==== 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 TRANSFERASE 15-DEC-09 2X0K . COMPND 2 MOLECULE: RIBOFLAVIN BIOSYNTHESIS PROTEIN RIBF; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM AMMONIAGENES; . AUTHOR B.HERGUEDAS,J.A.HERMOSO,M.MARTINEZ-JULVEZ,M.MEDINA,S.FRAGO . 676 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32211.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 466 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 104 15.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 55 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.7 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 2 0 4 2 2 2 0 0 0 0 0 1 1 0 0 0 0 0 0 2 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 4 6 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 6 0 0 3 1 1 5 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 . 6 0 0 0 2 0 2 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 51 0, 0.0 576,-0.3 0, 0.0 87,-0.2 0.000 360.0 360.0 360.0 130.7 38.7 121.3 30.3 2 2 A D E -a 88 0A 72 85,-2.2 87,-2.4 574,-0.1 2,-0.4 -0.546 360.0-158.4 -78.3 146.0 39.0 125.1 30.1 3 3 A I E -a 89 0A 7 574,-0.3 2,-0.5 85,-0.2 87,-0.2 -0.977 9.5-172.2-128.3 116.6 42.2 126.7 28.6 4 4 A W E -a 90 0A 23 85,-3.2 87,-3.4 -2,-0.4 2,-0.9 -0.933 14.6-153.3-112.5 124.8 42.9 130.3 29.6 5 5 A Y E S-a 91 0A 34 -2,-0.5 4,-0.2 85,-0.2 87,-0.2 -0.846 71.3 -10.0 -95.8 103.1 45.7 132.4 28.1 6 6 A G S > S- 0 0 13 85,-2.4 3,-1.3 -2,-0.9 4,-0.4 0.158 86.2 -82.4 91.4 154.1 46.6 135.0 30.7 7 7 A T G > S+ 0 0 15 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.845 123.3 63.8 -59.4 -35.9 45.0 136.1 34.0 8 8 A A G 3 S+ 0 0 84 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.733 96.7 57.9 -60.2 -27.1 42.5 138.3 32.2 9 9 A A G < S+ 0 0 42 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.2 0.616 81.4 103.1 -81.4 -14.6 40.9 135.3 30.4 10 10 A V S < S- 0 0 10 -3,-1.4 2,-0.0 -4,-0.4 80,-0.0 -0.495 86.6-101.7 -69.9 136.7 40.0 133.6 33.7 11 11 A P > - 0 0 50 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 -0.358 20.0-141.0 -60.5 136.7 36.3 133.9 34.6 12 12 A K T 3 S+ 0 0 206 1,-0.2 -2,-0.1 -4,-0.1 -3,-0.0 0.741 99.3 60.8 -69.2 -23.9 35.6 136.6 37.2 13 13 A D T 3 + 0 0 135 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.311 67.9 133.1 -90.1 7.4 33.0 134.4 38.8 14 14 A L < - 0 0 16 -3,-1.2 3,-0.1 100,-0.2 -4,-0.0 -0.439 35.3-173.5 -54.6 127.1 35.4 131.6 39.6 15 15 A D - 0 0 135 1,-0.3 2,-0.3 -2,-0.1 -1,-0.2 0.806 53.9 -2.4-103.4 -36.8 34.5 130.8 43.2 16 16 A N + 0 0 39 30,-0.0 32,-1.8 2,-0.0 -1,-0.3 -0.965 60.1 174.8-161.3 139.0 37.1 128.3 44.5 17 17 A S E -bc 48 117A 0 99,-1.2 101,-2.8 -2,-0.3 102,-1.1 -0.986 28.6-141.7-145.0 155.8 40.1 126.3 43.3 18 18 A A E -bc 49 119A 0 30,-2.6 32,-2.9 -2,-0.3 2,-0.4 -0.992 39.0-160.7-108.6 128.8 42.9 124.0 44.2 19 19 A V E -bc 50 120A 0 100,-2.7 102,-2.9 -2,-0.5 2,-0.4 -0.889 21.5-170.2-123.5 136.2 45.9 125.0 42.1 20 20 A T E -bc 51 121A 0 30,-2.5 32,-3.1 -2,-0.4 2,-0.4 -0.970 16.0-156.7-120.1 144.8 49.2 123.5 41.0 21 21 A I E +b 52 0A 4 100,-1.1 102,-0.4 -2,-0.4 2,-0.3 -0.974 32.9 94.0-127.8 128.5 51.9 125.6 39.4 22 22 A G S S- 0 0 17 30,-2.6 32,-0.3 -2,-0.4 -2,-0.1 -0.929 74.7 -91.1 172.6 172.3 54.8 124.6 37.1 23 23 A V - 0 0 35 -2,-0.3 31,-0.3 30,-0.2 -1,-0.1 0.906 48.2-167.2 -65.7 -39.1 56.2 124.3 33.5 24 24 A F > + 0 0 2 1,-0.2 3,-1.4 -3,-0.1 2,-0.5 0.737 12.2 178.2 59.9 27.6 55.0 120.6 33.6 25 25 A D T 3 S+ 0 0 2 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 -0.478 70.9 5.2 -69.3 116.4 57.0 119.7 30.5 26 26 A G T 3 S- 0 0 0 -2,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.106 94.3-121.1 101.9 -19.4 56.4 116.0 29.8 27 27 A V < - 0 0 0 -3,-1.4 -1,-0.2 45,-0.1 -2,-0.1 0.937 50.6-176.6 39.1 58.6 53.9 115.5 32.6 28 28 A H > - 0 0 9 -3,-0.3 4,-2.3 1,-0.1 155,-0.2 -0.042 42.9 -82.5 -75.6-179.6 56.2 112.9 34.1 29 29 A R H > S+ 0 0 61 153,-2.3 4,-1.3 1,-0.2 154,-0.1 0.824 130.7 51.9 -60.4 -33.4 55.6 110.8 37.2 30 30 A G H > S+ 0 0 13 152,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.911 109.6 49.6 -65.0 -44.5 56.7 113.6 39.5 31 31 A H H > S+ 0 0 22 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.880 105.2 58.6 -59.3 -39.6 54.3 116.0 37.8 32 32 A Q H X S+ 0 0 30 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.861 99.9 57.1 -62.7 -34.3 51.5 113.4 38.2 33 33 A K H X S+ 0 0 115 -4,-1.3 4,-2.3 -3,-0.2 -1,-0.2 0.926 109.4 45.3 -58.6 -45.9 52.0 113.4 42.0 34 34 A L H X S+ 0 0 15 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.919 115.4 46.5 -65.0 -44.4 51.4 117.2 42.1 35 35 A I H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.928 112.0 50.0 -65.3 -46.0 48.3 116.9 39.8 36 36 A N H X S+ 0 0 67 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.921 110.6 50.4 -59.5 -44.3 46.9 113.9 41.7 37 37 A A H X S+ 0 0 20 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.894 113.5 46.2 -56.9 -42.8 47.3 115.9 45.0 38 38 A T H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.903 113.1 47.4 -68.8 -44.0 45.5 118.9 43.4 39 39 A V H X S+ 0 0 39 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.894 111.0 53.0 -67.0 -39.6 42.7 116.8 41.9 40 40 A E H X S+ 0 0 108 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.930 111.4 44.6 -61.8 -47.2 42.1 115.0 45.2 41 41 A K H X S+ 0 0 68 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.897 110.9 53.7 -65.2 -41.8 41.8 118.2 47.2 42 42 A A H X>S+ 0 0 4 -4,-2.2 5,-2.8 1,-0.2 4,-0.8 0.876 110.0 48.8 -60.1 -39.1 39.5 119.9 44.6 43 43 A R H <5S+ 0 0 168 -4,-2.0 3,-0.5 3,-0.2 -1,-0.2 0.925 109.0 53.6 -62.5 -47.2 37.2 116.8 44.8 44 44 A E H <5S+ 0 0 103 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.853 120.0 30.6 -58.9 -40.6 37.2 116.9 48.6 45 45 A V H <5S- 0 0 73 -4,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.407 110.2-113.1-101.7 0.1 36.1 120.6 48.9 46 46 A G T <5S+ 0 0 63 -4,-0.8 2,-0.2 -3,-0.5 -3,-0.2 0.930 72.1 130.0 66.8 47.0 34.1 120.8 45.6 47 47 A A < - 0 0 17 -5,-2.8 2,-0.3 -6,-0.2 -30,-0.2 -0.697 63.0 -90.1-120.6 174.3 36.4 123.1 43.8 48 48 A K E -b 17 0A 66 -32,-1.8 -30,-2.6 -2,-0.2 2,-0.6 -0.688 31.5-131.3 -85.5 139.3 38.0 123.2 40.4 49 49 A A E -b 18 0A 0 -2,-0.3 38,-2.6 36,-0.3 39,-1.4 -0.850 33.5-170.0 -89.3 118.4 41.5 121.6 40.0 50 50 A I E -bd 19 88A 0 -32,-2.9 -30,-2.5 -2,-0.6 2,-0.5 -0.925 17.7-155.6-118.9 134.7 43.6 124.2 38.1 51 51 A M E -bd 20 89A 0 37,-2.6 39,-2.9 -2,-0.4 2,-0.6 -0.942 6.0-159.2-103.6 126.3 47.0 123.9 36.5 52 52 A V E +bd 21 90A 0 -32,-3.1 -30,-2.6 -2,-0.5 2,-0.2 -0.936 27.2 164.6-100.0 117.0 49.0 127.1 36.1 53 53 A T E - d 0 91A 0 37,-2.8 39,-2.9 -2,-0.6 2,-0.4 -0.744 28.3-115.9-128.5-179.7 51.7 126.6 33.4 54 54 A F E - d 0 92A 11 -32,-0.3 39,-0.2 -31,-0.3 37,-0.1 -0.955 15.7-158.0-131.9 134.0 54.0 128.6 31.3 55 55 A D S S+ 0 0 25 37,-2.1 2,-0.2 -2,-0.4 -2,-0.0 -0.906 81.2 35.5-154.1 126.8 54.4 129.4 27.6 56 56 A P S S- 0 0 37 0, 0.0 38,-0.3 0, 0.0 5,-0.1 0.586 112.3 -95.9 -65.8 171.6 56.9 130.3 26.2 57 57 A H >> - 0 0 40 -2,-0.2 3,-1.3 1,-0.1 4,-0.8 -0.406 31.9-123.5 -56.1 131.3 59.3 128.4 28.5 58 58 A P H >> S+ 0 0 28 0, 0.0 4,-0.8 0, 0.0 3,-0.7 0.811 111.2 57.6 -50.2 -35.8 60.4 130.8 31.2 59 59 A V H >> S+ 0 0 54 1,-0.2 4,-3.0 2,-0.2 3,-0.6 0.865 98.6 59.8 -61.8 -37.4 64.1 130.2 30.2 60 60 A S H <4 S+ 0 0 27 -3,-1.3 -1,-0.2 1,-0.2 7,-0.1 0.744 95.2 63.3 -65.8 -25.0 63.4 131.4 26.6 61 61 A V H << S+ 0 0 46 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.898 116.2 29.8 -64.7 -40.5 62.3 134.8 28.0 62 62 A F H << S+ 0 0 163 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.841 135.3 29.2 -85.7 -38.7 65.8 135.3 29.3 63 63 A L S >< S- 0 0 78 -4,-3.0 3,-2.2 -5,-0.1 -1,-0.2 -0.694 83.2-151.0-126.2 76.6 67.7 133.3 26.7 64 64 A P T 3 S+ 0 0 75 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.190 82.4 8.2 -49.5 134.1 65.8 133.3 23.4 65 65 A R T 3 S+ 0 0 245 1,-0.1 -5,-0.1 3,-0.1 0, 0.0 0.590 113.6 84.2 65.0 16.2 66.4 130.2 21.4 66 66 A R < + 0 0 158 -3,-2.2 -1,-0.1 -7,-0.1 3,-0.1 0.068 57.6 122.3-129.7 22.6 68.3 128.5 24.3 67 67 A A S S- 0 0 34 1,-0.1 3,-0.1 -4,-0.1 2,-0.0 -0.402 74.4 -86.3 -75.9 160.9 65.4 127.1 26.2 68 68 A P - 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 -0.361 53.8 -90.1 -68.4 151.8 65.3 123.3 26.8 69 69 A L - 0 0 75 1,-0.1 2,-0.7 148,-0.1 148,-0.2 -0.266 45.6-104.4 -60.2 145.4 63.7 121.1 24.2 70 70 A G B -f 217 0B 22 146,-3.0 148,-2.3 1,-0.2 -1,-0.1 -0.643 24.2-165.1 -76.7 111.8 60.0 120.5 24.5 71 71 A I S S+ 0 0 3 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.902 84.4 7.1 -59.6 -43.1 59.3 116.9 25.8 72 72 A T S S- 0 0 17 -3,-0.1 -1,-0.2 115,-0.1 2,-0.1 -0.942 87.8-105.3-128.8 161.2 55.8 117.5 24.7 73 73 A T > - 0 0 67 -2,-0.3 4,-2.0 1,-0.1 -47,-0.2 -0.353 37.7-108.4 -69.7 162.8 54.0 120.2 22.7 74 74 A L H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.911 120.8 57.1 -59.3 -40.7 51.8 122.7 24.6 75 75 A A H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.903 108.4 44.9 -58.6 -43.4 48.8 121.0 23.0 76 76 A E H > S+ 0 0 54 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.812 106.7 59.5 -72.9 -30.1 49.8 117.6 24.4 77 77 A R H X S+ 0 0 14 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.918 107.4 48.1 -58.7 -42.6 50.5 119.1 27.8 78 78 A F H X S+ 0 0 10 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.911 111.8 48.7 -60.9 -46.7 46.9 120.2 27.8 79 79 A A H X S+ 0 0 28 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.902 113.0 47.1 -62.3 -43.1 45.7 116.7 26.7 80 80 A L H X S+ 0 0 15 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.933 110.3 52.7 -65.2 -45.5 47.8 115.1 29.5 81 81 A A H ><>S+ 0 0 0 -4,-2.6 5,-2.1 1,-0.2 3,-0.6 0.939 111.2 47.2 -52.2 -51.7 46.6 117.6 32.1 82 82 A E H ><5S+ 0 0 72 -4,-2.5 3,-1.7 1,-0.2 -1,-0.2 0.893 106.4 58.0 -56.8 -43.2 43.0 116.8 31.1 83 83 A S H 3<5S+ 0 0 82 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.786 106.3 49.7 -62.4 -27.9 43.7 113.0 31.2 84 84 A F T <<5S- 0 0 63 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.308 129.1 -91.9 -96.0 7.2 44.8 113.3 34.9 85 85 A G T < 5 + 0 0 29 -3,-1.7 -36,-0.3 1,-0.3 -3,-0.2 0.506 68.0 154.9 103.3 7.7 41.7 115.3 36.0 86 86 A I < - 0 0 4 -5,-2.1 -1,-0.3 -6,-0.2 -36,-0.2 -0.483 25.3-165.2 -67.8 134.5 42.6 118.9 35.6 87 87 A D S S+ 0 0 63 -38,-2.6 -85,-2.2 1,-0.3 2,-0.3 0.686 70.2 14.1 -93.5 -25.8 39.5 121.1 35.1 88 88 A G E -ad 2 50A 0 -39,-1.4 -37,-2.6 -87,-0.2 2,-0.5 -0.980 58.4-153.9-153.1 139.3 41.3 124.3 33.8 89 89 A V E -ad 3 51A 1 -87,-2.4 -85,-3.2 -2,-0.3 2,-0.6 -0.975 7.8-160.8-113.9 125.1 44.7 125.3 32.6 90 90 A L E -ad 4 52A 0 -39,-2.9 -37,-2.8 -2,-0.5 2,-0.6 -0.932 11.0-155.5-100.0 118.2 45.9 128.9 33.0 91 91 A V E -ad 5 53A 4 -87,-3.4 -85,-2.4 -2,-0.6 2,-0.4 -0.864 8.2-159.9 -98.1 119.8 48.8 129.6 30.6 92 92 A I E - d 0 54A 0 -39,-2.9 -37,-2.1 -2,-0.6 2,-0.6 -0.868 8.7-157.1-104.0 133.3 51.0 132.4 31.7 93 93 A D >> - 0 0 45 -2,-0.4 3,-2.1 -39,-0.2 4,-2.1 -0.945 6.3-156.4-105.9 111.0 53.3 134.3 29.3 94 94 A F T 34 S+ 0 0 40 -2,-0.6 5,-0.2 -38,-0.3 6,-0.1 0.651 92.6 63.7 -66.2 -15.2 56.2 135.9 31.4 95 95 A T T 34 S+ 0 0 101 1,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.635 112.8 36.9 -76.9 -14.2 56.7 138.6 28.6 96 96 A R T <4 S- 0 0 202 -3,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.784 125.9 -13.0-102.8 -41.0 53.2 139.8 29.5 97 97 A E S < S+ 0 0 32 -4,-2.1 -1,-0.3 1,-0.1 -91,-0.0 -0.982 103.4 36.2-159.1 166.2 52.8 139.4 33.3 98 98 A L S S+ 0 0 8 -2,-0.3 31,-0.4 1,-0.1 -4,-0.1 0.540 81.6 103.2 64.9 13.9 54.0 138.0 36.6 99 99 A S S S+ 0 0 47 -5,-0.2 32,-0.3 1,-0.1 -1,-0.1 0.891 86.2 33.5 -88.9 -46.9 57.8 138.4 35.8 100 100 A G S S+ 0 0 45 30,-0.1 2,-0.3 -6,-0.1 -1,-0.1 0.008 93.6 119.2 -99.0 28.0 58.6 141.6 37.8 101 101 A T - 0 0 24 -3,-0.1 29,-2.7 1,-0.1 -4,-0.0 -0.739 65.9-117.2 -96.2 139.3 56.1 140.9 40.7 102 102 A S > - 0 0 32 -2,-0.3 4,-2.6 27,-0.2 5,-0.2 -0.344 30.9-110.3 -60.8 152.4 57.2 140.4 44.3 103 103 A P H > S+ 0 0 17 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.889 120.7 53.2 -49.2 -40.5 56.5 137.0 45.8 104 104 A E H > S+ 0 0 114 1,-0.2 4,-2.0 2,-0.2 3,-0.2 0.949 111.7 42.0 -63.7 -50.7 53.8 138.7 48.0 105 105 A K H > S+ 0 0 109 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.801 108.2 62.2 -67.5 -31.6 52.0 140.3 45.0 106 106 A Y H X>S+ 0 0 3 -4,-2.6 4,-2.2 2,-0.2 5,-0.8 0.924 108.5 41.7 -57.0 -46.4 52.3 137.1 43.0 107 107 A V H <>S+ 0 0 0 -4,-1.8 5,-1.9 3,-0.2 4,-0.5 0.908 116.4 49.4 -68.6 -42.9 50.2 135.3 45.6 108 108 A E H <>S+ 0 0 99 -4,-2.0 5,-2.8 3,-0.2 -2,-0.2 0.923 120.7 33.7 -60.7 -48.3 47.8 138.1 45.9 109 109 A F H <>S+ 0 0 80 -4,-3.0 5,-1.6 3,-0.2 -2,-0.2 0.932 129.1 29.3 -78.7 -48.9 47.2 138.6 42.2 110 110 A L I <>S+ 0 0 0 -4,-2.2 5,-1.7 -5,-0.3 -3,-0.2 0.964 128.5 31.4 -79.5 -57.2 47.5 135.0 40.8 111 111 A L I - e 0 152A 6 -102,-0.4 3,-1.7 -2,-0.3 30,-0.2 -0.394 38.6-107.0 -76.1 162.5 57.2 120.8 44.0 124 124 A A T 3 S+ 0 0 49 28,-1.6 12,-0.4 1,-0.3 13,-0.2 0.760 120.7 57.5 -59.6 -25.5 60.1 121.3 46.5 125 125 A N T 3 S+ 0 0 113 10,-0.1 -1,-0.3 11,-0.1 2,-0.1 0.267 78.5 135.9 -90.0 12.5 61.9 123.1 43.6 126 126 A F < + 0 0 18 -3,-1.7 10,-0.7 -104,-0.0 2,-0.3 -0.374 26.3 174.3 -66.7 132.7 59.2 125.7 43.1 127 127 A T E +G 135 0C 80 8,-0.2 2,-0.3 -2,-0.1 8,-0.2 -0.987 1.9 163.9-136.7 152.3 60.3 129.3 42.7 128 128 A F E +G 134 0C 9 6,-1.5 6,-2.6 -2,-0.3 -29,-0.1 -0.960 29.5 49.2-157.2 165.6 58.3 132.5 41.8 129 129 A G S > S- 0 0 14 -31,-0.4 3,-1.6 -2,-0.3 -27,-0.2 -0.026 92.8 -21.5 84.7 172.0 58.5 136.3 41.8 130 130 A E G > S- 0 0 103 -29,-2.7 3,-1.7 1,-0.3 -30,-0.1 -0.200 132.2 -2.4 -56.7 134.0 61.0 138.8 40.6 131 131 A N G 3 S- 0 0 146 -32,-0.3 -1,-0.3 1,-0.3 -31,-0.1 0.805 121.9 -74.0 50.5 37.1 64.5 137.4 40.2 132 132 A A G < S+ 0 0 59 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.723 88.2 147.0 55.8 30.0 63.3 134.0 41.6 133 133 A A < + 0 0 64 -3,-1.7 2,-0.3 -6,-0.1 -4,-0.2 0.836 46.1 79.9 -67.9 -35.5 63.1 135.4 45.1 134 134 A G E +G 128 0C 0 -6,-2.6 -6,-1.5 -4,-0.1 2,-0.2 -0.563 58.4 179.4 -77.8 135.4 60.2 133.2 46.2 135 135 A T E > -G 127 0C 58 -2,-0.3 4,-2.3 -8,-0.2 -8,-0.2 -0.719 48.7 -90.6-119.8 175.8 60.8 129.6 47.2 136 136 A A H > S+ 0 0 7 -10,-0.7 4,-1.8 -12,-0.4 -9,-0.1 0.868 130.3 50.6 -54.5 -38.8 58.4 126.8 48.4 137 137 A D H > S+ 0 0 113 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.872 106.5 54.0 -68.9 -38.0 59.1 128.0 52.0 138 138 A S H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.912 107.6 52.0 -56.9 -44.5 58.3 131.6 51.0 139 139 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.901 106.2 53.2 -60.4 -44.8 54.9 130.4 49.6 140 140 A R H < S+ 0 0 157 -4,-1.8 4,-0.4 1,-0.2 -1,-0.2 0.898 114.1 41.6 -56.3 -44.3 54.1 128.6 52.9 141 141 A Q H >< S+ 0 0 118 -4,-1.7 3,-0.6 2,-0.2 -2,-0.2 0.865 113.4 50.8 -77.8 -37.6 54.7 131.7 55.0 142 142 A I H 3< S+ 0 0 17 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.880 110.9 50.7 -64.3 -38.6 52.9 134.2 52.6 143 143 A C T >X S+ 0 0 0 -4,-2.1 3,-3.0 -5,-0.2 4,-2.1 0.512 77.7 138.5 -81.3 -6.1 49.9 131.9 52.4 144 144 A Q T <4 S- 0 0 138 -3,-0.6 4,-0.1 -4,-0.4 -3,-0.1 -0.163 84.4 -5.8 -41.6 119.2 49.6 131.6 56.3 145 145 A S T 34 S+ 0 0 136 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.541 127.3 76.0 68.4 11.1 45.9 131.9 57.2 146 146 A R T <4 S- 0 0 103 -3,-3.0 2,-0.3 1,-0.5 -2,-0.2 0.722 108.1 -15.1-119.6 -45.7 44.9 132.6 53.5 147 147 A L S < S- 0 0 13 -4,-2.1 -1,-0.5 -27,-0.0 -28,-0.2 -0.966 70.7-102.8-155.8 158.7 45.2 129.3 51.8 148 148 A T E -e 119 0A 82 -30,-2.1 -28,-2.2 -2,-0.3 2,-0.4 -0.532 32.2-150.3 -84.2 149.3 46.7 125.8 52.5 149 149 A V E -e 120 0A 36 -30,-0.2 2,-0.5 -2,-0.2 -28,-0.2 -0.968 11.4-168.1-125.3 134.0 50.0 124.8 50.9 150 150 A D E -e 121 0A 61 -30,-2.6 -28,-2.2 -2,-0.4 2,-0.7 -0.968 6.4-168.2-120.9 111.3 51.2 121.3 50.0 151 151 A V E -e 122 0A 44 -2,-0.5 2,-0.4 -30,-0.2 -28,-0.2 -0.908 13.1-155.9 -99.4 115.9 54.9 121.1 49.0 152 152 A I E -e 123 0A 33 -30,-2.8 -28,-1.6 -2,-0.7 3,-0.1 -0.791 17.1-114.5-100.5 132.2 55.6 117.7 47.5 153 153 A D - 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0 0 32 28,-0.1 29,-1.2 1,-0.1 -4,-0.0 -0.206 68.3-122.4 -54.5 140.4 52.5 103.4 -23.9 441 1102 B S > - 0 0 28 27,-0.3 4,-2.0 1,-0.1 27,-0.2 -0.377 30.5-101.8 -74.9 163.0 50.6 103.7 -27.1 442 1103 B P H > S+ 0 0 15 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.862 122.7 51.2 -52.7 -37.7 46.8 104.3 -27.0 443 1104 B E H > S+ 0 0 105 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.917 111.9 43.6 -70.2 -46.0 46.2 100.6 -27.8 444 1105 B K H > S+ 0 0 128 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.755 108.1 62.2 -69.8 -26.9 48.5 99.2 -25.0 445 1106 B Y H X>S+ 0 0 2 -4,-2.0 4,-2.6 2,-0.2 5,-0.6 0.938 105.7 44.2 -61.9 -49.2 47.0 101.8 -22.6 446 1107 B V H <>S+ 0 0 0 -4,-1.6 5,-1.5 3,-0.2 4,-0.4 0.893 116.4 47.0 -65.4 -41.3 43.5 100.3 -22.9 447 1108 B E H <>S+ 0 0 101 -4,-1.6 5,-3.0 3,-0.2 6,-0.2 0.920 119.9 37.3 -64.9 -47.0 44.8 96.7 -22.6 448 1109 B F H <>S+ 0 0 80 -4,-2.5 5,-1.2 3,-0.2 -2,-0.2 0.944 128.3 29.5 -75.2 -50.0 47.1 97.3 -19.6 449 1110 B L I <>S+ 0 0 0 -4,-2.6 5,-2.0 -5,-0.3 4,-0.3 0.990 129.4 28.9 -74.4 -64.3 45.0 99.8 -17.6 450 1111 B L I - 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