==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-AUG-09 3ILJ . COMPND 2 MOLECULE: 2-AMINO-4-HYDROXY-6-HYDROXYMETHYLDIHYDROPTERIDINE . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.BLASZCZYK,Y.LI,H.YAN,X.JI . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8760.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 60.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 24.7 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 10 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 22.8 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+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 0 0 0 0 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 2 1 0 1 0 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 . 1 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 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 T 0 0 63 0, 0.0 61,-2.5 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 136.2 14.4 1.2 6.5 2 2 A V E -A 61 0A 46 59,-0.2 100,-2.6 61,-0.1 2,-0.4 -0.867 360.0-172.1 -93.5 117.9 15.1 4.4 4.7 3 3 A A E -AB 60 101A 0 57,-3.1 57,-3.2 -2,-0.7 2,-0.6 -0.866 14.7-143.9-106.6 142.6 13.2 7.2 6.2 4 4 A Y E -AB 59 100A 47 96,-2.7 95,-2.7 -2,-0.4 96,-1.3 -0.943 19.0-170.7-110.4 124.0 13.0 10.7 4.7 5 5 A I E -AB 58 98A 0 53,-2.8 53,-2.8 -2,-0.6 2,-0.4 -0.921 12.3-146.5-117.7 132.9 12.9 13.5 7.2 6 6 A A E -AB 57 97A 6 91,-2.9 91,-2.3 -2,-0.4 2,-0.4 -0.824 12.3-160.2 -96.2 138.9 12.3 17.2 6.5 7 7 A I E +AB 56 96A 0 49,-2.8 49,-2.0 -2,-0.4 2,-0.4 -0.969 11.1 177.7-116.6 134.2 14.1 19.8 8.6 8 8 A G E -AB 55 95A 5 87,-2.2 87,-2.9 -2,-0.4 2,-0.4 -1.000 4.6-179.4-135.4 136.3 12.9 23.4 8.8 9 9 A S E -AB 54 94A 0 45,-2.2 45,-2.8 -2,-0.4 85,-0.2 -0.999 14.5-172.0-133.1 135.2 14.3 26.3 10.9 10 10 A N + 0 0 6 83,-1.5 84,-0.1 -2,-0.4 83,-0.1 0.165 44.9 127.7-109.5 17.6 12.9 29.8 11.1 11 11 A L - 0 0 49 82,-0.4 -2,-0.1 1,-0.1 4,-0.0 -0.382 68.3-123.8 -66.5 150.9 15.8 31.3 13.1 12 12 A A S S+ 0 0 94 1,-0.3 -1,-0.1 2,-0.1 40,-0.1 0.886 113.8 24.9 -61.4 -38.8 17.4 34.5 11.7 13 13 A S S S+ 0 0 104 1,-0.1 3,-0.4 2,-0.0 4,-0.3 -0.785 80.1 161.9-128.0 84.3 20.8 32.6 11.7 14 14 A P > + 0 0 2 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.483 43.9 94.9 -87.4 -8.8 19.7 28.9 11.5 15 15 A L H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.866 86.7 46.0 -58.8 -41.7 22.9 27.2 10.5 16 16 A E H > S+ 0 0 171 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.881 114.5 47.9 -71.9 -36.6 24.1 26.2 13.9 17 17 A Q H > S+ 0 0 18 -4,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.926 111.3 50.5 -66.5 -45.5 20.7 24.9 15.0 18 18 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.902 111.4 49.1 -60.2 -40.7 20.3 22.9 11.8 19 19 A N H X S+ 0 0 91 -4,-2.2 4,-2.7 -5,-0.2 5,-0.2 0.920 109.5 50.7 -65.9 -43.2 23.7 21.4 12.3 20 20 A A H X S+ 0 0 33 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.881 112.5 48.6 -57.2 -39.0 22.9 20.5 15.9 21 21 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.923 110.5 49.9 -68.7 -44.9 19.7 18.9 14.6 22 22 A L H X S+ 0 0 18 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.918 111.0 49.0 -59.3 -44.5 21.6 17.0 11.9 23 23 A K H X S+ 0 0 136 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.935 110.8 51.6 -63.0 -41.7 24.1 15.7 14.4 24 24 A A H < S+ 0 0 11 -4,-2.0 4,-0.5 -5,-0.2 3,-0.4 0.869 106.8 52.9 -60.7 -39.8 21.3 14.6 16.6 25 25 A L H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.904 109.1 49.3 -63.6 -39.4 19.5 12.7 13.8 26 26 A G H 3< S+ 0 0 27 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.661 106.9 57.4 -73.3 -16.1 22.7 10.8 13.1 27 27 A D T 3< S+ 0 0 104 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.508 77.0 120.4 -90.4 -8.8 23.0 10.0 16.8 28 28 A I S X S- 0 0 3 -3,-1.0 3,-1.4 -4,-0.5 41,-0.0 -0.338 77.8 -96.6 -57.6 134.7 19.6 8.3 17.0 29 29 A P T 3 S+ 0 0 63 0, 0.0 35,-0.2 0, 0.0 34,-0.2 -0.211 103.8 5.5 -54.1 141.8 20.0 4.7 18.1 30 30 A E T 3 S+ 0 0 137 1,-0.2 33,-1.9 32,-0.1 2,-0.3 0.703 116.5 97.5 60.4 24.3 20.1 2.1 15.3 31 31 A S E < +C 62 0A 14 -3,-1.4 2,-0.3 31,-0.2 31,-0.2 -0.950 45.2 178.5-141.1 154.3 20.1 4.9 12.7 32 32 A H E -C 61 0A 100 29,-2.4 29,-2.7 -2,-0.3 2,-0.3 -0.983 35.5-100.2-156.4 154.5 22.5 6.8 10.5 33 33 A I E +C 60 0A 53 -2,-0.3 27,-0.2 27,-0.2 3,-0.1 -0.583 29.5 177.7 -76.3 128.8 22.4 9.6 7.9 34 34 A L E - 0 0 78 25,-3.1 2,-0.3 1,-0.4 26,-0.2 0.826 68.8 -7.3 -90.8 -42.9 22.7 8.4 4.3 35 35 A T E -C 59 0A 65 24,-1.3 24,-2.7 2,-0.0 2,-0.4 -0.994 53.3-154.7-155.9 145.2 22.3 11.7 2.6 36 36 A V E -C 58 0A 53 -2,-0.3 22,-0.2 22,-0.2 3,-0.1 -0.998 22.5-132.1-125.5 132.0 21.5 15.4 3.3 37 37 A S - 0 0 5 20,-3.0 91,-0.1 -2,-0.4 3,-0.0 -0.158 38.5 -83.9 -66.2 167.9 20.0 17.7 0.7 38 38 A S - 0 0 40 89,-0.1 2,-0.5 1,-0.1 19,-0.3 -0.300 52.7 -99.8 -58.3 161.0 21.4 21.2 0.1 39 39 A F - 0 0 50 17,-0.1 119,-2.9 -3,-0.1 2,-0.3 -0.780 44.5-158.3 -86.2 132.2 20.1 23.8 2.5 40 40 A Y E -DE 55 157A 19 15,-2.7 15,-2.4 -2,-0.5 2,-0.5 -0.854 13.8-135.1-117.1 150.4 17.3 25.9 0.8 41 41 A R E -DE 54 156A 84 115,-2.8 115,-0.7 -2,-0.3 13,-0.2 -0.886 22.3-165.9-104.6 124.2 15.9 29.3 1.5 42 42 A T E -D 53 0A 8 11,-2.5 11,-2.6 -2,-0.5 113,-0.1 -0.966 17.5-119.4-122.3 127.5 12.1 29.5 1.5 43 43 A P - 0 0 81 0, 0.0 2,-0.6 0, 0.0 10,-0.1 0.185 14.6-118.0 -55.9 163.7 10.1 32.8 1.4 44 44 A P - 0 0 30 0, 0.0 2,-0.2 0, 0.0 8,-0.1 -0.971 40.3-143.7 -95.9 118.2 7.6 34.4 3.8 45 45 A L - 0 0 139 -2,-0.6 5,-0.1 3,-0.0 0, 0.0 -0.612 63.2 -15.3 -87.7 147.7 4.6 34.5 1.5 46 46 A G S S+ 0 0 74 -2,-0.2 4,-0.0 2,-0.0 0, 0.0 -0.484 125.6 59.9 64.2-112.8 2.2 37.4 1.8 47 47 A P S S- 0 0 93 0, 0.0 3,-0.4 0, 0.0 0, 0.0 -0.268 71.0-164.2 -45.9 120.9 3.2 39.1 5.1 48 48 A Q S S+ 0 0 146 1,-0.2 -2,-0.0 -5,-0.0 -3,-0.0 0.802 73.1 79.5 -85.7 -33.4 6.9 40.0 4.5 49 49 A D S S+ 0 0 138 2,-0.0 -1,-0.2 0, 0.0 0, 0.0 0.606 73.2 103.0 -57.2 -9.7 8.0 40.7 8.1 50 50 A Q S S- 0 0 51 -3,-0.4 2,-0.1 -5,-0.1 -4,-0.0 -0.512 78.1-118.5 -69.9 142.7 8.2 36.9 8.4 51 51 A P - 0 0 64 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.439 30.6 -93.5 -81.2 157.8 11.8 35.5 8.3 52 52 A D - 0 0 52 -2,-0.1 2,-0.3 -40,-0.1 -11,-0.0 -0.405 38.3-132.3 -65.4 143.0 13.1 33.1 5.7 53 53 A Y E - D 0 42A 54 -11,-2.6 -11,-2.5 -10,-0.1 2,-0.6 -0.726 4.6-139.4 -90.6 146.7 13.0 29.4 6.5 54 54 A L E -AD 9 41A 0 -45,-2.8 -45,-2.2 -2,-0.3 2,-0.4 -0.954 30.1-175.9 -97.6 124.6 15.9 27.1 6.0 55 55 A N E +AD 8 40A 8 -15,-2.4 -15,-2.7 -2,-0.6 2,-0.3 -0.947 10.7 157.4-121.7 143.6 14.6 23.8 4.7 56 56 A A E -A 7 0A 3 -49,-2.0 -49,-2.8 -2,-0.4 2,-0.4 -0.976 29.0-130.6-152.5 167.4 16.3 20.5 3.9 57 57 A A E -A 6 0A 1 -19,-0.3 -20,-3.0 -2,-0.3 2,-0.4 -0.946 16.8-161.3-122.3 146.4 15.7 16.8 3.5 58 58 A V E -AC 5 36A 0 -53,-2.8 -53,-2.8 -2,-0.4 2,-0.7 -0.989 12.5-147.7-127.4 134.5 17.5 14.0 5.1 59 59 A A E -AC 4 35A 5 -24,-2.7 -25,-3.1 -2,-0.4 -24,-1.3 -0.922 25.4-172.4 -96.4 116.7 17.6 10.3 4.2 60 60 A L E -AC 3 33A 0 -57,-3.2 -57,-3.1 -2,-0.7 2,-0.4 -0.952 17.4-147.9-115.0 122.3 18.0 8.3 7.4 61 61 A E E +AC 2 32A 53 -29,-2.7 -29,-2.4 -2,-0.5 2,-0.3 -0.739 33.7 165.4 -81.2 133.2 18.7 4.6 7.5 62 62 A T E - C 0 31A 0 -61,-2.5 -31,-0.2 -2,-0.4 -32,-0.1 -0.994 43.4-161.9-153.0 144.7 17.0 3.2 10.6 63 63 A S + 0 0 90 -33,-1.9 -32,-0.1 -2,-0.3 -33,-0.1 0.363 65.0 111.5-100.5 0.4 16.0 -0.1 12.2 64 64 A L S S- 0 0 7 -34,-0.3 -2,-0.1 -35,-0.2 -34,-0.0 -0.340 78.1-102.5 -71.3 154.7 13.7 1.6 14.6 65 65 A A > - 0 0 27 1,-0.1 4,-2.1 -2,-0.1 3,-0.4 -0.427 38.1-109.8 -67.6 153.1 9.9 1.3 14.5 66 66 A P H > S+ 0 0 14 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.866 119.6 50.8 -56.8 -39.4 8.3 4.4 13.0 67 67 A E H > S+ 0 0 101 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.842 108.0 53.0 -70.8 -30.5 6.8 5.5 16.3 68 68 A E H > S+ 0 0 86 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.880 108.3 50.9 -66.4 -40.0 10.2 5.1 18.0 69 69 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.930 108.1 52.0 -62.7 -44.0 11.7 7.4 15.3 70 70 A L H X S+ 0 0 16 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.877 104.4 57.8 -58.5 -39.4 8.9 9.9 15.9 71 71 A N H X S+ 0 0 77 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.946 109.5 44.7 -55.5 -49.1 9.9 9.8 19.6 72 72 A H H X S+ 0 0 38 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.884 111.8 49.7 -65.7 -42.4 13.4 10.8 18.8 73 73 A T H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.896 112.9 48.7 -64.5 -38.2 12.5 13.6 16.3 74 74 A Q H X S+ 0 0 82 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.873 110.8 50.7 -67.6 -37.2 10.1 15.0 18.9 75 75 A R H X S+ 0 0 81 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.915 109.8 50.4 -62.4 -44.0 12.8 14.8 21.6 76 76 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.897 108.2 52.7 -65.4 -38.8 15.2 16.6 19.3 77 77 A E H X S+ 0 0 22 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.914 112.1 45.4 -57.5 -44.9 12.7 19.3 18.6 78 78 A L H < S+ 0 0 129 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.880 119.1 41.9 -68.1 -39.0 12.3 19.8 22.4 79 79 A Q H < S+ 0 0 115 -4,-2.6 -2,-0.2 1,-0.1 -1,-0.2 0.857 123.9 33.4 -76.9 -36.7 16.0 19.8 23.0 80 80 A Q H < S+ 0 0 72 -4,-2.9 2,-0.2 -5,-0.2 -2,-0.2 0.541 121.0 25.5-103.6 -9.2 17.2 21.9 20.0 81 81 A G < - 0 0 22 -4,-1.6 2,-0.3 -5,-0.3 -72,-0.0 -0.767 63.0-131.8-141.5-172.6 14.4 24.4 19.6 82 82 A R - 0 0 131 -2,-0.2 11,-2.3 -3,-0.0 2,-0.7 -0.924 27.9-102.5-141.6 164.2 11.5 26.3 21.2 83 83 A V B -F 92 0B 81 -2,-0.3 9,-0.3 9,-0.2 2,-0.2 -0.827 36.2-127.8 -94.3 116.6 7.8 27.0 20.6 84 84 A R - 0 0 55 7,-1.6 3,-0.0 -2,-0.7 6,-0.0 -0.451 8.5-148.1 -62.9 125.0 7.2 30.6 19.4 85 85 A K S S+ 0 0 211 -2,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.358 79.4 84.7 -76.6 6.4 4.6 32.2 21.6 86 86 A A S S- 0 0 55 4,-0.2 2,-0.2 1,-0.1 -1,-0.1 0.980 96.6 -55.8 -72.2 -83.5 3.4 34.2 18.6 87 87 A E - 0 0 144 3,-0.3 -1,-0.1 -3,-0.0 -3,-0.0 -0.483 53.2 -83.1-141.0-156.0 0.9 32.3 16.5 88 88 A R S S+ 0 0 185 -2,-0.2 4,-0.1 -3,-0.1 -4,-0.0 0.557 106.6 86.3 -97.9 -16.8 0.4 29.0 14.6 89 89 A W S S+ 0 0 131 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.958 107.4 15.8 -43.1 -74.8 2.2 30.5 11.6 90 90 A G S S+ 0 0 6 1,-0.2 -3,-0.3 -80,-0.0 -1,-0.3 -0.882 78.6 175.8-104.1 97.8 5.7 29.5 12.8 91 91 A P + 0 0 35 0, 0.0 -7,-1.6 0, 0.0 2,-0.3 0.979 63.9 11.0 -65.7 -61.6 5.0 27.0 15.5 92 92 A R B -F 83 0B 84 -9,-0.3 -9,-0.2 -4,-0.1 -82,-0.2 -0.854 64.3-129.7-121.7 154.7 8.5 25.9 16.5 93 93 A T S S+ 0 0 3 -11,-2.3 -83,-1.5 -2,-0.3 2,-0.5 0.858 104.2 36.5 -69.5 -35.0 11.9 27.3 15.7 94 94 A L E S-B 9 0A 0 -12,-0.3 2,-0.5 -85,-0.2 -1,-0.2 -0.980 73.6-173.5-120.8 124.4 13.0 23.8 14.6 95 95 A A E -B 8 0A 24 -87,-2.9 -87,-2.2 -2,-0.5 2,-0.5 -0.972 5.2-172.8-120.2 129.5 10.6 21.4 12.9 96 96 A L E -B 7 0A 6 -2,-0.5 2,-0.4 -89,-0.2 -89,-0.2 -0.987 10.9-177.7-117.8 125.8 11.4 17.8 12.1 97 97 A D E -B 6 0A 47 -91,-2.3 -91,-2.9 -2,-0.5 2,-0.9 -0.987 27.0-134.7-128.3 134.2 8.8 15.9 10.0 98 98 A I E +B 5 0A 9 -2,-0.4 -93,-0.2 -93,-0.2 3,-0.1 -0.772 27.8 174.2 -85.1 109.2 8.8 12.3 8.9 99 99 A M E + 0 0 0 -95,-2.7 16,-1.7 -2,-0.9 2,-0.3 0.941 65.8 1.3 -80.2 -52.6 7.9 12.5 5.2 100 100 A L E -B 4 0A 6 -96,-1.3 -96,-2.7 14,-0.2 2,-0.4 -0.978 53.9-161.2-136.3 150.0 8.3 8.9 4.2 101 101 A F E > -B 3 0A 2 3,-0.5 3,-2.5 -2,-0.3 -98,-0.2 -0.867 64.1 -68.3-132.6 96.8 9.2 5.7 6.2 102 102 A G T 3 S- 0 0 28 -100,-2.6 -1,-0.3 -2,-0.4 -98,-0.1 -0.288 99.3 -41.9 50.1-136.3 10.3 3.0 3.8 103 103 A N T 3 S+ 0 0 111 -3,-0.1 -1,-0.3 34,-0.1 2,-0.2 0.127 104.3 132.9-103.0 20.2 7.2 2.0 1.8 104 104 A E < - 0 0 83 -3,-2.5 2,-0.5 1,-0.0 -3,-0.5 -0.467 47.2-150.4 -80.1 143.4 5.0 2.1 4.9 105 105 A V - 0 0 90 -2,-0.2 2,-0.4 33,-0.1 -2,-0.1 -0.936 20.3-176.2-103.6 128.3 1.6 3.7 5.1 106 106 A I E +G 113 0C 18 7,-2.7 7,-2.5 -2,-0.5 2,-0.1 -0.995 17.5 167.2-131.4 133.3 0.8 4.9 8.7 107 107 A N E +G 112 0C 123 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.606 30.1 132.6-144.0 74.3 -2.4 6.4 9.9 108 108 A T S S- 0 0 72 3,-3.0 -2,-0.1 -2,-0.1 0, 0.0 -0.592 71.9 -93.1-115.3-179.2 -2.4 6.6 13.7 109 109 A E S S+ 0 0 193 -2,-0.2 3,-0.1 1,-0.2 -1,-0.0 0.790 126.9 31.3 -62.2 -28.5 -3.2 9.2 16.3 110 110 A R S S+ 0 0 112 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.729 120.8 43.7 -99.8 -28.0 0.5 10.1 16.4 111 111 A L - 0 0 14 2,-0.0 -3,-3.0 4,-0.0 2,-0.5 -0.972 44.2-179.8-139.4 122.8 1.6 9.5 12.9 112 112 A T E -G 107 0C 62 -2,-0.4 4,-0.4 -5,-0.2 -5,-0.2 -0.981 28.7-149.9-117.1 116.1 0.5 10.1 9.3 113 113 A V E S+G 106 0C 2 -7,-2.5 -7,-2.7 -2,-0.5 2,-0.2 -1.000 82.7 43.0-134.0 132.0 2.9 8.8 6.7 114 114 A P S S- 0 0 36 0, 0.0 -14,-0.2 0, 0.0 -15,-0.1 0.573 121.5 -94.3 -58.1 152.3 3.4 9.9 4.0 115 115 A H > - 0 0 22 -16,-1.7 3,-1.2 -2,-0.2 4,-0.4 -0.164 35.2-122.3 -50.7 134.2 3.2 13.3 5.7 116 116 A Y T 3 S+ 0 0 166 -4,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.708 101.7 24.0 -58.3 -28.5 -0.3 14.6 5.4 117 117 A D T > S+ 0 0 41 1,-0.1 3,-2.1 2,-0.1 4,-0.3 0.341 84.8 108.9-121.5 6.2 0.5 17.8 3.6 118 118 A M G X S+ 0 0 2 -3,-1.2 3,-1.7 1,-0.3 7,-0.3 0.810 72.6 63.5 -60.4 -31.8 3.8 17.3 1.9 119 119 A K G 3 S+ 0 0 86 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.623 104.6 50.3 -67.6 -7.9 2.3 17.2 -1.6 120 120 A N G < S+ 0 0 90 -3,-2.1 2,-0.6 1,-0.1 -1,-0.3 0.400 96.9 81.6-104.1 -1.2 1.2 20.8 -1.0 121 121 A R X> - 0 0 49 -3,-1.7 4,-2.4 -4,-0.3 3,-1.5 -0.883 48.9-175.0-118.6 104.8 4.7 22.0 0.1 122 122 A G H 3> S+ 0 0 10 -2,-0.6 4,-2.6 1,-0.3 -1,-0.2 0.844 89.0 64.1 -61.5 -32.1 7.4 22.9 -2.4 123 123 A F H 34 S+ 0 0 75 1,-0.2 -1,-0.3 2,-0.2 -83,-0.1 0.630 111.4 36.5 -70.0 -12.4 9.7 23.4 0.5 124 124 A M H <> S+ 0 0 4 -3,-1.5 4,-1.5 -6,-0.2 -2,-0.2 0.778 119.1 47.5 -98.0 -42.4 9.4 19.7 1.3 125 125 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 -7,-0.3 -2,-0.2 0.905 108.5 51.6 -69.4 -45.0 9.2 18.4 -2.3 126 126 A W H X S+ 0 0 47 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.932 111.4 44.1 -65.2 -47.2 12.1 20.2 -3.8 127 127 A P H > S+ 0 0 1 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.900 115.7 50.3 -65.4 -34.5 14.8 19.3 -1.3 128 128 A L H X S+ 0 0 0 -4,-1.5 4,-1.7 1,-0.2 3,-0.2 0.888 106.9 54.6 -64.9 -39.6 13.4 15.7 -1.3 129 129 A F H < S+ 0 0 58 -4,-2.6 -1,-0.2 1,-0.2 -3,-0.2 0.810 101.6 59.9 -64.5 -30.4 13.6 15.6 -5.1 130 130 A E H < S+ 0 0 76 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.915 117.1 29.7 -63.0 -42.2 17.3 16.7 -5.0 131 131 A I H < S+ 0 0 35 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.577 136.1 25.9 -96.3 -11.8 18.2 13.6 -3.0 132 132 A A >< + 0 0 10 -4,-1.7 3,-2.0 -5,-0.1 -1,-0.2 -0.314 61.8 159.3-149.5 58.5 15.6 11.1 -4.3 133 133 A P T 3 S+ 0 0 51 0, 0.0 11,-0.4 0, 0.0 -4,-0.1 0.734 80.0 50.3 -58.0 -25.1 14.4 12.2 -7.8 134 134 A E T 3 S+ 0 0 153 9,-0.1 -5,-0.1 -3,-0.1 -2,-0.0 0.377 80.1 144.3 -93.2 3.7 13.1 8.6 -8.5 135 135 A L < - 0 0 17 -3,-2.0 8,-2.1 -7,-0.1 2,-0.4 -0.112 31.0-164.2 -55.7 132.5 11.1 8.3 -5.3 136 136 A V B -H 142 0D 78 6,-0.2 6,-0.2 7,-0.1 5,-0.1 -0.976 16.3-131.7-115.8 131.6 7.8 6.4 -5.5 137 137 A F > - 0 0 3 4,-2.9 3,-2.4 -2,-0.4 -34,-0.1 -0.363 31.3-101.1 -75.1 160.9 5.2 6.7 -2.8 138 138 A P T 3 S+ 0 0 28 0, 0.0 -1,-0.1 0, 0.0 -33,-0.1 0.832 123.5 51.6 -54.1 -34.0 3.6 3.6 -1.2 139 139 A D T 3 S- 0 0 109 1,-0.0 3,-0.1 2,-0.0 -36,-0.0 0.484 124.9-100.2 -85.1 0.5 0.4 4.2 -3.3 140 140 A G S < S+ 0 0 44 -3,-2.4 -1,-0.0 1,-0.3 0, 0.0 0.316 76.7 138.1 99.1 -7.9 2.4 4.5 -6.5 141 141 A E - 0 0 60 -5,-0.1 -4,-2.9 1,-0.1 2,-0.4 -0.329 47.1-133.5 -62.9 157.7 2.4 8.2 -6.9 142 142 A M B > -H 136 0D 62 -6,-0.2 4,-2.2 1,-0.1 -6,-0.2 -0.958 8.6-140.4-122.2 131.7 5.7 9.6 -8.0 143 143 A L H > S+ 0 0 0 -8,-2.1 4,-2.1 -2,-0.4 5,-0.2 0.898 107.4 52.8 -51.7 -45.1 7.6 12.6 -6.5 144 144 A R H > S+ 0 0 105 -9,-0.4 4,-1.8 -11,-0.4 -1,-0.2 0.905 108.5 50.4 -58.0 -42.0 8.6 13.7 -10.0 145 145 A Q H > S+ 0 0 68 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.881 106.9 53.6 -65.6 -39.6 5.0 13.6 -11.1 146 146 A I H X S+ 0 0 14 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.929 112.6 43.7 -60.8 -45.9 3.8 15.7 -8.2 147 147 A L H X S+ 0 0 15 -4,-2.1 4,-1.3 1,-0.2 5,-0.3 0.801 115.3 50.6 -67.5 -28.3 6.3 18.4 -9.0 148 148 A H H < S+ 0 0 143 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.807 113.5 44.2 -80.4 -31.6 5.4 18.0 -12.7 149 149 A T H < S+ 0 0 100 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.878 121.3 36.2 -75.8 -39.9 1.6 18.4 -12.0 150 150 A R H < S- 0 0 119 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.746 84.9-144.7 -92.6 -29.8 1.8 21.3 -9.6 151 151 A A < - 0 0 82 -4,-1.3 2,-0.4 -5,-0.2 -3,-0.1 0.992 21.8-171.5 56.4 68.9 4.6 23.6 -10.8 152 152 A F - 0 0 34 -5,-0.3 -1,-0.2 1,-0.1 3,-0.1 -0.768 32.5-100.8 -86.0 136.0 6.0 24.8 -7.4 153 153 A D - 0 0 146 -2,-0.4 -1,-0.1 1,-0.1 2,-0.0 -0.256 42.7-107.7 -52.4 138.3 8.6 27.6 -7.7 154 154 A K - 0 0 165 1,-0.1 2,-0.4 -28,-0.0 -1,-0.1 -0.358 32.9-121.7 -66.0 150.9 12.1 26.3 -7.3 155 155 A L - 0 0 31 -33,-0.1 2,-0.2 -3,-0.1 -113,-0.1 -0.785 15.7-130.5 -97.2 139.3 13.9 27.2 -4.1 156 156 A N E -E 41 0A 130 -115,-0.7 -115,-2.8 -2,-0.4 2,-0.2 -0.491 33.6-103.5 -77.1 156.9 17.1 29.1 -4.0 157 157 A K E E 40 0A 128 -117,-0.3 -117,-0.3 -2,-0.2 -1,-0.1 -0.516 360.0 360.0 -83.6 152.9 19.9 27.6 -1.9 158 158 A W 0 0 91 -119,-2.9 -118,-0.1 -2,-0.2 -1,-0.1 0.929 360.0 360.0 -56.1 360.0 20.7 29.1 1.5