==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-DEC-03 1RR2 . COMPND 2 MOLECULE: TRANSCARBOXYLASE 5S SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: PROPIONIBACTERIUM FREUDENREICHII SUBSP . AUTHOR P.R.HALL,R.ZHENG,L.ANTONY,M.PUSZTAI-CAREY,P.R.CAREY,V.C.YEE . 472 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19715.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 329 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 0.4 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 . 1 0.2 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 . 22 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 165 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.5 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 1 1 5 1 1 1 2 2 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 0 4 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 . 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 3 A P 0 0 172 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 78.3 95.7 56.4 -27.5 2 4 A R + 0 0 241 1,-0.0 2,-0.3 2,-0.0 0, 0.0 -0.295 360.0 169.0 -62.6 129.6 93.9 53.3 -26.1 3 5 A E - 0 0 172 -2,-0.1 2,-0.4 2,-0.0 -1,-0.0 -0.930 27.3-143.6-140.9 163.3 94.8 52.4 -22.5 4 6 A I - 0 0 87 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.995 21.2-130.5-131.1 126.2 93.6 50.2 -19.6 5 7 A E - 0 0 138 -2,-0.4 2,-0.3 226,-0.0 -2,-0.0 -0.598 30.0-172.2 -76.5 132.4 93.7 51.2 -16.0 6 8 A V - 0 0 71 -2,-0.3 225,-0.2 225,-0.1 224,-0.1 -0.906 28.1 -94.8-124.9 157.0 95.3 48.5 -13.8 7 9 A S - 0 0 16 223,-2.2 3,-0.1 -2,-0.3 225,-0.1 -0.242 50.6 -92.7 -67.0 155.4 95.7 48.2 -10.0 8 10 A E - 0 0 118 1,-0.2 -1,-0.1 224,-0.0 224,-0.0 -0.222 57.9 -74.3 -65.5 157.2 98.8 49.5 -8.3 9 11 A P S S+ 0 0 99 0, 0.0 2,-0.3 0, 0.0 255,-0.2 -0.220 76.7 139.8 -51.4 138.1 101.7 47.1 -7.7 10 12 A R E -a 264 0A 42 253,-0.9 255,-1.7 -3,-0.1 2,-0.4 -0.987 54.9 -83.1-173.1 169.4 100.8 44.8 -4.8 11 13 A E E -a 265 0A 129 -2,-0.3 2,-0.5 253,-0.2 255,-0.2 -0.689 36.7-150.0 -88.4 134.4 100.8 41.3 -3.4 12 14 A V - 0 0 2 253,-3.3 255,-0.4 -2,-0.4 223,-0.2 -0.920 14.9-131.0-106.3 130.8 98.1 38.9 -4.7 13 15 A G E -b 235 0B 17 221,-2.7 223,-2.0 -2,-0.5 2,-0.4 -0.496 16.9-149.7 -80.2 151.9 96.9 36.2 -2.3 14 16 A I E -b 236 0B 2 33,-0.3 35,-2.7 221,-0.2 36,-0.9 -0.976 5.8-158.0-126.5 132.3 96.6 32.6 -3.4 15 17 A T E -bc 237 50B 0 221,-2.0 223,-2.4 -2,-0.4 2,-0.4 -0.941 17.9-142.3-107.7 120.0 94.2 29.9 -2.1 16 18 A E E -bc 238 51B 0 34,-1.6 36,-2.2 -2,-0.6 223,-0.2 -0.681 17.8-177.2 -83.4 132.7 95.4 26.3 -2.8 17 19 A L > > + 0 0 0 221,-2.1 5,-2.2 -2,-0.4 3,-2.2 0.382 51.4 107.2-110.4 2.0 92.6 23.8 -3.7 18 20 A V T 3 >S+ 0 0 0 1,-0.3 5,-0.5 220,-0.3 -1,-0.1 0.824 78.8 53.8 -55.3 -33.6 94.7 20.6 -4.0 19 21 A L T 3 5S- 0 0 0 33,-0.4 -1,-0.3 -3,-0.2 34,-0.1 0.566 130.1 -0.0 -81.5 -6.4 93.2 19.2 -0.7 20 22 A R T <>5S+ 0 0 0 -3,-2.2 4,-1.9 32,-0.2 3,-0.2 0.343 130.1 31.9-141.4 -80.8 89.6 19.6 -1.8 21 23 A D H >5S+ 0 0 2 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.843 111.7 61.5 -61.0 -36.4 88.3 21.0 -5.1 22 24 A A H >< S- 0 0 0 -4,-1.9 3,-1.9 -5,-0.2 264,-0.2 -0.103 107.6 -96.1-137.8 43.2 89.3 12.2 -9.6 28 30 A A T 3< S- 0 0 40 -4,-0.5 -4,-0.3 1,-0.3 -3,-0.1 0.796 72.6 -70.2 51.8 39.3 85.7 12.3 -8.3 29 31 A T T 3 S+ 0 0 11 -6,-2.5 -1,-0.3 1,-0.1 -5,-0.2 0.704 100.0 131.3 58.7 23.4 86.7 13.3 -4.7 30 32 A R < + 0 0 45 -3,-1.9 431,-0.4 -7,-0.5 2,-0.2 0.411 22.3 134.1 -88.5 3.9 88.3 9.9 -4.2 31 33 A M - 0 0 0 -11,-0.1 2,-0.2 1,-0.1 5,-0.1 -0.328 53.8-133.1 -59.4 122.1 91.6 11.3 -2.9 32 34 A A > - 0 0 1 -2,-0.2 3,-1.3 1,-0.1 4,-0.4 -0.487 9.2-125.9 -77.3 146.6 92.5 9.2 0.2 33 35 A M G >> S+ 0 0 19 426,-0.3 4,-2.1 1,-0.3 3,-1.8 0.881 110.1 58.9 -60.2 -38.6 93.6 11.0 3.4 34 36 A E G 34 S+ 0 0 142 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.744 102.6 55.5 -66.7 -16.9 96.8 9.0 3.6 35 37 A D G <4 S+ 0 0 11 -3,-1.3 -1,-0.3 1,-0.1 -2,-0.2 0.550 114.1 39.4 -88.3 -7.2 97.7 10.3 0.2 36 38 A M T X4 S+ 0 0 0 -3,-1.8 3,-2.5 -4,-0.4 4,-0.5 0.788 94.6 73.5-110.3 -37.4 97.4 13.9 1.3 37 39 A V G >< S+ 0 0 48 -4,-2.1 3,-1.2 1,-0.3 4,-0.5 0.779 87.1 68.6 -53.6 -29.2 98.8 14.2 4.9 38 40 A G G 3 S+ 0 0 49 -4,-0.4 -1,-0.3 1,-0.2 4,-0.2 0.700 102.3 44.4 -65.6 -15.7 102.4 13.9 3.5 39 41 A A G <> S+ 0 0 0 -3,-2.5 4,-2.7 1,-0.1 -1,-0.2 0.451 86.6 93.8-105.8 -2.1 102.1 17.3 1.9 40 42 A C H <> S+ 0 0 1 -3,-1.2 4,-2.9 -4,-0.5 5,-0.2 0.904 82.2 51.9 -61.0 -44.7 100.5 19.2 4.8 41 43 A A H > S+ 0 0 65 -4,-0.5 4,-1.0 1,-0.2 -1,-0.2 0.935 115.1 42.4 -60.4 -43.5 103.8 20.5 6.3 42 44 A D H 4 S+ 0 0 27 -4,-0.2 3,-0.4 2,-0.2 4,-0.4 0.906 114.4 51.1 -69.4 -38.8 104.9 22.0 3.0 43 45 A I H >< S+ 0 0 1 -4,-2.7 3,-1.1 1,-0.2 5,-0.5 0.915 108.4 53.1 -62.4 -40.2 101.4 23.3 2.2 44 46 A D H 3< S+ 0 0 23 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.751 115.2 40.1 -67.6 -25.2 101.3 25.0 5.6 45 47 A A T 3< S+ 0 0 42 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.299 90.4 92.3-107.6 10.9 104.7 26.7 5.0 46 48 A A S < S- 0 0 1 -3,-1.1 223,-2.4 -4,-0.4 227,-0.2 0.851 96.6-112.5 -76.1 -34.2 104.0 27.6 1.3 47 49 A G + 0 0 47 -4,-0.5 220,-0.3 221,-0.2 -33,-0.3 0.594 55.6 161.2 112.1 17.3 102.6 31.1 1.9 48 50 A Y - 0 0 23 -5,-0.5 37,-0.3 1,-0.1 -33,-0.2 -0.306 45.3-134.4 -69.9 151.5 99.0 30.6 0.8 49 51 A W S S- 0 0 39 -35,-2.7 36,-0.3 1,-0.3 2,-0.3 0.906 88.5 -11.2 -70.2 -41.9 96.2 33.0 1.9 50 52 A S E -c 15 0B 0 -36,-0.9 -34,-1.6 34,-0.1 2,-0.5 -0.969 60.8-131.8-152.4 164.5 94.0 29.9 2.7 51 53 A V E -cd 16 86B 1 34,-2.9 36,-2.6 -2,-0.3 2,-0.6 -0.949 17.6-147.7-124.1 105.6 94.0 26.2 2.2 52 54 A E E + d 0 87B 0 -36,-2.2 -33,-0.4 -2,-0.5 -32,-0.2 -0.651 42.1 141.9 -74.8 119.0 90.7 24.8 0.9 53 55 A C E + 0 0 0 34,-2.4 2,-0.3 -2,-0.6 35,-0.2 0.281 49.9 42.7-144.5 13.1 90.5 21.3 2.5 54 56 A W E S+ d 0 88B 0 33,-1.0 35,-1.1 20,-0.0 -1,-0.1 -0.962 80.6 35.0-154.8 169.0 86.9 20.6 3.6 55 57 A G E > + d 0 89B 0 -2,-0.3 3,-1.7 33,-0.2 35,-0.2 -0.316 69.9 84.8 80.9-165.8 83.3 20.8 2.5 56 58 A G T 3 S- 0 0 20 33,-1.9 3,-0.5 1,-0.2 4,-0.3 -0.455 117.6 -30.7 66.1-140.1 82.0 20.4 -1.0 57 59 A A T 3> S+ 0 0 31 1,-0.2 4,-2.5 2,-0.1 -1,-0.2 0.352 118.0 94.0 -93.0 6.2 81.5 16.7 -1.8 58 60 A T H <> S+ 0 0 0 -3,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.857 80.5 56.1 -68.6 -32.9 84.3 15.5 0.5 59 61 A Y H > S+ 0 0 0 -3,-0.5 4,-1.9 2,-0.2 5,-0.3 0.979 112.2 42.3 -60.6 -52.6 81.9 14.9 3.4 60 62 A D H > S+ 0 0 33 -4,-0.3 4,-3.2 1,-0.2 5,-0.4 0.949 115.8 49.3 -56.3 -52.2 79.8 12.6 1.2 61 63 A S H X>S+ 0 0 2 -4,-2.5 4,-2.3 1,-0.2 5,-1.8 0.873 107.1 56.1 -58.3 -40.8 82.9 10.9 -0.3 62 64 A C H <5S+ 0 0 0 -4,-2.7 6,-3.3 3,-0.2 4,-0.4 0.953 119.2 29.7 -58.4 -49.6 84.5 10.3 3.1 63 65 A I H <5S+ 0 0 7 -4,-1.9 -2,-0.2 4,-0.2 -1,-0.2 0.827 126.0 43.6 -84.2 -29.2 81.5 8.4 4.5 64 66 A R H <5S+ 0 0 119 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.2 0.841 132.3 9.7 -87.6 -32.2 80.2 6.9 1.3 65 67 A F T <5S+ 0 0 77 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.1 0.699 130.1 40.4-121.6 -27.0 83.4 5.7 -0.4 66 68 A L S > - 0 0 16 -2,-0.4 4,-1.9 1,-0.2 3,-0.7 -0.727 15.8-151.1 -83.6 116.0 85.0 10.3 9.3 70 72 A P H 3> S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.848 96.8 55.9 -52.4 -40.4 84.9 13.9 7.7 71 73 A W H 3> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.858 105.4 50.8 -65.9 -33.5 85.3 15.4 11.2 72 74 A E H <> S+ 0 0 97 -3,-0.7 4,-2.3 2,-0.2 -1,-0.2 0.903 107.7 53.6 -72.1 -34.5 88.5 13.4 11.8 73 75 A R H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.934 109.5 48.7 -62.0 -42.3 89.8 14.6 8.4 74 76 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.938 110.9 49.4 -62.4 -47.7 89.2 18.2 9.6 75 77 A R H X S+ 0 0 84 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.888 111.4 49.6 -60.8 -38.3 90.9 17.7 12.9 76 78 A T H X S+ 0 0 27 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.934 111.5 47.5 -68.0 -45.2 93.9 16.1 11.3 77 79 A F H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.912 110.9 52.7 -61.5 -40.3 94.3 19.0 8.7 78 80 A R H < S+ 0 0 56 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.895 114.5 42.5 -60.7 -39.6 93.9 21.5 11.6 79 81 A K H < S+ 0 0 139 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.872 116.4 45.8 -76.0 -40.1 96.7 19.7 13.5 80 82 A L H < S+ 0 0 55 -4,-3.0 -36,-0.2 1,-0.2 -2,-0.2 0.669 121.2 38.4 -80.6 -16.6 99.0 19.2 10.5 81 83 A M >< + 0 0 0 -4,-1.8 3,-1.5 -5,-0.2 -1,-0.2 -0.424 69.0 156.8-131.2 61.8 98.6 22.8 9.2 82 84 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.665 72.2 48.5 -59.4 -22.2 98.5 24.9 12.4 83 85 A N T 3 S+ 0 0 136 2,-0.1 2,-0.3 0, 0.0 -5,-0.0 0.408 96.2 91.7-102.2 4.1 99.6 28.2 10.8 84 86 A S S < S- 0 0 17 -3,-1.5 2,-0.8 -6,-0.2 -34,-0.1 -0.666 76.9-120.3-104.2 154.5 97.2 28.1 7.8 85 87 A R - 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0 0 58 -50,-0.9 4,-2.3 -2,-0.3 3,-0.4 -0.248 34.5-150.5 -47.0 107.5 57.1 31.4 -16.4 390 392 A P H > S+ 0 0 103 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.864 96.2 55.5 -55.6 -29.7 53.8 31.8 -14.5 391 393 A K H > S+ 0 0 158 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.915 110.0 42.9 -68.8 -41.5 52.3 29.3 -17.0 392 394 A V H > S+ 0 0 9 -3,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.798 113.6 55.1 -73.6 -25.4 54.9 26.6 -16.3 393 395 A V H X S+ 0 0 21 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.935 104.6 51.5 -69.0 -48.1 54.6 27.4 -12.6 394 396 A K H X S+ 0 0 130 -4,-2.6 4,-1.8 1,-0.2 3,-0.3 0.920 108.8 51.1 -56.5 -47.2 50.8 26.9 -12.6 395 397 A L H X S+ 0 0 67 -4,-1.6 4,-1.2 1,-0.3 -1,-0.2 0.898 106.5 54.8 -57.7 -42.7 51.3 23.4 -14.2 396 398 A A H X S+ 0 0 0 -4,-1.5 4,-0.6 1,-0.2 6,-0.4 0.860 108.4 49.6 -59.2 -35.3 53.9 22.5 -11.5 397 399 A E H X S+ 0 0 63 -4,-1.7 4,-1.8 -3,-0.3 -1,-0.2 0.841 113.1 45.4 -73.0 -33.1 51.2 23.4 -9.0 398 400 A E H < S+ 0 0 129 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.560 114.6 49.2 -87.1 -8.8 48.6 21.2 -10.7 399 401 A Q H < S+ 0 0 80 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.469 127.2 22.1-106.2 -5.2 51.1 18.4 -11.2 400 402 A S H < S- 0 0 54 -4,-0.6 -3,-0.2 -3,-0.2 -2,-0.2 0.590 90.0-132.2-128.8 -34.2 52.3 18.3 -7.5 401 403 A G < + 0 0 65 -4,-1.8 2,-0.2 -5,-0.4 -4,-0.1 0.461 62.6 129.1 90.7 -0.3 49.5 19.9 -5.5 402 404 A K - 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0 0 51 -4,-0.5 -310,-0.2 -3,-0.3 3,-0.1 -0.475 62.6-142.8 -72.2 130.0 61.0 24.2 8.4 414 416 A P - 0 0 87 0, 0.0 -312,-0.2 0, 0.0 -2,-0.1 -0.375 37.9 -73.6 -85.7 166.1 60.2 23.2 12.0 415 417 A P + 0 0 105 0, 0.0 -312,-0.0 0, 0.0 4,-0.0 -0.336 55.7 165.1 -58.0 143.2 62.9 22.4 14.7 416 418 A E > + 0 0 16 -3,-0.1 4,-2.7 2,-0.1 5,-0.2 0.451 44.2 95.5-139.6 -10.0 64.4 19.0 13.8 417 419 A W H > S+ 0 0 5 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.950 88.4 48.3 -52.2 -57.1 67.6 18.6 15.9 418 420 A E H > S+ 0 0 140 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.867 113.9 48.2 -53.6 -39.3 66.0 16.7 18.8 419 421 A K H > S+ 0 0 134 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.877 112.2 48.7 -69.3 -39.2 64.4 14.4 16.2 420 422 A Q H X S+ 0 0 13 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.936 110.9 50.9 -65.7 -45.5 67.7 13.9 14.4 421 423 A S H X S+ 0 0 25 -4,-3.1 4,-2.3 -5,-0.2 -2,-0.2 0.929 110.1 49.2 -57.7 -50.0 69.5 13.2 17.6 422 424 A K H < S+ 0 0 163 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.959 114.5 43.5 -55.8 -55.9 67.0 10.5 18.7 423 425 A E H >< S+ 0 0 56 -4,-2.0 3,-1.5 1,-0.2 -1,-0.2 0.911 114.2 50.5 -57.7 -46.0 67.0 8.6 15.4 424 426 A A H >< S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.3 -1,-0.2 0.873 101.5 62.6 -62.1 -37.0 70.8 8.8 15.1 425 427 A A T 3< S+ 0 0 61 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.564 95.7 61.4 -68.0 -7.5 71.3 7.5 18.7 426 428 A T T < S+ 0 0 112 -3,-1.5 2,-0.4 -4,-0.4 -1,-0.3 0.455 83.3 101.9 -97.1 -0.9 69.6 4.2 17.6 427 429 A L S X S- 0 0 37 -3,-1.9 3,-1.9 -4,-0.2 2,-0.3 -0.681 80.7-114.6 -89.0 134.2 72.3 3.4 15.0 428 430 A K T 3 S+ 0 0 146 -2,-0.4 3,-0.1 1,-0.3 -2,-0.1 -0.478 104.6 25.9 -63.6 124.6 75.0 0.8 15.8 429 431 A G T 3 S+ 0 0 37 1,-0.3 -1,-0.3 -2,-0.3 2,-0.1 0.229 80.0 145.4 104.5 -15.4 78.3 2.7 15.8 430 432 A F < - 0 0 45 -3,-1.9 -1,-0.3 -6,-0.2 -5,-0.0 -0.379 36.5-158.3 -56.9 128.6 76.9 6.2 16.8 431 433 A N - 0 0 77 2,-0.1 -1,-0.2 -3,-0.1 4,-0.1 0.350 35.1-115.8 -95.3 6.6 79.5 7.8 19.0 432 434 A G S S+ 0 0 50 1,-0.2 2,-0.2 -8,-0.1 -2,-0.1 0.459 71.0 129.0 78.3 0.6 77.1 10.2 20.7 433 435 A T S > S- 0 0 51 1,-0.1 4,-2.0 4,-0.0 3,-0.4 -0.526 70.2-121.8 -90.3 157.0 78.6 13.4 19.4 434 436 A D H > S+ 0 0 49 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.852 115.0 65.1 -61.7 -32.1 76.8 16.3 17.6 435 437 A E H > S+ 0 0 14 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.925 104.0 43.9 -55.5 -44.9 79.3 15.5 14.7 436 438 A D H > S+ 0 0 0 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.892 111.1 53.3 -69.4 -40.1 77.7 12.1 14.3 437 439 A V H X S+ 0 0 4 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.929 109.3 50.5 -60.2 -41.4 74.1 13.5 14.6 438 440 A L H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.928 106.6 54.2 -62.0 -41.9 75.1 15.9 11.8 439 441 A T H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 8,-0.3 0.902 111.9 45.0 -60.0 -37.3 76.4 13.0 9.7 440 442 A Y H < S+ 0 0 31 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.903 113.9 48.6 -71.3 -41.4 73.0 11.3 10.2 441 443 A A H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.868 118.0 40.8 -66.6 -37.9 71.0 14.5 9.4 442 444 A L H < S+ 0 0 0 -4,-2.9 -344,-0.5 1,-0.2 -2,-0.2 0.847 132.8 20.5 -80.2 -37.6 73.1 15.2 6.3 443 445 A F >X + 0 0 23 -4,-2.2 4,-3.0 -5,-0.3 3,-0.9 -0.549 65.2 166.4-136.6 73.1 73.3 11.6 5.0 444 446 A P T 34 S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.822 80.0 48.4 -52.8 -39.0 70.5 9.5 6.5 445 447 A Q T 34 S+ 0 0 169 1,-0.1 4,-0.4 2,-0.1 -5,-0.1 0.690 120.0 35.9 -81.0 -20.7 71.0 6.6 4.0 446 448 A V T <> S+ 0 0 13 -3,-0.9 4,-2.6 -7,-0.2 3,-0.4 0.805 98.0 76.9-100.7 -37.2 74.8 6.4 4.4 447 449 A A H X S+ 0 0 0 -4,-3.0 4,-3.0 -8,-0.3 5,-0.2 0.852 93.3 55.0 -41.9 -48.0 75.2 7.2 8.2 448 450 A P H > S+ 0 0 44 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.952 112.5 39.3 -53.5 -55.6 74.0 3.6 9.1 449 451 A V H > S+ 0 0 87 -3,-0.4 4,-0.8 -4,-0.4 -2,-0.2 0.901 117.7 50.2 -63.1 -42.1 76.6 1.7 7.0 450 452 A F H >X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 3,-0.9 0.928 106.5 55.4 -65.0 -43.8 79.4 4.2 7.9 451 453 A F H 3< S+ 0 0 6 -4,-3.0 4,-0.3 -5,-0.3 -1,-0.2 0.874 110.8 43.6 -60.7 -36.0 78.7 4.0 11.6 452 454 A E H 3< S+ 0 0 98 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.613 122.0 37.8 -90.0 -2.9 79.1 0.2 11.8 453 455 A H H X< S+ 0 0 66 -3,-0.9 3,-2.9 -4,-0.8 4,-0.3 0.594 87.7 92.3-114.6 -17.2 82.2 0.1 9.6 454 456 A R G >< S+ 0 0 43 -4,-2.4 3,-2.4 1,-0.3 -385,-0.1 0.803 74.3 70.5 -47.2 -36.6 84.0 3.2 10.7 455 457 A A G 3 S+ 0 0 106 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.690 85.5 69.4 -59.4 -17.5 86.0 1.2 13.3 456 458 A E G < S- 0 0 112 -3,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.658 108.9-121.2 -72.8 -18.2 87.9 -0.5 10.4 457 459 A G < - 0 0 25 -3,-2.4 -1,-0.2 -4,-0.3 -2,-0.1 -0.041 41.8 -49.3 93.2 157.7 89.6 2.8 9.7 458 460 A P - 0 0 77 0, 0.0 -391,-0.2 0, 0.0 2,-0.2 -0.330 59.2-162.1 -65.8 148.6 89.6 4.8 6.4 459 461 A H - 0 0 79 -393,-2.5 2,-0.4 -426,-0.0 -426,-0.3 -0.563 12.0-124.0-119.3-174.7 90.3 3.0 3.2 460 462 A S - 0 0 45 -2,-0.2 -429,-0.1 2,-0.1 -394,-0.0 -0.993 8.9-165.8-134.6 139.5 91.4 3.9 -0.4 461 463 A V + 0 0 61 -431,-0.4 2,-0.1 -2,-0.4 -430,-0.1 0.190 63.0 107.1-107.2 13.1 89.6 3.0 -3.6 462 464 A A S S- 0 0 10 -432,-0.1 -175,-0.2 1,-0.1 -2,-0.1 -0.468 83.4 -89.6 -86.4 161.5 92.8 4.0 -5.6 463 465 A L - 0 0 23 -177,-2.9 2,-0.2 -2,-0.1 -1,-0.1 -0.398 42.3-123.6 -68.6 148.5 95.0 1.5 -7.3 464 466 A T > - 0 0 71 1,-0.1 4,-2.2 -3,-0.1 5,-0.2 -0.488 26.3-106.2 -86.9 164.7 97.9 0.2 -5.1 465 467 A D H > S+ 0 0 106 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.907 125.4 53.8 -56.2 -37.3 101.5 0.5 -6.2 466 468 A A H > S+ 0 0 70 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.925 107.8 47.5 -61.8 -47.3 101.3 -3.2 -6.9 467 469 A Q H > S+ 0 0 97 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.808 109.6 55.6 -66.3 -28.6 98.2 -2.8 -9.1 468 470 A L H X S+ 0 0 40 -4,-2.2 4,-1.4 1,-0.2 3,-0.3 0.946 107.0 47.3 -68.3 -47.4 100.0 0.0 -10.9 469 471 A K H < S+ 0 0 168 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.737 107.2 61.2 -64.9 -21.2 102.9 -2.2 -11.8 470 472 A A H < S+ 0 0 78 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.906 102.2 48.4 -71.5 -42.8 100.4 -4.8 -12.9 471 473 A E H < 0 0 99 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.826 360.0 360.0 -65.0 -31.6 98.9 -2.4 -15.6 472 474 A A < 0 0 116 -4,-1.4 -3,-0.0 -5,-0.1 0, 0.0 -0.043 360.0 360.0 -84.4 360.0 102.5 -1.8 -16.7