==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-JAN-12 3VEZ . COMPND 2 MOLECULE: O-CARBAMOYLTRANSFERASE TOBZ; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOALLOTEICHUS TENEBRARIUS; . AUTHOR C.PARTHIER,M.T.STUBBS,S.GOERLICH,F.JAENECKE . 566 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22419.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.9 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 . 32 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.9 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 0 0 1 3 1 3 3 1 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 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 0 PARALLEL BRIDGES PER LADDER . 2 2 1 4 0 3 1 1 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 0 0 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 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 M 0 0 71 0, 0.0 22,-3.1 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 157.5 8.4 44.0 36.8 2 2 A R E +A 22 0A 100 20,-0.2 63,-2.9 21,-0.1 64,-1.2 -0.951 360.0 175.7-110.1 113.1 11.1 41.3 36.7 3 3 A V E -Ab 21 66A 0 18,-2.5 18,-2.7 -2,-0.6 2,-0.7 -0.967 20.0-154.5-126.0 123.2 10.3 38.9 33.9 4 4 A L E -Ab 20 67A 0 62,-2.2 64,-3.0 -2,-0.5 2,-0.3 -0.858 13.7-158.2 -98.9 115.8 12.5 36.0 32.7 5 5 A G E -Ab 19 68A 0 14,-3.5 14,-2.3 -2,-0.7 2,-0.3 -0.723 12.5-167.8 -95.4 144.5 12.0 35.0 29.1 6 6 A L E +Ab 18 69A 0 62,-3.0 64,-2.2 -2,-0.3 2,-0.3 -0.939 19.4 175.9-135.0 147.0 13.0 31.5 27.9 7 7 A N E +A 17 0A 0 10,-1.9 10,-1.3 -2,-0.3 2,-0.0 -0.973 46.3 69.0-140.4 153.1 13.5 29.5 24.7 8 8 A G - 0 0 0 -2,-0.3 37,-0.1 8,-0.3 34,-0.1 0.104 44.4-168.3 109.9 134.5 14.8 25.9 24.4 9 9 A W - 0 0 4 36,-0.2 35,-0.5 35,-0.2 4,-0.2 -0.976 34.3-111.5-154.3 149.0 13.2 22.6 25.4 10 10 A P S S+ 0 0 66 0, 0.0 2,-0.5 0, 0.0 3,-0.2 0.747 95.9 71.1 -62.9 -24.3 14.6 19.1 25.6 11 11 A R S S- 0 0 113 1,-0.2 33,-0.1 33,-0.0 -3,-0.1 -0.836 118.8 -35.6-103.9 124.4 12.6 17.7 22.6 12 12 A D S S+ 0 0 97 -2,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.850 96.2 137.0 35.9 64.5 13.4 18.6 19.0 13 13 A F - 0 0 10 -4,-0.2 30,-3.0 -3,-0.2 2,-0.3 -0.944 33.9-164.7-138.0 156.9 14.4 22.2 19.7 14 14 A H + 0 0 75 -2,-0.3 27,-0.2 28,-0.3 28,-0.2 -0.895 58.8 28.1-138.3 166.3 17.0 24.7 18.7 15 15 A D - 0 0 30 25,-3.6 26,-0.2 -2,-0.3 -1,-0.1 0.833 66.8-166.6 52.5 44.1 18.6 28.1 19.7 16 16 A A + 0 0 1 25,-1.4 16,-2.0 24,-0.3 17,-0.5 -0.304 19.3 155.6 -54.5 139.4 17.9 27.9 23.5 17 17 A S E -AC 7 31A 0 -10,-1.3 -10,-1.9 14,-0.3 2,-0.3 -0.979 31.1-140.7-160.8 164.3 18.4 31.3 25.2 18 18 A A E -AC 6 30A 0 12,-2.3 12,-2.1 -2,-0.3 2,-0.4 -0.987 12.0-172.4-135.9 147.4 17.4 33.3 28.3 19 19 A A E -AC 5 29A 0 -14,-2.3 -14,-3.5 -2,-0.3 2,-0.6 -0.997 9.0-155.7-139.9 130.9 16.6 37.0 28.7 20 20 A L E -AC 4 28A 0 8,-3.2 7,-2.9 -2,-0.4 8,-1.1 -0.928 7.3-167.7-113.6 116.0 15.9 39.0 31.9 21 21 A L E -AC 3 26A 1 -18,-2.7 -18,-2.5 -2,-0.6 2,-0.5 -0.889 2.5-173.4 -97.6 124.1 13.8 42.2 31.8 22 22 A V E > S-AC 2 25A 36 3,-2.6 3,-2.0 -2,-0.5 -20,-0.2 -0.959 78.8 -24.5-115.3 112.5 13.9 44.4 34.8 23 23 A D T 3 S- 0 0 109 -22,-3.1 -1,-0.1 -2,-0.5 333,-0.1 0.896 128.0 -50.4 51.1 42.9 11.4 47.3 34.5 24 24 A G T 3 S+ 0 0 1 -23,-0.4 334,-1.9 1,-0.3 2,-0.3 0.433 116.1 115.5 80.3 -1.5 11.6 47.0 30.7 25 25 A R E < S-C 22 0A 164 -3,-2.0 -3,-2.6 332,-0.2 2,-1.0 -0.760 73.7-114.0-101.5 148.2 15.4 47.0 30.7 26 26 A I E +C 21 0A 29 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.692 35.4 173.6 -79.2 107.7 17.6 44.2 29.6 27 27 A A E - 0 0 25 -7,-2.9 2,-0.3 -2,-1.0 -1,-0.2 0.857 69.8 -17.7 -79.3 -36.2 19.4 43.1 32.7 28 28 A A E +C 20 0A 0 -8,-1.1 -8,-3.2 -3,-0.2 -1,-0.4 -0.961 58.8 178.0-168.6 154.2 21.0 40.2 31.0 29 29 A F E +C 19 0A 0 337,-1.8 2,-0.3 -2,-0.3 -10,-0.2 -0.895 14.7 155.8-167.4 127.2 20.5 38.0 27.8 30 30 A A E -C 18 0A 5 -12,-2.1 -12,-2.3 -2,-0.3 2,-0.4 -0.988 36.1-116.1-156.9 159.1 22.6 35.1 26.5 31 31 A E E > -C 17 0A 9 -2,-0.3 3,-1.3 -14,-0.2 4,-0.5 -0.827 22.5-130.2-100.9 140.5 22.4 32.0 24.3 32 32 A E T >> S+ 0 0 4 -16,-2.0 4,-2.1 -2,-0.4 3,-1.8 0.859 102.2 66.8 -54.0 -42.6 22.9 28.5 25.7 33 33 A E H 3> S+ 0 0 15 -17,-0.5 4,-2.3 1,-0.3 5,-0.4 0.783 91.0 64.3 -54.8 -28.0 25.5 27.5 23.1 34 34 A R H <4 S+ 0 0 16 -3,-1.3 -1,-0.3 1,-0.2 507,-0.2 0.801 111.0 35.6 -68.0 -28.8 28.0 30.0 24.5 35 35 A F H <4 S+ 0 0 47 -3,-1.8 -2,-0.2 -4,-0.5 -1,-0.2 0.848 122.5 42.9 -91.9 -39.7 28.1 28.2 27.8 36 36 A T H < S- 0 0 43 -4,-2.1 -2,-0.2 2,-0.2 -3,-0.2 0.733 95.3-138.9 -76.9 -22.5 27.8 24.6 26.5 37 37 A R < + 0 0 57 -4,-2.3 2,-0.6 -5,-0.3 -3,-0.2 0.659 66.1 123.8 66.8 16.7 30.2 25.4 23.6 38 38 A K > - 0 0 158 -5,-0.4 3,-1.4 -6,-0.2 -1,-0.2 -0.929 67.5-117.3-112.0 112.5 27.8 23.3 21.5 39 39 A K T 3 S+ 0 0 80 -2,-0.6 3,-0.4 1,-0.2 497,-0.0 -0.079 88.0 12.5 -57.5 136.3 26.6 25.4 18.5 40 40 A H T 3 S- 0 0 35 1,-0.2 -25,-3.6 -26,-0.1 -24,-0.3 0.395 98.6-107.8 84.8 -1.4 22.9 26.2 18.1 41 41 A G < - 0 0 3 -3,-1.4 -25,-1.4 -26,-0.2 3,-0.5 0.882 51.5-165.0 47.6 52.6 21.8 25.2 21.6 42 42 A Y - 0 0 119 -3,-0.4 -28,-0.3 1,-0.2 -1,-0.1 -0.358 51.3 -8.1 -72.3 143.8 20.0 22.0 20.5 43 43 A N S S+ 0 0 85 -30,-3.0 2,-0.3 1,-0.1 -1,-0.2 0.799 102.3 104.9 48.3 50.5 17.5 20.0 22.5 44 44 A T S S- 0 0 39 -3,-0.5 -35,-0.2 -35,-0.5 -1,-0.1 -0.993 71.8-113.2-155.9 144.6 17.9 21.7 25.9 45 45 A A - 0 0 5 -2,-0.3 2,-2.1 49,-0.2 3,-0.3 -0.505 50.5-104.2 -63.1 151.8 16.3 24.1 28.3 46 46 A P > + 0 0 0 0, 0.0 4,-2.9 0, 0.0 5,-0.3 -0.280 65.7 153.0 -79.7 55.1 18.4 27.2 28.6 47 47 A V H > + 0 0 32 -2,-2.1 4,-2.0 1,-0.2 5,-0.1 0.911 69.4 36.1 -51.9 -57.5 19.7 26.1 31.9 48 48 A Q H > S+ 0 0 93 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.887 115.9 54.0 -68.2 -40.0 23.1 27.9 31.9 49 49 A A H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.930 112.5 44.0 -60.4 -45.9 21.9 31.0 30.1 50 50 A A H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 5,-0.2 0.860 109.7 55.9 -68.8 -35.3 19.1 31.5 32.7 51 51 A A H X S+ 0 0 38 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.932 109.8 47.8 -60.0 -44.1 21.5 30.8 35.6 52 52 A F H X S+ 0 0 26 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.895 108.4 54.0 -60.4 -43.3 23.7 33.6 34.2 53 53 A C H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.940 112.6 43.3 -58.7 -45.8 20.8 36.0 33.8 54 54 A L H X>S+ 0 0 11 -4,-2.2 5,-3.1 2,-0.2 4,-0.5 0.895 114.8 48.6 -68.2 -41.4 19.8 35.5 37.5 55 55 A A H ><5S+ 0 0 75 -4,-2.4 3,-1.1 3,-0.2 -2,-0.2 0.934 109.6 53.4 -65.2 -43.3 23.4 35.7 38.7 56 56 A Q H 3<5S+ 0 0 74 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.921 116.1 38.4 -55.5 -46.3 24.0 38.9 36.7 57 57 A A H 3<5S- 0 0 36 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.405 110.8-120.3 -86.7 0.1 20.9 40.6 38.2 58 58 A G T <<5 + 0 0 62 -3,-1.1 2,-0.3 -4,-0.5 -3,-0.2 0.912 69.4 130.9 61.1 43.6 21.6 39.1 41.7 59 59 A L < - 0 0 28 -5,-3.1 2,-0.3 -6,-0.1 -1,-0.2 -0.782 47.0-150.7-123.4 167.8 18.2 37.4 41.6 60 60 A T > - 0 0 59 -2,-0.3 3,-2.4 -3,-0.1 4,-0.2 -0.850 44.1 -96.7-124.2 166.6 16.6 34.0 42.3 61 61 A V G > S+ 0 0 4 41,-0.5 3,-1.6 -2,-0.3 42,-0.1 0.810 123.1 65.2 -53.1 -28.0 13.5 32.6 40.7 62 62 A D G 3 S+ 0 0 45 40,-0.3 -1,-0.3 1,-0.3 41,-0.1 0.678 95.5 58.3 -70.0 -14.7 11.6 33.8 43.9 63 63 A D G < S+ 0 0 61 -3,-2.4 2,-0.3 44,-0.0 -1,-0.3 0.389 87.4 101.1 -93.1 3.4 12.4 37.4 42.8 64 64 A L < - 0 0 12 -3,-1.6 -61,-0.2 -4,-0.2 3,-0.1 -0.717 54.4-162.6 -93.4 139.8 10.6 36.9 39.4 65 65 A D S S- 0 0 68 -63,-2.9 2,-0.3 -2,-0.3 -62,-0.2 0.716 78.8 -0.3 -84.9 -25.9 7.1 38.2 38.7 66 66 A A E -b 3 0A 0 -64,-1.2 -62,-2.2 41,-0.1 2,-0.4 -0.976 54.6-144.0-159.9 147.9 6.8 36.0 35.6 67 67 A V E -bd 4 109A 0 41,-2.9 43,-3.2 -2,-0.3 2,-0.4 -0.981 26.4-161.0-110.8 131.9 8.5 33.4 33.6 68 68 A A E -bd 5 110A 0 -64,-3.0 -62,-3.0 -2,-0.4 2,-0.4 -0.943 7.5-159.0-119.3 128.5 7.8 33.6 29.8 69 69 A F E -bd 6 111A 0 41,-3.4 43,-3.0 -2,-0.4 2,-0.3 -0.912 18.6-134.9-109.8 136.2 8.3 30.9 27.2 70 70 A G S S+ 0 0 0 -64,-2.2 2,-0.3 -2,-0.4 48,-0.1 0.058 81.6 49.3 -82.0 25.9 8.6 31.9 23.5 71 71 A W S S- 0 0 18 -2,-0.3 2,-1.9 42,-0.1 41,-0.3 -0.976 86.9-111.3-149.2 152.5 6.2 29.3 22.0 72 72 A D > + 0 0 35 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 -0.612 48.8 170.3 -81.3 78.6 2.7 28.1 22.7 73 73 A L H > + 0 0 0 -2,-1.9 4,-2.2 1,-0.2 5,-0.2 0.890 68.8 54.5 -63.2 -43.1 4.2 24.8 23.9 74 74 A P H > S+ 0 0 10 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.934 109.2 50.4 -58.3 -39.4 1.0 23.4 25.4 75 75 A A H > S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.896 108.8 49.9 -65.4 -42.8 -0.8 24.0 22.0 76 76 A M H X S+ 0 0 9 -4,-2.0 4,-2.8 2,-0.2 5,-0.5 0.901 111.9 49.1 -61.6 -41.7 1.9 22.3 20.0 77 77 A Y H X S+ 0 0 15 -4,-2.2 6,-1.9 3,-0.2 4,-1.5 0.907 112.8 47.8 -62.7 -42.7 1.7 19.3 22.3 78 78 A R H X S+ 0 0 154 -4,-2.3 4,-0.5 4,-0.2 -2,-0.2 0.927 120.2 37.1 -62.3 -47.1 -2.1 19.2 22.1 79 79 A E H < S+ 0 0 124 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.928 130.8 23.0 -73.9 -48.3 -2.1 19.4 18.3 80 80 A R H < S+ 0 0 30 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.642 128.9 35.4-101.2 -15.2 0.8 17.4 17.2 81 81 A L H < S- 0 0 64 -4,-1.5 -3,-0.2 -5,-0.5 -1,-0.1 0.259 105.8-103.0-128.4 11.5 1.5 14.9 20.1 82 82 A G S < S- 0 0 78 -4,-0.5 -4,-0.2 -5,-0.1 -3,-0.1 0.819 85.8 -8.6 73.1 33.5 -1.9 14.0 21.5 83 83 A G - 0 0 30 -6,-1.9 -5,-0.1 -9,-0.1 -8,-0.0 -0.159 64.9-102.3 125.0 145.3 -1.9 16.1 24.6 84 84 A W - 0 0 35 1,-0.1 -2,-0.0 -2,-0.1 -6,-0.0 -0.889 32.4-174.5 -99.8 110.6 0.1 18.4 27.0 85 85 A P + 0 0 87 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.517 47.6 94.5 -87.5 -6.7 1.0 16.3 30.0 86 86 A H - 0 0 48 4,-0.1 2,-0.1 3,-0.0 -2,-0.0 -0.704 60.1-144.1-102.9 136.1 2.6 19.0 32.3 87 87 A S > - 0 0 54 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.485 43.3-102.9 -73.0 159.1 1.2 21.1 35.0 88 88 A D H > S+ 0 0 87 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.918 126.4 55.0 -49.9 -41.5 2.8 24.5 35.1 89 89 A S H > S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.902 108.8 46.1 -59.7 -42.7 4.9 23.3 38.0 90 90 A E H > S+ 0 0 96 2,-0.2 4,-1.2 -3,-0.2 -1,-0.2 0.839 110.5 53.3 -70.5 -32.3 6.2 20.3 36.0 91 91 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.903 108.3 50.4 -67.1 -40.8 6.9 22.5 33.0 92 92 A L H X S+ 0 0 1 -4,-2.4 4,-3.5 1,-0.2 -2,-0.2 0.882 104.3 58.0 -63.9 -39.0 9.0 24.8 35.2 93 93 A D H < S+ 0 0 56 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.849 111.9 42.3 -60.1 -35.6 10.9 21.9 36.6 94 94 A I H < S+ 0 0 54 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.884 119.5 41.9 -75.2 -41.7 11.9 21.0 33.1 95 95 A L H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.840 133.1 20.7 -75.2 -35.1 12.7 24.6 32.0 96 96 A L S < S- 0 0 2 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.647 87.2-145.9-138.0 76.3 14.4 25.6 35.2 97 97 A P >> - 0 0 31 0, 0.0 4,-2.7 0, 0.0 3,-1.5 -0.083 14.7-128.9 -50.3 137.0 15.6 22.5 37.0 98 98 A R T 34 S+ 0 0 110 1,-0.3 -4,-0.0 2,-0.2 -5,-0.0 0.764 104.1 65.4 -65.6 -26.4 15.5 22.8 40.8 99 99 A D T 34 S+ 0 0 145 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.779 119.5 25.6 -67.1 -22.9 19.1 21.7 41.3 100 100 A V T <4 S+ 0 0 67 -3,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.689 131.5 41.8-104.7 -26.8 20.1 24.9 39.5 101 101 A F S < S- 0 0 3 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.1 -0.661 73.0-169.1-125.9 74.7 17.1 27.0 40.2 102 102 A P + 0 0 91 0, 0.0 -41,-0.5 0, 0.0 -40,-0.3 -0.388 14.3 178.7 -65.0 142.6 15.9 26.6 43.8 103 103 A R - 0 0 20 -42,-0.1 3,-0.1 1,-0.1 -2,-0.0 -0.994 37.3-151.7-151.7 140.5 12.5 28.1 44.5 104 104 A R S S- 0 0 202 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 0.865 88.6 -6.0 -74.4 -39.0 10.0 28.5 47.4 105 105 A T S S- 0 0 97 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.809 86.8 -80.1-143.8 180.0 7.0 28.6 45.0 106 106 A D - 0 0 63 -2,-0.2 3,-0.1 -3,-0.1 -17,-0.1 -0.808 35.6-135.8 -94.9 125.6 6.2 28.8 41.3 107 107 A P - 0 0 10 0, 0.0 2,-0.2 0, 0.0 -41,-0.1 -0.425 45.1 -83.3 -65.4 149.9 6.4 32.0 39.4 108 108 A P - 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0 0 9 -3,-2.9 4,-2.5 1,-0.2 5,-0.1 -0.582 48.4-179.0 -76.0 89.9 19.3 37.6 5.6 315 315 A A H > S+ 0 0 2 -2,-1.7 4,-2.7 1,-0.2 161,-1.9 0.823 77.3 57.4 -61.2 -34.7 21.3 40.8 5.7 316 316 A T H > S+ 0 0 22 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.964 109.9 43.4 -61.1 -52.3 21.4 41.0 1.9 317 317 A M H > S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.904 113.2 53.8 -58.0 -44.6 17.6 41.0 1.7 318 318 A N H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.936 105.3 52.1 -55.9 -51.0 17.4 43.4 4.6 319 319 A G H X S+ 0 0 7 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.895 111.7 47.2 -53.6 -42.8 19.7 45.9 2.9 320 320 A K H < S+ 0 0 86 -4,-1.7 4,-0.3 2,-0.2 -1,-0.2 0.795 108.6 54.1 -71.6 -30.9 17.6 45.8 -0.3 321 321 A L H >< S+ 0 0 0 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.912 104.1 57.3 -64.8 -42.0 14.3 46.2 1.7 322 322 A L H 3< S+ 0 0 27 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.889 106.8 47.3 -56.4 -42.8 15.8 49.3 3.3 323 323 A T T 3< S+ 0 0 106 -4,-1.3 -1,-0.3 -5,-0.2 2,-0.2 0.464 85.8 119.4 -83.0 0.5 16.3 51.0 -0.1 324 324 A R S X S- 0 0 76 -3,-1.5 3,-2.7 -4,-0.3 -3,-0.0 -0.454 73.3-125.7 -67.8 135.1 12.8 50.1 -1.3 325 325 A S T 3 S+ 0 0 106 1,-0.3 -1,-0.1 -2,-0.2 -4,-0.0 0.721 109.5 60.0 -50.7 -22.4 10.6 53.1 -2.2 326 326 A T T 3 S+ 0 0 38 -5,-0.1 2,-0.5 1,-0.1 -1,-0.3 0.442 96.7 68.4 -89.6 0.4 8.0 51.7 0.3 327 327 A V < + 0 0 8 -3,-2.7 -23,-0.2 -6,-0.2 3,-0.1 -0.974 40.6 165.2-127.3 121.9 10.3 51.8 3.4 328 328 A D S S+ 0 0 97 -25,-2.9 2,-0.4 -2,-0.5 -24,-0.2 0.835 76.2 21.6 -95.2 -46.5 11.6 54.9 5.2 329 329 A K E -h 304 0B 108 -26,-1.7 -24,-2.8 2,-0.0 2,-0.4 -0.948 66.0-169.1-126.8 145.5 12.8 53.3 8.4 330 330 A M E -h 305 0B 29 -2,-0.4 2,-0.4 -26,-0.2 -24,-0.2 -0.993 6.5-173.3-135.1 136.8 13.7 49.8 9.3 331 331 A F E +h 306 0B 27 -26,-2.6 -24,-1.8 -2,-0.4 -205,-0.1 -0.964 10.2 166.0-130.7 122.2 14.4 47.9 12.5 332 332 A V - 0 0 4 -2,-0.4 -24,-0.1 -26,-0.2 140,-0.1 -0.978 31.9-133.4-129.9 115.5 15.7 44.3 12.7 333 333 A P > - 0 0 0 0, 0.0 3,-0.9 0, 0.0 -211,-0.1 -0.257 20.2-117.2 -67.5 154.9 17.0 43.2 16.1 334 334 A P T 3 S+ 0 0 9 0, 0.0 3,-0.3 0, 0.0 84,-0.2 0.749 115.3 58.4 -62.7 -19.7 20.3 41.3 16.3 335 335 A V T 3 + 0 0 0 1,-0.2 5,-0.4 -214,-0.2 -26,-0.2 -0.285 62.2 137.5-107.4 47.2 18.2 38.5 17.7 336 336 A A < + 0 0 0 -3,-0.9 -27,-2.2 -2,-0.1 -1,-0.2 0.827 57.8 71.4 -60.7 -34.6 15.9 38.0 14.7 337 337 A S S > S- 0 0 14 -3,-0.3 3,-2.5 -27,-0.2 4,-0.2 -0.084 113.9 -75.9 -75.4-176.5 16.1 34.2 14.9 338 338 A D G > S+ 0 0 9 1,-0.3 3,-1.6 2,-0.2 4,-0.5 0.692 123.0 76.9 -57.1 -23.2 14.6 32.0 17.7 339 339 A I G > S+ 0 0 2 1,-0.3 3,-0.6 2,-0.1 4,-0.5 0.852 94.6 55.4 -52.4 -27.1 17.4 33.1 20.1 340 340 A G G <> S+ 0 0 0 -3,-2.5 4,-2.2 -5,-0.4 -1,-0.3 0.576 84.4 78.7 -86.9 -11.1 15.3 36.3 20.2 341 341 A V H <> S+ 0 0 0 -3,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.687 86.6 60.5 -75.7 -16.3 12.0 34.8 21.3 342 342 A S H <> S+ 0 0 0 -3,-0.6 4,-2.3 -4,-0.5 -336,-0.3 0.963 111.4 40.6 -66.9 -50.8 13.0 34.4 24.9 343 343 A L H > S+ 0 0 0 -4,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.874 117.1 50.7 -60.1 -40.9 13.5 38.2 25.0 344 344 A G H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.914 108.8 48.9 -65.1 -45.5 10.3 38.6 22.9 345 345 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.928 112.1 51.1 -60.5 -42.3 8.2 36.4 25.2 346 346 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 -278,-0.2 -2,-0.2 0.901 110.7 47.3 -61.0 -45.4 9.5 38.4 28.2 347 347 A A H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 5,-0.3 0.930 109.8 52.7 -62.6 -46.1 8.7 41.8 26.6 348 348 A A H X S+ 0 0 15 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.916 115.1 41.9 -57.1 -43.0 5.2 40.7 25.6 349 349 A V H X S+ 0 0 2 -4,-2.1 4,-1.2 -5,-0.2 -2,-0.2 0.941 114.1 51.0 -71.0 -46.7 4.6 39.6 29.2 350 350 A A H ><>S+ 0 0 0 -4,-3.1 5,-2.7 1,-0.2 3,-0.5 0.905 110.5 48.9 -55.7 -48.1 6.2 42.6 30.8 351 351 A V H ><5S+ 0 0 42 -4,-3.2 3,-1.4 1,-0.2 -1,-0.2 0.884 108.8 54.5 -57.5 -39.9 4.2 45.0 28.6 352 352 A E H 3<5S+ 0 0 132 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.740 105.4 53.1 -65.7 -25.5 1.1 43.0 29.7 353 353 A L T <<5S- 0 0 59 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.296 130.9 -95.3 -93.1 7.0 2.1 43.6 33.3 354 354 A G T < 5S+ 0 0 60 -3,-1.4 -3,-0.2 1,-0.3 -2,-0.1 0.484 77.8 139.7 98.2 5.7 2.2 47.4 32.6 355 355 A D < - 0 0 29 -5,-2.7 2,-0.5 -6,-0.2 -1,-0.3 -0.395 46.5-135.2 -80.3 156.5 5.9 47.9 31.9 356 356 A R - 0 0 224 -333,-0.1 2,-0.5 -2,-0.1 -1,-0.0 -0.960 21.8-133.6-109.9 133.2 7.4 50.1 29.2 357 357 A I - 0 0 27 -2,-0.5 -332,-0.2 -10,-0.0 -230,-0.1 -0.743 13.9-136.0 -93.3 126.7 10.2 48.5 27.2 358 358 A A - 0 0 16 -334,-1.9 -332,-0.1 -2,-0.5 -334,-0.0 -0.520 28.0-102.7 -77.3 146.0 13.4 50.5 26.6 359 359 A P - 0 0 75 0, 0.0 -233,-0.2 0, 0.0 -234,-0.1 -0.269 27.3-118.6 -58.5 152.1 15.0 50.5 23.1 360 360 A M - 0 0 14 -235,-2.2 -234,-0.1 -335,-0.1 -334,-0.1 0.905 37.3-145.9 -61.6 -44.0 18.1 48.4 22.7 361 361 A G - 0 0 47 -236,-0.4 3,-0.1 1,-0.2 -235,-0.1 0.856 53.0 -59.9 80.9 37.4 20.2 51.4 21.9 362 362 A D S S+ 0 0 48 1,-0.2 2,-0.3 107,-0.0 141,-0.3 0.832 109.9 99.5 69.4 31.6 22.7 50.2 19.3 363 363 A T - 0 0 34 139,-0.1 -1,-0.2 1,-0.0 109,-0.1 -0.992 42.8-177.1-146.9 148.6 24.3 47.5 21.5 364 364 A A + 0 0 3 -2,-0.3 2,-1.9 107,-0.1 51,-1.7 0.138 48.6 122.9-124.2 15.1 24.0 43.8 21.8 365 365 A A B +K 414 0E 16 49,-0.2 49,-0.3 1,-0.2 47,-0.2 -0.504 25.2 123.0 -86.7 76.0 26.4 43.4 24.7 366 366 A W + 0 0 20 -2,-1.9 -337,-1.8 47,-0.5 -1,-0.2 0.310 47.0 92.5-116.1 4.3 24.1 41.7 27.2 367 367 A G S S- 0 0 3 46,-2.9 -337,-0.1 1,-0.2 48,-0.1 -0.078 86.5 -51.3 -91.6-168.6 26.1 38.6 27.9 368 368 A P - 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