.869 125.2 -28.0 36.2 66.5 74.8 58.2 -9.6 266 399 A G T 3 S+ 0 0 72 1,-0.1 2,-0.5 0, 0.0 -1,-0.3 -0.073 120.3 96.1 96.4 -33.0 77.7 56.1 -8.5 267 400 A S E < -O 264 0H 69 -3,-2.1 -3,-3.3 20,-0.0 2,-0.5 -0.810 64.0-144.4-100.1 124.9 76.8 55.6 -4.9 268 401 A V E +O 263 0H 57 -2,-0.5 20,-1.9 -5,-0.3 -5,-0.2 -0.762 30.1 174.0 -84.6 126.5 75.0 52.6 -3.7 269 402 A M E -OP 262 287H 41 -7,-3.3 -7,-2.9 -2,-0.5 2,-0.3 -0.707 24.4-133.7-123.9 175.4 72.5 53.5 -0.9 270 403 A K E -OP 261 286H 4 16,-2.2 16,-2.1 -9,-0.3 -9,-0.2 -0.952 30.0-104.8-131.9 148.0 69.8 51.8 1.1 271 404 A E E + P 0 285H 11 -11,-1.7 2,-0.3 -2,-0.3 14,-0.2 -0.500 37.6 179.2 -74.1 146.4 66.4 53.1 1.9 272 405 A Y E + P 0 284H 19 12,-1.9 12,-3.6 -2,-0.2 2,-0.3 -0.950 5.3 167.2-150.1 123.1 65.6 54.4 5.4 273 406 A W E - P 0 283H 22 -2,-0.3 -213,-0.4 10,-0.3 10,-0.3 -0.977 32.8-113.5-136.6 150.5 62.4 55.8 6.7 274 407 A G > - 0 0 13 8,-2.5 3,-1.6 -2,-0.3 5,-0.3 -0.429 25.9-116.5 -79.3 159.5 61.2 56.6 10.2 275 408 A E T 3 S+ 0 0 58 1,-0.3 -1,-0.1 -2,-0.1 4,-0.1 0.769 118.2 52.6 -64.4 -28.2 58.3 54.8 11.9 276 409 A G T 3 S+ 0 0 60 2,-0.1 -1,-0.3 6,-0.0 2,-0.1 -0.005 88.5 113.9 -94.9 23.3 56.4 58.0 12.1 277 410 A S S < S- 0 0 16 -3,-1.6 2,-0.2 2,-0.4 5,-0.1 -0.464 87.6-104.6 -86.7 169.2 57.0 58.6 8.3 278 411 A S 0 0 138 3,-0.4 -3,-0.1 -2,-0.1 -1,-0.1 -0.064 360.0 360.0 -83.9 36.8 54.1 58.6 5.9 279 412 A R 0 0 101 -5,-0.3 -2,-0.4 -2,-0.2 3,-0.0 -0.988 360.0 360.0-140.8 360.0 55.4 55.1 4.9 280 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 281 432 A G 0 0 81 0, 0.0 -3,-0.4 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 160.9 59.1 60.9 10.2 282 433 A V - 0 0 84 -5,-0.1 -8,-2.5 -4,-0.0 2,-0.3 -0.417 360.0-161.7 -99.8 172.9 61.6 60.8 7.4 283 434 A D E +P 273 0H 84 -10,-0.3 -10,-0.3 -2,-0.1 2,-0.2 -0.889 43.4 114.5-153.0 113.7 62.3 58.8 4.3 284 435 A S E -P 272 0H 65 -12,-3.6 -12,-1.9 -2,-0.3 2,-0.3 -0.584 56.0 -81.2-152.7-144.5 65.8 59.0 2.9 285 436 A Y E -P 271 0H 94 -14,-0.2 -14,-0.2 -2,-0.2 -32,-0.1 -0.992 18.4-156.5-143.8 151.2 68.9 56.9 2.3 286 437 A V E -P 270 0H 12 -16,-2.1 -16,-2.2 -2,-0.3 2,-0.2 -0.900 41.1 -95.0-123.3 147.4 71.9 55.7 4.3 287 438 A P E -P 269 0H 81 0, 0.0 -18,-0.2 0, 0.0 2,-0.1 -0.483 43.2-111.1 -66.0 135.0 75.2 54.7 2.6 288 439 A Y + 0 0 77 -20,-1.9 -34,-0.2 -2,-0.2 -20,-0.1 -0.460 36.5 178.8 -65.8 134.9 75.4 51.0 1.9 289 440 A A - 0 0 32 -36,-2.2 2,-0.3 1,-0.4 -35,-0.2 0.426 33.9-123.1-119.3 -4.6 78.1 49.4 4.1 290 441 A G B +n 254 0G 14 -37,-0.7 -35,-3.0 4,-0.1 -1,-0.4 -0.681 64.2 1.2 98.5-153.8 78.0 45.8 3.2 291 442 A K > - 0 0 112 -2,-0.3 4,-1.1 -37,-0.2 3,-0.2 -0.449 64.2-124.0 -76.1 148.3 77.4 42.8 5.5 292 443 A L H >> S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 3,-0.6 0.918 101.3 63.3 -55.2 -51.9 76.7 43.3 9.2 293 444 A K H 3> S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.866 102.7 45.5 -41.5 -58.6 79.5 41.1 10.5 294 445 A D H 3> S+ 0 0 81 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.837 116.4 45.7 -61.3 -35.3 82.4 43.1 9.1 295 446 A N H <>S+ 0 0 0 -4,-2.6 5,-1.7 1,-0.2 3,-1.2 0.940 107.6 48.9 -56.6 -45.8 88.1 50.4 27.0 308 459 A a H ><5S+ 0 0 9 -4,-2.0 3,-1.2 1,-0.3 -1,-0.2 0.833 103.4 59.2 -65.6 -28.7 91.7 49.4 27.5 309 460 A N H 3<5S+ 0 0 85 -4,-1.9 -290,-2.3 1,-0.3 -1,-0.3 0.739 109.8 45.7 -68.0 -22.5 92.8 53.0 27.3 310 461 A C T <<5S- 0 0 6 -3,-1.2 -1,-0.3 -4,-1.0 -290,-0.3 0.372 121.1-115.7 -96.0 -0.9 90.5 53.4 30.3 311 462 A G T < 5 + 0 0 7 -3,-1.2 2,-0.4 -292,-0.3 -3,-0.2 0.882 69.3 134.0 68.2 43.9 91.9 50.2 31.8 312 463 A A < - 0 0 0 -5,-1.7 -1,-0.2 -8,-0.2 -2,-0.2 -0.981 37.9-175.9-129.9 134.0 88.8 48.1 31.7 313 464 A L S S+ 0 0 33 -2,-0.4 -282,-3.0 -283,-0.1 2,-0.3 0.458 78.0 31.2-101.2 -7.9 88.3 44.5 30.6 314 465 A T B > S-b 31 0B 39 -284,-0.2 4,-2.2 1,-0.1 -282,-0.2 -0.957 84.8-109.1-143.8 162.8 84.6 44.5 31.0 315 466 A I H > S+ 0 0 0 -284,-0.7 4,-2.7 -282,-0.3 5,-0.2 0.933 117.8 54.9 -60.8 -45.2 81.7 46.9 30.7 316 467 A P H > S+ 0 0 80 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.871 109.4 47.8 -56.8 -38.4 81.1 46.9 34.5 317 468 A Q H >> S+ 0 0 75 2,-0.2 4,-2.8 1,-0.2 3,-0.7 0.916 110.0 52.5 -66.8 -43.5 84.8 47.9 35.0 318 469 A L H 3X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.933 106.2 54.8 -56.1 -45.9 84.5 50.6 32.4 319 470 A Q H 3< S+ 0 0 52 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.726 116.1 36.2 -62.8 -25.1 81.5 52.0 34.2 320 471 A S H << S+ 0 0 99 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.2 0.780 123.3 41.4 -98.1 -28.9 83.3 52.3 37.5 321 472 A K H < S+ 0 0 92 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.702 82.8 117.2 -89.8 -26.1 86.7 53.3 36.2 322 473 A A < - 0 0 22 -4,-2.8 2,-0.7 -5,-0.3 -306,-0.0 -0.176 49.6-155.7 -51.6 132.2 85.7 55.8 33.4 323 474 A K E -A 17 0A 106 -306,-0.6 -306,-2.8 2,-0.0 2,-0.5 -0.936 19.0-168.6-111.2 103.0 86.9 59.4 33.9 324 475 A I E -A 16 0A 64 -2,-0.7 2,-0.3 -308,-0.2 -308,-0.2 -0.834 6.6-174.7-103.9 128.8 84.5 61.5 31.9 325 476 A T E -A 15 0A 56 -310,-2.8 -310,-2.2 -2,-0.5 2,-0.2 -0.887 23.2-123.6-122.4 151.5 85.0 65.2 31.1 326 477 A L E -A 14 0A 70 -2,-0.3 2,-0.3 -312,-0.2 -312,-0.2 -0.615 25.4-140.8 -86.9 148.3 82.9 67.8 29.4 327 478 A V - 0 0 28 -314,-2.8 2,-0.1 -2,-0.2 5,-0.1 -0.872 21.7-107.0-112.6 143.2 84.4 69.6 26.4 328 479 A S >> - 0 0 67 -2,-0.3 3,-0.8 1,-0.1 4,-0.7 -0.415 23.8-118.9 -72.9 148.3 83.9 73.4 25.7 329 480 A S G >4 S+ 0 0 103 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.862 116.2 51.6 -48.6 -44.3 81.6 74.6 22.9 330 481 A V G 34 S+ 0 0 131 1,-0.3 -1,-0.3 0, 0.0 -2,-0.0 0.828 100.1 62.6 -65.2 -34.1 84.6 76.2 21.1 331 482 A S G <4 0 0 87 -3,-0.8 -1,-0.3 -318,-0.0 -2,-0.2 0.699 360.0 360.0 -64.6 -18.8 86.6 73.0 21.3 332 483 A I << 0 0 111 -3,-1.0 -319,-0.0 -4,-0.7 -1,-0.0 -0.894 360.0 360.0-102.6 360.0 83.8 71.5 19.1