==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/RNA 01-FEB-08 2ZH9 . COMPND 2 MOLECULE: CCA-ADDING ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR Y.TOH,K.TOMITA . 437 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24054.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 302 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 13.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 22 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.6 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 1 0 2 1 1 0 2 3 1 0 1 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 1 0 1 3 2 1 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 . 0 1 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 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 0 154 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 15.1 18.1 6.8 8.2 2 2 A K > - 0 0 90 246,-0.1 4,-2.2 1,-0.0 5,-0.3 -0.903 360.0 -77.5-129.5 158.5 14.7 5.1 8.0 3 3 A V H > S+ 0 0 28 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.646 128.9 35.2 -10.5 -79.2 11.6 5.0 10.1 4 4 A E H > S+ 0 0 114 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.950 117.0 54.1 -49.8 -60.5 12.9 2.5 12.7 5 5 A E H >> S+ 0 0 82 -3,-0.2 4,-1.5 1,-0.2 3,-1.1 0.905 111.0 45.8 -41.1 -57.1 16.4 3.7 12.6 6 6 A I H 3X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.3 -1,-0.2 0.936 107.4 56.2 -55.6 -49.8 15.2 7.3 13.4 7 7 A L H 3X S+ 0 0 24 -4,-2.6 4,-1.3 -5,-0.3 -1,-0.3 0.764 104.4 59.6 -55.1 -22.4 12.9 6.1 16.2 8 8 A E H XX S+ 0 0 129 -4,-1.6 3,-0.8 -3,-1.1 4,-0.7 0.992 108.5 37.7 -67.2 -64.3 16.1 4.6 17.5 9 9 A K H >< S+ 0 0 89 -4,-1.5 3,-0.6 1,-0.2 4,-0.3 0.795 110.4 67.4 -58.2 -29.4 18.1 7.8 17.9 10 10 A A H >X S+ 0 0 0 -4,-2.6 3,-3.1 -5,-0.2 4,-1.1 0.889 86.2 64.0 -60.5 -44.3 14.9 9.4 19.0 11 11 A L H > - 0 0 66 -2,-0.1 4,-2.1 -5,-0.1 3,-2.1 -0.384 29.6 -94.4 -77.9 157.9 18.6 9.1 31.6 18 18 A E H 3> S+ 0 0 161 1,-0.3 4,-4.2 2,-0.2 5,-0.3 0.820 124.6 49.8 -32.9 -59.2 19.7 6.9 34.6 19 19 A E H 3> S+ 0 0 94 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.797 112.0 49.5 -57.6 -30.1 20.6 9.9 36.8 20 20 A E H <> S+ 0 0 38 -3,-2.1 4,-1.5 2,-0.2 -1,-0.3 0.839 115.7 42.4 -78.3 -32.1 17.3 11.6 36.0 21 21 A V H X S+ 0 0 33 -4,-2.1 4,-2.9 -3,-0.2 -2,-0.2 0.909 114.2 51.1 -77.2 -41.8 15.4 8.4 36.9 22 22 A R H X S+ 0 0 125 -4,-4.2 4,-2.4 -5,-0.3 5,-0.3 0.908 107.8 52.8 -60.0 -42.9 17.6 7.8 40.0 23 23 A K H X S+ 0 0 110 -4,-1.8 4,-1.6 -5,-0.3 -1,-0.2 0.951 113.3 46.1 -56.6 -46.0 16.9 11.3 41.1 24 24 A G H X S+ 0 0 0 -4,-1.5 4,-3.0 2,-0.2 -2,-0.2 0.868 111.0 49.2 -65.2 -42.4 13.3 10.5 40.7 25 25 A R H X S+ 0 0 89 -4,-2.9 4,-3.7 2,-0.2 -2,-0.2 0.982 111.9 48.2 -61.5 -57.5 13.3 7.2 42.4 26 26 A E H X S+ 0 0 87 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.835 114.2 48.4 -52.5 -34.5 15.1 8.5 45.5 27 27 A A H X S+ 0 0 1 -4,-1.6 4,-2.6 -5,-0.3 -1,-0.2 0.944 111.5 48.2 -70.4 -48.4 12.7 11.4 45.6 28 28 A E H X S+ 0 0 33 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.907 111.0 55.3 -56.1 -42.3 9.7 9.0 45.2 29 29 A E H X S+ 0 0 93 -4,-3.7 4,-2.0 2,-0.2 -2,-0.2 0.976 109.7 41.4 -52.3 -67.1 11.4 7.0 48.0 30 30 A E H X S+ 0 0 46 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.907 113.2 55.4 -45.1 -53.5 11.6 9.8 50.6 31 31 A L H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.912 106.6 49.7 -50.2 -50.5 8.2 11.0 49.7 32 32 A R H X S+ 0 0 95 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.901 110.4 52.5 -57.4 -42.1 6.6 7.6 50.4 33 33 A R H X S+ 0 0 140 -4,-2.0 4,-2.5 1,-0.2 3,-0.4 0.919 109.3 46.6 -61.2 -47.8 8.4 7.6 53.7 34 34 A R H < S+ 0 0 57 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.881 109.7 53.2 -64.8 -39.7 7.2 10.9 54.9 35 35 A L H <>S+ 0 0 3 -4,-2.2 5,-2.8 -5,-0.2 -1,-0.2 0.753 113.8 45.7 -66.6 -23.4 3.6 10.2 53.9 36 36 A D H <5S+ 0 0 87 -4,-1.1 3,-0.5 -3,-0.4 -2,-0.2 0.860 100.3 61.3 -88.0 -40.2 3.9 7.0 56.0 37 37 A E T <5S+ 0 0 171 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.633 118.4 36.1 -61.7 -9.5 5.5 8.5 59.1 38 38 A L T 5S- 0 0 102 -4,-0.5 -1,-0.3 -5,-0.2 -2,-0.2 0.418 110.8-138.0-113.9 -12.3 2.2 10.4 59.0 39 39 A G T 5 + 0 0 59 -3,-0.5 -3,-0.3 1,-0.2 2,-0.2 0.881 37.9 166.0 54.2 52.1 0.4 7.4 57.7 40 40 A V < - 0 0 29 -5,-2.8 2,-1.0 1,-0.0 -1,-0.2 -0.632 43.7-111.3 -94.8 153.8 -1.9 9.0 55.1 41 41 A E + 0 0 90 24,-0.3 24,-2.2 -2,-0.2 2,-0.3 -0.734 55.8 158.3 -86.6 105.7 -3.8 7.1 52.5 42 42 A Y E -A 64 0A 42 -2,-1.0 2,-0.3 22,-0.2 22,-0.2 -0.860 30.4-161.3-129.5 163.6 -2.1 8.1 49.2 43 43 A V E -A 63 0A 39 20,-2.4 20,-2.4 -2,-0.3 2,-0.4 -0.944 18.8-135.3-147.0 121.3 -1.6 6.9 45.6 44 44 A F E +A 62 0A 8 -2,-0.3 18,-0.2 18,-0.2 2,-0.2 -0.617 38.6 161.2 -76.1 124.5 1.1 8.0 43.1 45 45 A V E +A 61 0A 4 16,-2.6 16,-0.7 -2,-0.4 4,-0.4 -0.730 23.4 60.7-136.8-176.6 -0.4 8.6 39.6 46 46 A G S > S- 0 0 16 -2,-0.2 4,-0.8 1,-0.2 3,-0.5 -0.289 104.8 -40.8 84.0-178.7 0.4 10.4 36.4 47 47 A S T 4>S+ 0 0 29 1,-0.2 5,-2.5 2,-0.2 6,-1.2 0.670 133.6 59.1 -58.0 -23.6 3.4 9.7 34.1 48 48 A Y T >45S+ 0 0 4 11,-0.4 3,-1.4 -3,-0.4 -1,-0.2 0.955 104.2 50.3 -72.5 -44.9 5.8 9.2 36.9 49 49 A A T 345S+ 0 0 33 -3,-0.5 -1,-0.2 -4,-0.4 -2,-0.2 0.684 120.7 36.0 -64.3 -18.2 3.9 6.4 38.4 50 50 A R T 3<5S- 0 0 28 -4,-0.8 -1,-0.3 -5,-0.1 -2,-0.2 0.208 107.3-121.1-119.2 14.0 3.7 4.7 35.0 51 51 A N T < 5S+ 0 0 57 -3,-1.4 -3,-0.2 -4,-0.2 -4,-0.1 0.888 80.2 118.6 45.6 48.9 7.1 5.6 33.8 52 52 A T < + 0 0 0 -5,-2.5 2,-0.2 96,-0.1 -4,-0.2 0.166 34.8 129.3-121.2 9.8 5.7 7.4 30.8 53 53 A W - 0 0 2 -6,-1.2 5,-0.1 -7,-0.1 3,-0.1 -0.495 62.0-117.1 -72.0 133.8 7.1 10.8 31.7 54 54 A L > - 0 0 14 -2,-0.2 3,-1.9 3,-0.2 -39,-0.2 -0.344 42.6 -82.0 -68.5 150.5 8.9 12.6 28.9 55 55 A K T 3 S+ 0 0 81 -41,-2.0 -1,-0.1 1,-0.3 -40,-0.1 -0.143 114.2 12.8 -53.4 143.6 12.6 13.3 29.4 56 56 A G T 3 S+ 0 0 56 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.566 106.0 93.2 65.9 7.9 13.5 16.4 31.4 57 57 A S < + 0 0 57 -3,-1.9 2,-0.2 2,-0.0 -3,-0.2 -0.192 51.5 163.1-125.1 42.8 9.9 16.7 32.6 58 58 A L + 0 0 22 -5,-0.1 50,-0.6 -11,-0.0 2,-0.3 -0.416 4.6 149.9 -66.0 126.7 10.0 14.9 35.9 59 59 A E E - b 0 108A 65 -2,-0.2 -11,-0.4 48,-0.1 2,-0.4 -0.867 32.6-144.5-161.7 123.0 7.1 15.6 38.3 60 60 A I E - b 0 109A 0 48,-2.6 50,-2.5 -2,-0.3 2,-0.6 -0.723 10.0-157.3 -91.5 136.7 5.6 13.3 40.9 61 61 A D E -Ab 45 110A 27 -16,-0.7 -16,-2.6 -2,-0.4 2,-0.6 -0.945 7.5-172.1-121.0 113.9 1.8 13.4 41.5 62 62 A V E -Ab 44 111A 0 48,-2.7 50,-2.0 -2,-0.6 2,-0.5 -0.900 6.7-160.2-106.7 114.9 0.6 12.1 44.8 63 63 A F E -Ab 43 112A 13 -20,-2.4 -20,-2.4 -2,-0.6 2,-0.7 -0.820 9.0-144.9 -98.2 131.7 -3.2 11.9 45.2 64 64 A L E -Ab 42 113A 0 48,-3.0 50,-2.6 -2,-0.5 2,-0.4 -0.861 14.2-140.5 -98.7 116.8 -4.5 11.8 48.8 65 65 A L E - b 0 114A 28 -24,-2.2 -24,-0.3 -2,-0.7 50,-0.2 -0.638 22.7-176.6 -82.0 125.6 -7.6 9.6 49.1 66 66 A F E - b 0 115A 17 48,-2.1 50,-2.3 -2,-0.4 9,-0.0 -0.928 31.6 -95.8-123.5 146.2 -10.4 10.8 51.4 67 67 A P > - 0 0 53 0, 0.0 3,-1.0 0, 0.0 50,-0.1 -0.180 33.4-117.8 -56.4 147.7 -13.7 9.3 52.5 68 68 A E T 3 S+ 0 0 84 48,-0.4 49,-0.1 1,-0.2 47,-0.0 0.933 111.2 57.8 -50.9 -53.1 -16.8 10.2 50.5 69 69 A E T 3 S+ 0 0 154 2,-0.0 -1,-0.2 46,-0.0 46,-0.0 0.732 79.3 111.2 -53.8 -28.2 -18.5 11.8 53.5 70 70 A F S < S- 0 0 74 -3,-1.0 -4,-0.1 1,-0.1 2,-0.0 -0.201 74.4-114.3 -53.2 138.4 -15.7 14.3 54.1 71 71 A S > - 0 0 49 1,-0.1 4,-1.7 4,-0.0 3,-0.1 -0.330 22.9-111.2 -71.1 155.5 -16.7 17.9 53.4 72 72 A K H > S+ 0 0 133 1,-0.2 4,-1.5 2,-0.2 3,-0.2 0.931 118.6 51.1 -52.6 -47.9 -15.1 19.7 50.5 73 73 A E H > S+ 0 0 72 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.853 103.2 57.1 -58.8 -42.6 -13.3 22.0 53.0 74 74 A E H > S+ 0 0 64 1,-0.2 4,-2.6 2,-0.2 5,-0.5 0.916 103.9 54.4 -58.1 -43.3 -11.9 19.2 55.1 75 75 A L H X S+ 0 0 12 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.937 114.1 40.0 -56.1 -48.8 -10.2 17.8 52.0 76 76 A R H X S+ 0 0 93 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.895 116.9 47.9 -70.9 -40.2 -8.4 21.1 51.3 77 77 A E H X S+ 0 0 91 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.987 120.8 36.8 -62.3 -57.8 -7.6 22.0 54.9 78 78 A R H X S+ 0 0 99 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.844 114.5 59.8 -62.2 -32.7 -6.2 18.5 55.6 79 79 A G H X S+ 0 0 1 -4,-1.9 4,-2.2 -5,-0.5 -1,-0.2 0.940 108.3 42.1 -61.0 -47.7 -4.8 18.5 52.1 80 80 A L H X S+ 0 0 31 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.903 111.8 57.3 -65.5 -40.0 -2.7 21.6 52.8 81 81 A E H X S+ 0 0 100 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.949 109.4 43.2 -55.4 -54.6 -1.7 20.3 56.2 82 82 A I H X S+ 0 0 3 -4,-2.7 4,-1.1 1,-0.2 5,-0.3 0.950 112.9 52.4 -57.8 -52.3 -0.3 17.1 54.7 83 83 A G H >X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 3,-0.6 0.892 109.2 49.6 -51.3 -46.2 1.5 18.9 51.9 84 84 A K H 3< S+ 0 0 76 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.924 110.1 50.2 -60.0 -47.3 3.2 21.3 54.3 85 85 A A H 3< S+ 0 0 72 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.604 119.5 35.9 -70.2 -13.6 4.4 18.6 56.6 86 86 A V H << S+ 0 0 3 -4,-1.1 2,-0.4 -3,-0.6 -1,-0.2 0.616 98.5 86.0-115.0 -17.8 6.0 16.5 53.9 87 87 A L < - 0 0 10 -4,-2.0 17,-0.2 -5,-0.3 3,-0.1 -0.731 62.8-147.4 -94.8 133.2 7.3 19.1 51.4 88 88 A D S S+ 0 0 96 15,-1.4 2,-0.3 -2,-0.4 -1,-0.2 0.949 96.9 10.1 -53.1 -51.9 10.7 20.7 51.7 89 89 A S E S-C 103 0A 70 14,-0.7 14,-1.0 -3,-0.1 2,-0.4 -0.938 79.6-163.2-126.5 148.2 9.2 23.8 50.1 90 90 A Y E +C 102 0A 112 -2,-0.3 2,-0.4 12,-0.2 12,-0.2 -0.999 13.8 178.0-140.2 139.8 5.5 24.3 49.6 91 91 A E E -C 101 0A 113 10,-2.8 10,-1.1 -2,-0.4 -2,-0.0 -0.874 30.2-129.0-141.1 103.0 3.5 26.7 47.5 92 92 A I E -C 100 0A 58 -2,-0.4 2,-0.3 8,-0.2 8,-0.2 -0.098 32.7-170.7 -47.8 149.3 -0.3 26.4 47.5 93 93 A R E -C 99 0A 83 6,-2.6 6,-2.2 4,-0.0 2,-0.3 -0.933 10.1-131.0-141.9 164.8 -1.7 26.3 43.9 94 94 A Y + 0 0 159 -2,-0.3 2,-0.2 4,-0.2 6,-0.0 -0.837 38.1 123.8-126.7 161.4 -5.1 26.4 42.3 95 95 A A S S- 0 0 69 -2,-0.3 4,-0.0 2,-0.1 0, 0.0 -0.681 90.7 -19.2-171.1-135.7 -7.3 24.6 39.8 96 96 A E S S- 0 0 103 -2,-0.2 -2,-0.0 1,-0.1 0, 0.0 0.912 143.0 -5.3 -56.0 -39.8 -10.8 23.1 40.2 97 97 A H S S- 0 0 81 16,-0.1 2,-0.1 -21,-0.0 -1,-0.1 -0.899 99.8 -78.0-144.2 165.5 -9.9 23.3 43.9 98 98 A P + 0 0 32 0, 0.0 -4,-0.2 0, 0.0 2,-0.2 -0.466 51.2 169.0 -75.1 145.8 -6.8 24.2 45.7 99 99 A Y E -C 93 0A 44 -6,-2.2 -6,-2.6 -2,-0.1 2,-0.4 -0.763 30.9-100.9-137.4-176.0 -3.9 21.7 45.9 100 100 A V E -CD 92 111A 3 11,-2.3 11,-2.9 -2,-0.2 2,-0.4 -0.932 24.6-167.8-121.3 139.6 -0.2 21.9 47.0 101 101 A H E +CD 91 110A 17 -10,-1.1 -10,-2.8 -2,-0.4 2,-0.2 -0.945 26.2 123.3-122.2 144.3 2.9 22.1 45.0 102 102 A G E -CD 90 109A 3 7,-2.4 7,-1.7 -2,-0.4 2,-0.3 -0.764 46.5 -91.1-162.9-151.8 6.5 21.6 46.2 103 103 A V E -CD 89 108A 35 -14,-1.0 -15,-1.4 5,-0.2 -14,-0.7 -0.986 20.4-172.6-150.8 136.2 9.8 19.8 46.0 104 104 A V E > S- D 0 107A 0 3,-1.8 3,-1.6 -2,-0.3 -77,-0.1 -0.991 79.9 -13.4-130.0 139.6 11.3 16.7 47.7 105 105 A K T 3 S- 0 0 106 -2,-0.4 -78,-0.1 1,-0.3 -1,-0.1 0.772 133.2 -51.3 38.1 33.6 15.0 15.7 47.3 106 106 A G T 3 S+ 0 0 41 1,-0.2 2,-0.3 -79,-0.1 -1,-0.3 0.779 112.7 108.4 77.5 31.4 15.1 18.2 44.4 107 107 A V E < S- D 0 104A 7 -3,-1.6 -3,-1.8 -80,-0.1 -1,-0.2 -0.989 70.4-100.0-140.2 149.6 12.1 17.1 42.3 108 108 A E E -bD 59 103A 77 -50,-0.6 -48,-2.6 -2,-0.3 2,-0.4 -0.352 40.2-175.6 -67.1 140.5 8.7 18.6 41.5 109 109 A V E -bD 60 102A 0 -7,-1.7 -7,-2.4 -50,-0.2 2,-0.5 -1.000 17.6-158.8-142.7 140.1 5.7 17.2 43.4 110 110 A D E -bD 61 101A 13 -50,-2.5 -48,-2.7 -2,-0.4 2,-0.8 -0.969 5.9-166.5-120.0 117.0 2.0 17.8 43.3 111 111 A V E +bD 62 100A 2 -11,-2.9 -11,-2.3 -2,-0.5 -48,-0.2 -0.876 17.3 178.9-105.5 103.3 -0.0 16.8 46.3 112 112 A V E -b 63 0A 18 -50,-2.0 -48,-3.0 -2,-0.8 2,-0.4 -0.803 22.6-134.1-108.1 145.5 -3.7 16.8 45.4 113 113 A P E +b 64 0A 16 0, 0.0 2,-0.3 0, 0.0 -48,-0.2 -0.800 34.7 158.0 -97.5 138.4 -6.7 15.9 47.5 114 114 A C E -b 65 0A 1 -50,-2.6 -48,-2.1 -2,-0.4 2,-0.6 -0.963 41.8 -95.3-152.0 168.1 -9.4 13.6 46.2 115 115 A Y E -b 66 0A 19 -2,-0.3 2,-0.9 -50,-0.2 -50,-0.1 -0.787 29.2-132.8 -92.7 121.7 -12.3 11.3 47.2 116 116 A K + 0 0 112 -50,-2.3 -48,-0.4 -2,-0.6 2,-0.2 -0.616 47.7 166.4 -70.3 107.6 -11.5 7.6 47.4 117 117 A L - 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0 0 22 0, 0.0 27,-2.0 0, 0.0 -1,-0.3 -0.027 61.8 -88.7 -64.0 169.7 -35.9 49.4 -0.1 348 348 A Q E > -K 373 0D 105 25,-0.2 3,-2.2 1,-0.1 25,-0.3 -0.613 44.1-107.6 -82.1 143.8 -37.2 48.3 -3.5 349 349 A F T 3 S+ 0 0 113 23,-2.8 24,-0.1 1,-0.3 -1,-0.1 0.738 112.4 58.4 -42.2 -40.1 -38.7 51.2 -5.6 350 350 A E T 3 S+ 0 0 122 22,-0.3 2,-1.1 1,-0.1 -1,-0.3 0.341 79.3 93.4 -81.3 14.0 -42.4 50.2 -5.3 351 351 A D <> + 0 0 62 -3,-2.2 4,-2.1 1,-0.2 5,-0.2 -0.823 53.1 179.1-105.0 89.9 -42.4 50.4 -1.5 352 352 A E H > S+ 0 0 164 -2,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.899 74.8 53.4 -51.7 -47.2 -43.6 54.0 -1.3 353 353 A R H > S+ 0 0 183 2,-0.2 4,-2.1 1,-0.2 3,-0.3 0.989 115.0 34.6 -57.5 -69.7 -43.6 53.9 2.5 354 354 A N H > S+ 0 0 79 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.861 116.2 56.7 -56.3 -38.8 -40.0 52.7 3.2 355 355 A V H X S+ 0 0 14 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.939 105.6 51.8 -58.0 -46.0 -38.7 54.6 0.2 356 356 A K H < S+ 0 0 151 -4,-2.4 4,-0.5 -3,-0.3 -2,-0.2 0.936 112.9 43.8 -57.6 -48.8 -40.1 57.8 1.7 357 357 A K H >X S+ 0 0 144 -4,-2.1 3,-1.4 1,-0.2 4,-0.6 0.931 112.1 54.3 -62.6 -42.7 -38.5 57.2 5.0 358 358 A F H >< S+ 0 0 27 -4,-3.2 3,-0.6 1,-0.3 -2,-0.2 0.880 111.9 43.7 -58.5 -39.8 -35.2 56.2 3.2 359 359 A L T 3< S+ 0 0 72 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.497 99.1 76.3 -85.3 -0.4 -35.2 59.4 1.3 360 360 A S T <4 S+ 0 0 87 -3,-1.4 2,-0.6 -4,-0.5 -1,-0.2 0.680 71.8 88.8 -84.1 -17.5 -36.1 61.4 4.5 361 361 A R S << S- 0 0 157 -4,-0.6 2,-0.3 -3,-0.6 -4,-0.0 -0.710 82.5-130.4 -80.2 118.5 -32.6 61.2 6.0 362 362 A N + 0 0 157 -2,-0.6 2,-0.3 4,-0.1 -2,-0.1 -0.576 36.6 172.9 -73.6 129.5 -30.7 64.2 4.7 363 363 A R - 0 0 47 -2,-0.3 3,-0.3 -4,-0.1 15,-0.1 -0.804 41.2-112.6-128.6 171.4 -27.4 63.1 3.4 364 364 A A S S+ 0 0 89 -2,-0.3 14,-0.1 1,-0.2 -1,-0.1 0.827 103.9 38.2 -78.9 -29.7 -24.6 64.8 1.5 365 365 A F S S- 0 0 110 12,-0.4 -1,-0.2 -3,-0.0 12,-0.1 0.055 95.2-116.7-124.1 32.6 -24.9 63.0 -1.8 366 366 A R - 0 0 215 -3,-0.3 -4,-0.1 10,-0.1 -2,-0.0 0.853 32.5-109.1 56.2 103.9 -28.4 62.2 -2.9 367 367 A P - 0 0 27 0, 0.0 2,-0.3 0, 0.0 9,-0.3 -0.159 32.9-151.5 -64.3 159.9 -29.4 58.6 -3.3 368 368 A F E -L 375 0D 50 7,-1.9 7,-2.1 5,-0.0 2,-0.5 -0.860 15.4-109.8-133.4 166.4 -30.0 56.8 -6.6 369 369 A I E +L 374 0D 98 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.851 35.1 172.1-101.4 126.1 -32.0 54.0 -8.2 370 370 A E E > -L 373 0D 69 3,-2.9 3,-1.8 -2,-0.5 -2,-0.0 -0.981 63.5 -21.0-139.4 125.0 -30.1 50.8 -9.3 371 371 A N T 3 S- 0 0 156 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.882 128.9 -40.0 45.9 53.7 -31.6 47.6 -10.6 372 372 A G T 3 S+ 0 0 32 1,-0.1 -23,-2.8 -24,-0.1 2,-0.3 0.108 123.4 75.3 91.7 -24.8 -35.1 48.0 -9.0 373 373 A R E < S-KL 348 370D 61 -3,-1.8 -3,-2.9 -25,-0.3 -25,-0.2 -0.893 74.0-107.4-131.1 160.4 -34.0 49.5 -5.7 374 374 A W E - L 0 369D 49 -27,-2.0 -28,-2.3 -2,-0.3 2,-0.3 -0.352 29.6-175.9 -77.8 154.4 -32.8 52.6 -4.0 375 375 A W E -KL 345 368D 42 -7,-2.1 -7,-1.9 -30,-0.2 2,-0.3 -0.986 8.1-158.6-147.4 153.5 -29.3 53.3 -2.7 376 376 A A E -K 344 0D 0 -32,-1.7 -32,-2.8 -2,-0.3 2,-0.4 -0.946 19.4-127.4-133.8 151.3 -27.6 56.1 -0.8 377 377 A F E -K 343 0D 76 -2,-0.3 -12,-0.4 -34,-0.2 2,-0.3 -0.819 35.0-177.6 -94.5 141.6 -24.0 57.1 -0.5 378 378 A E E -K 342 0D 23 -36,-2.7 -36,-1.4 -2,-0.4 2,-0.4 -0.785 21.7-113.5-130.6 175.0 -23.1 57.4 3.2 379 379 A M E -K 341 0D 92 -2,-0.3 -38,-0.2 -38,-0.2 2,-0.2 -0.910 20.4-127.6-118.5 143.3 -19.9 58.5 5.0 380 380 A R - 0 0 27 -40,-2.7 3,-0.1 -2,-0.4 -40,-0.0 -0.581 7.0-142.5 -85.6 150.4 -17.5 56.4 7.2 381 381 A K S S+ 0 0 193 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.545 91.0 20.6 -84.0 -11.0 -16.5 57.6 10.6 382 382 A F - 0 0 22 -42,-0.1 -1,-0.1 1,-0.0 4,-0.0 -0.983 56.0-165.5-152.9 155.1 -13.0 56.1 9.9 383 383 A T + 0 0 10 -2,-0.3 -45,-1.6 -3,-0.1 3,-0.1 0.392 69.5 57.2-128.0 3.1 -11.0 55.2 6.8 384 384 A T S > S- 0 0 24 -47,-0.2 4,-2.4 1,-0.1 -47,-0.2 -0.938 79.5-118.6-131.1 157.4 -8.1 53.0 8.1 385 385 A P H > S+ 0 0 0 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.969 114.3 50.5 -57.2 -55.3 -8.0 49.8 10.1 386 386 A E H > S+ 0 0 51 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.898 109.6 51.6 -51.5 -44.3 -6.1 51.4 13.0 387 387 A E H > S+ 0 0 62 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.956 112.0 46.7 -59.0 -48.3 -8.6 54.2 13.1 388 388 A G H X S+ 0 0 0 -4,-2.4 4,-3.2 1,-0.2 3,-0.3 0.924 111.9 49.1 -59.6 -47.2 -11.5 51.7 13.3 389 389 A V H X S+ 0 0 0 -4,-3.2 4,-3.0 1,-0.2 5,-0.4 0.910 107.0 55.7 -61.2 -40.1 -9.8 49.5 15.9 390 390 A R H X S+ 0 0 136 -4,-2.8 4,-0.9 -5,-0.3 -1,-0.2 0.852 113.1 43.9 -59.2 -31.5 -9.1 52.6 18.0 391 391 A S H X S+ 0 0 53 -4,-1.5 4,-1.5 -3,-0.3 -2,-0.2 0.918 115.1 47.3 -77.3 -45.6 -12.8 53.2 17.8 392 392 A Y H X S+ 0 0 8 -4,-3.2 4,-3.5 1,-0.2 3,-0.4 0.956 112.2 47.1 -61.1 -55.4 -13.9 49.6 18.4 393 393 A A H X S+ 0 0 1 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.845 109.7 55.4 -57.2 -36.4 -11.6 49.0 21.4 394 394 A S H < S+ 0 0 68 -4,-0.9 -1,-0.2 -5,-0.4 -2,-0.2 0.864 121.5 26.8 -66.9 -36.4 -12.7 52.2 23.1 395 395 A T H < S+ 0 0 92 -4,-1.5 3,-0.2 -3,-0.4 -2,-0.2 0.741 128.3 38.6 -99.6 -26.9 -16.4 51.4 22.9 396 396 A H H >< S+ 0 0 89 -4,-3.5 3,-3.3 -5,-0.2 4,-0.4 0.157 70.6 123.4-111.0 19.9 -16.6 47.6 23.0 397 397 A W G >< S+ 0 0 66 -4,-0.7 3,-1.4 1,-0.3 11,-0.2 0.823 70.8 64.1 -47.0 -34.3 -13.7 47.0 25.4 398 398 A H G 3 S+ 0 0 133 1,-0.3 3,-0.3 -3,-0.2 -1,-0.3 0.585 95.0 58.4 -69.3 -10.2 -16.3 45.1 27.5 399 399 A T G < S+ 0 0 40 -3,-3.3 -1,-0.3 1,-0.2 -2,-0.2 0.498 86.7 79.5 -97.8 -3.9 -16.8 42.5 24.7 400 400 A L S < S- 0 0 0 -3,-1.4 -100,-0.5 -4,-0.4 -1,-0.2 0.122 114.1 -60.8 -90.6 23.5 -13.2 41.4 24.7 401 401 A G > - 0 0 11 -3,-0.3 4,-2.4 3,-0.2 5,-0.4 0.065 53.6 -94.5 103.1 135.7 -13.1 39.1 27.7 402 402 A K H > S+ 0 0 142 3,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.918 122.6 24.9 -48.6 -54.1 -13.8 40.0 31.3 403 403 A N H > S+ 0 0 43 2,-0.2 4,-2.2 -111,-0.2 3,-0.5 0.968 123.0 48.4 -80.3 -58.3 -10.2 40.6 32.1 404 404 A V H > S+ 0 0 0 1,-0.3 4,-2.5 2,-0.2 -3,-0.2 0.893 115.4 50.2 -49.4 -40.0 -8.6 41.5 28.8 405 405 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.3 0.848 105.7 52.8 -68.7 -36.5 -11.4 43.9 28.4 406 406 A E H X S+ 0 0 68 -4,-1.0 4,-1.0 -3,-0.5 -1,-0.2 0.849 112.5 47.8 -68.1 -30.8 -11.1 45.5 31.8 407 407 A S H >X S+ 0 0 7 -4,-2.2 4,-2.1 2,-0.2 3,-0.5 0.942 111.1 48.2 -74.2 -47.5 -7.4 46.1 31.0 408 408 A I H 3< S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.895 105.9 59.4 -60.1 -39.3 -8.1 47.5 27.5 409 409 A R H 3< S+ 0 0 116 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.863 112.3 39.5 -58.3 -34.8 -10.7 49.9 28.9 410 410 A E H << S- 0 0 127 -4,-1.0 2,-0.3 -3,-0.5 -1,-0.2 0.775 133.0 -2.1 -88.5 -25.9 -8.1 51.4 31.2 411 411 A Y < + 0 0 67 -4,-2.1 -127,-0.5 -5,-0.1 -1,-0.3 -0.896 67.5 137.3-166.8 136.1 -5.2 51.5 28.9 412 412 A F - 0 0 40 -2,-0.3 2,-0.3 -129,-0.2 -129,-0.2 -0.951 18.0-169.2-169.3 156.7 -4.4 50.5 25.3 413 413 A E E -I 282 0C 53 -131,-1.7 -131,-2.7 -2,-0.3 2,-0.5 -0.987 22.1-123.9-151.7 156.4 -2.6 51.8 22.3 414 414 A I E -I 281 0C 44 -2,-0.3 2,-0.2 -133,-0.2 -133,-0.2 -0.896 27.6-170.2-105.3 128.5 -2.2 50.9 18.6 415 415 A I E +I 280 0C 2 -135,-2.2 -135,-1.7 -2,-0.5 2,-0.3 -0.667 16.8 143.6-109.2 168.4 1.3 50.4 17.3 416 416 A S E +I 279 0C 46 -137,-0.2 4,-0.5 -2,-0.2 3,-0.4 -0.933 40.2 36.2 173.8 172.0 2.4 49.9 13.7 417 417 A G S >> S- 0 0 40 -139,-0.8 3,-1.8 -2,-0.3 4,-0.9 -0.190 119.2 -21.7 62.4-159.5 5.2 50.8 11.3 418 418 A E H >> S+ 0 0 111 1,-0.3 3,-1.5 2,-0.2 4,-0.9 0.913 134.8 62.7 -47.6 -53.2 8.8 50.8 12.6 419 419 A K H 3> S+ 0 0 116 -3,-0.4 4,-0.8 1,-0.3 3,-0.3 0.757 100.5 55.8 -45.8 -30.2 7.7 51.3 16.2 420 420 A L H <4 S+ 0 0 1 -3,-1.8 5,-0.3 -4,-0.5 -1,-0.3 0.829 98.6 56.9 -75.9 -33.7 6.0 47.9 16.0 421 421 A F H << S+ 0 0 15 -3,-1.5 -1,-0.2 -4,-0.9 -2,-0.2 0.653 99.6 63.2 -71.8 -14.1 9.0 45.8 15.0 422 422 A K H < S+ 0 0 168 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.913 88.6 87.5 -73.2 -44.0 10.7 47.1 18.1 423 423 A E S >< S- 0 0 32 -4,-0.8 2,-2.1 -3,-0.2 3,-0.5 -0.017 99.1-100.3 -52.9 158.0 8.1 45.3 20.2 424 424 A P T 3 S+ 0 0 52 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 -0.335 99.5 92.4 -79.3 57.5 8.6 41.7 21.2 425 425 A V T 3> + 0 0 0 -2,-2.1 4,-2.2 -5,-0.3 5,-0.2 0.236 41.2 110.2-135.8 14.1 6.2 40.4 18.5 426 426 A T H <> S+ 0 0 27 -3,-0.5 4,-2.5 2,-0.2 5,-0.2 0.866 79.6 49.2 -62.2 -40.3 8.4 39.6 15.6 427 427 A A H > S+ 0 0 50 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.971 111.1 48.4 -65.3 -51.8 8.1 35.8 15.7 428 428 A E H > S+ 0 0 52 1,-0.2 4,-3.2 2,-0.2 -2,-0.2 0.926 113.7 49.6 -52.1 -47.3 4.4 35.8 15.9 429 429 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 6,-0.3 0.912 112.5 45.5 -58.7 -46.0 4.3 38.3 13.0 430 430 A C H <>S+ 0 0 20 -4,-2.5 5,-2.1 1,-0.2 4,-0.3 0.920 115.4 48.3 -63.6 -40.0 6.6 36.1 11.0 431 431 A E H ><5S+ 0 0 135 -4,-3.5 3,-0.7 3,-0.2 -2,-0.2 0.867 111.5 51.6 -64.8 -39.1 4.5 33.1 12.0 432 432 A M H 3<5S+ 0 0 5 -4,-3.2 -2,-0.2 -5,-0.3 -1,-0.2 0.951 114.3 40.0 -64.1 -51.3 1.4 35.1 11.0 433 433 A M T 3<5S- 0 0 8 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.281 108.1-117.3 -83.4 8.0 2.6 36.1 7.5 434 434 A G T < 5 - 0 0 53 -3,-0.7 -3,-0.2 -4,-0.3 -4,-0.1 0.800 44.7-178.8 60.9 25.3 4.2 32.8 6.7 435 435 A V < - 0 0 35 -5,-2.1 2,-0.4 -6,-0.3 -1,-0.2 -0.390 14.0-154.8 -54.9 135.3 7.6 34.5 6.4 436 436 A K 0 0 187 -3,-0.1 -1,-0.0 0, 0.0 -5,-0.0 -0.963 360.0 360.0-125.7 143.8 9.9 31.6 5.5 437 437 A D 0 0 155 -2,-0.4 -2,-0.0 -177,-0.0 0, 0.0 -0.864 360.0 360.0 139.4 360.0 13.6 31.0 5.9