==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-DEC-01 1KK5 . COMPND 2 MOLECULE: STREPTOGRAMIN A ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECIUM; . AUTHOR M.SUGANTINO,S.L.RODERICK . 1236 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53712.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 840 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 203 16.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 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 . 6 0.5 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 . 122 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 216 17.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.1 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 8 10 2 0 0 0 6 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 49 11 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 . 0 0 6 1 5 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 . 0 0 6 6 0 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 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 0 123 0, 0.0 303,-0.2 0, 0.0 302,-0.1 0.000 360.0 360.0 360.0 146.2 49.7 -2.4 41.4 2 2 A G - 0 0 15 301,-2.2 2,-0.1 300,-0.3 301,-0.1 -0.182 360.0 -63.8 89.4 171.0 51.3 0.4 39.5 3 3 A P - 0 0 11 0, 0.0 8,-0.1 0, 0.0 299,-0.0 -0.354 57.0 -91.2 -86.9 174.1 49.7 3.8 38.8 4 4 A N > - 0 0 92 1,-0.1 3,-4.1 6,-0.1 -2,-0.1 -0.766 28.1-146.2 -89.6 106.2 46.6 4.5 36.7 5 5 A P T 3 S+ 0 0 21 0, 0.0 -1,-0.1 0, 0.0 16,-0.1 0.597 97.8 65.0 -46.2 -11.1 47.8 5.1 33.1 6 6 A M T 3 S+ 0 0 105 15,-0.1 2,-0.5 16,-0.1 3,-0.1 0.546 78.5 98.5 -90.9 -9.6 44.8 7.5 32.8 7 7 A K < - 0 0 87 -3,-4.1 12,-0.5 1,-0.2 4,-0.1 -0.716 65.6-151.8 -82.3 121.6 46.3 9.8 35.4 8 8 A M S S+ 0 0 72 -2,-0.5 11,-2.1 1,-0.3 -1,-0.2 0.929 94.1 29.9 -56.5 -53.1 48.1 12.7 33.8 9 9 A Y S S+ 0 0 71 9,-0.2 -1,-0.3 1,-0.2 9,-0.2 -0.871 75.1 179.8-112.1 93.8 50.6 13.2 36.6 10 10 A P + 0 0 7 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.811 59.9 71.6 -64.8 -34.6 50.9 9.7 38.0 11 11 A I S > S- 0 0 32 6,-0.4 3,-0.6 3,-0.3 2,-0.1 -0.674 89.2-112.8 -89.5 140.0 53.4 10.6 40.8 12 12 A E T 3 S+ 0 0 154 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.438 94.3 3.5 -71.1 139.8 52.2 12.6 43.8 13 13 A G T 3 S+ 0 0 87 -2,-0.1 -1,-0.2 1,-0.1 2,-0.1 0.953 105.8 107.0 48.6 56.2 53.6 16.1 44.3 14 14 A N < + 0 0 55 -3,-0.6 3,-0.3 3,-0.1 -3,-0.3 -0.606 38.0 174.0-163.2 90.5 55.4 15.8 41.0 15 15 A K S S+ 0 0 71 1,-0.2 -3,-0.1 -2,-0.1 3,-0.1 0.133 73.0 70.2 -89.1 21.7 54.0 17.9 38.1 16 16 A S S S+ 0 0 40 1,-0.1 24,-2.7 -5,-0.1 2,-0.5 0.737 81.6 65.5-109.2 -31.9 56.9 17.0 35.9 17 17 A V E S+A 39 0A 6 -3,-0.3 2,-0.4 22,-0.2 -6,-0.4 -0.823 70.5 178.9 -91.6 132.4 56.6 13.3 35.1 18 18 A Q E -A 38 0A 0 20,-1.5 20,-2.3 -2,-0.5 2,-0.4 -0.997 34.1-125.2-142.3 139.4 53.5 12.7 33.0 19 19 A F E > -A 37 0A 0 -11,-2.1 4,-0.8 -12,-0.5 18,-0.2 -0.655 25.4-152.6 -77.0 130.7 51.7 9.9 31.3 20 20 A I H > S+ 0 0 0 16,-2.2 4,-3.1 -2,-0.4 5,-0.3 0.789 79.7 68.8 -79.9 -31.5 51.4 10.9 27.6 21 21 A K H > S+ 0 0 53 15,-0.5 4,-2.7 12,-0.4 5,-0.3 0.965 102.1 47.1 -54.1 -54.5 48.3 9.0 26.5 22 22 A P H > S+ 0 0 31 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.935 117.2 44.1 -52.7 -47.9 45.9 11.1 28.6 23 23 A I H >< S+ 0 0 20 -4,-0.8 3,-0.7 1,-0.2 -2,-0.2 0.973 123.0 33.2 -62.0 -55.9 47.5 14.3 27.5 24 24 A L H >< S+ 0 0 0 -4,-3.1 3,-1.1 1,-0.2 -1,-0.2 0.562 94.5 82.7 -80.9 -12.4 47.8 13.5 23.7 25 25 A E H 3< S+ 0 0 67 -4,-2.7 2,-0.5 -5,-0.3 -1,-0.2 0.863 82.4 71.2 -59.2 -30.1 44.7 11.4 23.3 26 26 A K T << S+ 0 0 83 -3,-0.7 2,-0.4 -4,-0.5 -1,-0.3 0.032 88.6 91.0 -73.8 29.2 43.0 14.8 23.0 27 27 A L S X S- 0 0 76 -3,-1.1 3,-0.9 -2,-0.5 2,-0.3 -0.969 78.5-115.0-133.3 148.1 44.7 15.2 19.6 28 28 A E T 3 S+ 0 0 133 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.579 98.0 6.2 -77.2 132.3 43.9 14.6 16.0 29 29 A N T 3 S+ 0 0 30 -2,-0.3 32,-1.8 1,-0.2 2,-0.4 0.859 100.5 117.1 64.9 38.3 46.1 12.0 14.3 30 30 A V E < -g 61 0B 15 -3,-0.9 2,-0.4 30,-0.2 -3,-0.2 -0.999 39.3-174.4-136.8 131.9 48.0 11.0 17.4 31 31 A E E -g 62 0B 102 30,-2.7 32,-2.9 -2,-0.4 2,-0.3 -0.981 9.2-174.7-129.4 120.5 48.0 7.5 19.0 32 32 A V E -g 63 0B 15 -2,-0.4 32,-0.2 30,-0.2 33,-0.1 -0.880 19.4-125.1-117.1 146.9 49.8 7.0 22.3 33 33 A G - 0 0 6 31,-1.3 -12,-0.4 30,-0.9 32,-0.2 -0.187 30.3-102.4 -79.1 178.6 50.4 3.9 24.3 34 34 A E S S+ 0 0 56 1,-0.2 -13,-0.4 -13,-0.1 31,-0.1 0.977 105.0 22.7 -72.3 -62.5 49.5 3.3 27.9 35 35 A Y S S+ 0 0 20 -16,-0.1 -1,-0.2 -15,-0.1 30,-0.1 0.547 84.7 127.6 -90.5 3.1 52.4 3.6 30.2 36 36 A S - 0 0 0 28,-0.2 -16,-2.2 30,-0.1 -15,-0.5 -0.296 41.1-171.2 -56.3 129.9 54.6 5.7 28.0 37 37 A Y E -Ab 19 68A 16 30,-2.4 32,-1.6 -18,-0.2 2,-0.4 -0.783 20.4-142.5-123.9 168.1 55.7 8.8 30.0 38 38 A Y E -Ab 18 69A 0 -20,-2.3 -20,-1.5 -2,-0.3 2,-1.0 -0.979 11.0-144.0-135.8 122.2 57.5 12.1 29.4 39 39 A D E -A 17 0A 46 30,-2.4 -22,-0.2 -2,-0.4 33,-0.1 -0.726 29.6-128.6 -86.7 100.0 59.9 13.6 31.8 40 40 A S - 0 0 12 -24,-2.7 5,-0.1 -2,-1.0 -24,-0.0 -0.114 13.6-157.9 -51.5 138.1 59.4 17.4 31.6 41 41 A K S S- 0 0 90 3,-0.1 -1,-0.1 29,-0.1 -25,-0.0 0.670 89.7 -6.0 -90.7 -21.6 62.4 19.7 31.0 42 42 A N S S- 0 0 149 2,-0.2 -1,-0.1 -26,-0.1 -2,-0.1 0.250 114.4 -75.5-158.7 15.7 60.8 22.8 32.4 43 43 A G S S+ 0 0 43 1,-0.4 -3,-0.1 -27,-0.1 0, 0.0 -0.071 86.0 135.4 110.0 -33.0 57.2 22.1 33.2 44 44 A E - 0 0 43 1,-0.1 -1,-0.4 2,-0.1 2,-0.3 -0.036 55.9-117.4 -48.6 151.7 55.9 22.1 29.6 45 45 A T > - 0 0 27 1,-0.1 3,-2.1 -5,-0.1 4,-0.2 -0.656 25.0-111.6 -91.6 151.4 53.5 19.3 28.6 46 46 A F G > S+ 0 0 1 1,-0.3 3,-2.8 -2,-0.3 4,-0.4 0.764 110.0 73.3 -54.8 -30.9 54.5 16.9 25.8 47 47 A D G > S+ 0 0 45 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.793 92.8 58.9 -56.5 -23.9 51.9 18.2 23.4 48 48 A K G < S+ 0 0 121 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.476 94.4 64.4 -83.9 -2.4 54.1 21.2 23.1 49 49 A Q G < S+ 0 0 27 -3,-2.8 26,-2.2 -4,-0.2 2,-0.7 0.441 82.4 88.4 -96.7 -3.5 57.0 19.1 21.9 50 50 A I E < -k 75 0C 20 -3,-0.9 2,-0.3 -4,-0.4 3,-0.3 -0.863 65.7-168.1 -97.5 114.9 55.2 18.1 18.7 51 51 A L E +k 76 0C 50 24,-3.0 26,-2.6 -2,-0.7 28,-0.3 -0.798 54.0 8.3-109.8 151.1 55.9 20.6 16.0 52 52 A Y S S+ 0 0 52 -2,-0.3 27,-2.5 1,-0.2 2,-0.7 0.898 74.1 152.4 53.3 49.3 54.4 21.2 12.5 53 53 A H + 0 0 39 -3,-0.3 -1,-0.2 25,-0.1 3,-0.1 -0.897 13.4 171.1-111.5 103.9 51.5 18.8 12.9 54 54 A Y >> - 0 0 108 -2,-0.7 3,-2.6 1,-0.1 4,-0.6 -0.954 32.5-141.8-116.2 118.2 48.5 20.0 10.7 55 55 A P G >4 S+ 0 0 56 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.802 96.8 70.8 -45.1 -35.5 45.6 17.6 10.3 56 56 A I G 34 S+ 0 0 119 1,-0.3 -3,-0.0 2,-0.1 49,-0.0 0.765 94.7 52.1 -57.9 -25.5 45.2 18.6 6.7 57 57 A L G <4 S- 0 0 29 -3,-2.6 -1,-0.3 2,-0.1 3,-0.1 0.657 97.1-145.6 -85.4 -13.9 48.4 16.8 5.7 58 58 A N << + 0 0 95 -3,-1.5 2,-0.4 -4,-0.6 -2,-0.1 0.702 43.6 146.9 58.3 26.3 47.2 13.7 7.4 59 59 A D - 0 0 3 -5,-0.4 2,-0.3 53,-0.1 -1,-0.2 -0.776 35.6-149.3 -89.2 133.9 50.5 12.3 8.6 60 60 A K - 0 0 70 -2,-0.4 54,-1.6 -3,-0.1 2,-0.4 -0.710 8.7-147.4-106.6 159.0 49.9 10.5 11.9 61 61 A L E -gh 30 114B 0 -32,-1.8 -30,-2.7 -2,-0.3 2,-0.4 -0.992 17.5-177.9-126.6 127.9 52.1 10.0 14.9 62 62 A K E -gh 31 115B 68 52,-1.9 54,-2.7 -2,-0.4 2,-0.4 -0.981 6.9-172.2-130.5 139.8 52.0 6.8 17.0 63 63 A I E -gh 32 116B 7 -32,-2.9 -30,-0.9 -2,-0.4 54,-0.2 -0.993 15.9-139.8-133.0 128.7 53.8 5.8 20.1 64 64 A G - 0 0 13 52,-2.6 -31,-1.3 53,-1.0 2,-0.2 0.270 34.2 -88.5 -65.3-159.4 53.8 2.4 21.8 65 65 A K S S+ 0 0 42 1,-0.2 54,-2.7 -32,-0.2 55,-0.3 -0.709 98.0 37.3-114.4 167.7 53.7 1.9 25.5 66 66 A F S S+ 0 0 4 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.929 79.0 154.2 56.8 47.1 56.3 1.6 28.3 67 67 A C - 0 0 0 -3,-0.2 -30,-2.4 52,-0.2 2,-0.7 -0.882 38.2-148.7-105.8 135.3 58.3 4.3 26.5 68 68 A S E -bc 37 121A 0 52,-2.0 54,-2.3 -2,-0.4 2,-0.7 -0.923 15.8-168.6-105.6 108.9 60.7 6.4 28.5 69 69 A I E -bc 38 122A 4 -32,-1.6 -30,-2.4 -2,-0.7 54,-0.1 -0.879 11.2-144.3-105.2 113.0 60.9 9.8 26.9 70 70 A G > - 0 0 8 52,-2.6 3,-0.9 -2,-0.7 -29,-0.1 -0.026 34.0 -76.8 -62.8 171.7 63.6 12.1 28.2 71 71 A P T 3 S+ 0 0 11 0, 0.0 54,-3.1 0, 0.0 55,-0.2 -0.327 109.7 17.6 -73.3 153.4 63.3 15.8 28.6 72 72 A G T 3 S+ 0 0 8 52,-0.2 -32,-0.1 1,-0.2 -2,-0.1 0.500 82.0 155.9 69.0 1.6 63.4 18.3 25.7 73 73 A V < - 0 0 1 -3,-0.9 2,-0.4 52,-0.2 -1,-0.2 -0.319 27.3-153.8 -59.4 143.6 62.8 15.5 23.2 74 74 A T E - l 0 127C 22 52,-3.2 54,-3.2 -3,-0.1 2,-0.5 -0.977 16.3-161.1-131.9 139.1 61.3 16.9 20.0 75 75 A I E -kl 50 128C 2 -26,-2.2 -24,-3.0 -2,-0.4 2,-0.6 -0.963 8.9-163.2-118.2 117.0 59.1 15.5 17.3 76 76 A I E -k 51 0C 12 52,-2.9 -24,-0.2 -2,-0.5 2,-0.1 -0.888 10.1-165.6-102.0 122.6 59.0 17.3 13.9 77 77 A M > - 0 0 0 -26,-2.6 3,-0.8 -2,-0.6 -24,-0.1 -0.310 41.6 -84.6 -95.7-176.0 56.1 16.4 11.6 78 78 A N G > S+ 0 0 4 1,-0.2 3,-1.6 34,-0.1 -25,-0.1 0.497 99.5 100.6 -71.7 -0.2 55.6 17.1 7.9 79 79 A G G 3 S+ 0 0 17 -27,-2.5 -1,-0.2 -28,-0.3 -27,-0.2 0.532 80.7 48.1 -64.9 -5.0 54.2 20.6 8.6 80 80 A A G < S+ 0 0 29 -3,-0.8 2,-0.3 -28,-0.2 -1,-0.3 0.397 77.2 125.9-116.2 5.0 57.5 22.3 7.8 81 81 A N < - 0 0 35 -3,-1.6 2,-0.2 28,-0.1 3,-0.1 -0.503 48.3-147.9 -69.8 121.9 58.3 20.6 4.5 82 82 A H - 0 0 33 -2,-0.3 7,-0.1 1,-0.1 6,-0.1 -0.570 27.3 -97.5 -88.7 152.0 59.0 23.1 1.6 83 83 A R - 0 0 27 -2,-0.2 25,-0.1 1,-0.1 -1,-0.1 -0.431 42.1-179.5 -65.5 142.8 58.2 22.3 -2.0 84 84 A M + 0 0 66 23,-0.4 -1,-0.1 -2,-0.1 4,-0.1 0.463 52.6 97.6-128.2 -2.0 61.3 21.1 -3.7 85 85 A D S S- 0 0 66 22,-0.2 527,-0.1 526,-0.2 2,-0.1 0.804 113.0 -16.5 -59.1 -24.0 60.7 20.3 -7.4 86 86 A G S S+ 0 0 1 525,-0.4 525,-0.3 1,-0.4 2,-0.1 -0.249 125.2 8.2-142.1-125.6 62.0 23.8 -8.0 87 87 A S - 0 0 3 523,-1.8 -1,-0.4 1,-0.1 -2,-0.1 -0.417 52.2-149.0 -69.8 140.8 62.6 26.8 -5.7 88 88 A T + 0 0 3 445,-0.3 -1,-0.1 392,-0.1 -5,-0.1 0.372 59.1 120.4 -90.0 2.4 62.1 26.2 -2.0 89 89 A Y - 0 0 5 1,-0.1 2,-1.4 -7,-0.1 3,-0.2 -0.497 64.5-134.0 -72.7 133.6 60.9 29.8 -1.4 90 90 A P >> + 0 0 17 0, 0.0 3,-0.8 0, 0.0 4,-0.6 -0.523 39.1 159.7 -88.1 69.5 57.4 30.1 0.1 91 91 A F G >4 S+ 0 0 1 -2,-1.4 3,-2.7 1,-0.2 4,-0.3 0.963 71.4 59.7 -51.0 -58.3 56.0 32.8 -2.2 92 92 A N G >4 S+ 0 0 41 1,-0.3 3,-1.3 -3,-0.2 -1,-0.2 0.749 93.6 68.0 -41.6 -34.3 52.4 31.9 -1.3 93 93 A L G <4 S+ 0 0 74 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.825 95.3 54.6 -59.5 -34.2 53.1 32.6 2.3 94 94 A F G << S- 0 0 3 -3,-2.7 -1,-0.2 -4,-0.6 -2,-0.2 0.371 85.9-163.8 -86.2 3.5 53.5 36.4 1.7 95 95 A G X + 0 0 17 -3,-1.3 3,-2.0 -4,-0.3 -1,-0.2 -0.092 48.0 120.2 50.0-145.6 50.2 37.0 -0.0 96 96 A N T 3 S- 0 0 98 1,-0.3 320,-1.8 2,-0.1 -1,-0.1 0.802 115.7 -37.8 56.1 32.4 49.8 40.3 -2.0 97 97 A G T > S+ 0 0 18 318,-0.2 3,-1.1 -5,-0.1 -1,-0.3 -0.050 129.9 89.8 111.5 -30.7 49.1 38.3 -5.1 98 98 A W G X + 0 0 0 -3,-2.0 3,-2.3 1,-0.2 -6,-0.2 0.661 61.2 87.1 -73.6 -15.9 51.5 35.5 -4.5 99 99 A E G > S+ 0 0 112 1,-0.3 3,-2.3 2,-0.2 -1,-0.2 0.846 73.0 81.3 -49.6 -31.8 48.9 33.5 -2.6 100 100 A K G < S+ 0 0 159 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.808 84.4 55.4 -38.1 -46.5 48.2 32.4 -6.2 101 101 A H G < S+ 0 0 15 -3,-2.3 -1,-0.3 -4,-0.1 -9,-0.2 0.147 71.0 152.4 -84.1 19.5 51.0 29.9 -6.0 102 102 A M < - 0 0 113 -3,-2.3 2,-0.1 -10,-0.1 -3,-0.0 -0.273 51.3-111.9 -51.1 126.6 49.7 28.0 -2.9 103 103 A P - 0 0 31 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.351 25.2-118.5 -66.9 145.5 51.1 24.5 -3.3 104 104 A K >> - 0 0 133 1,-0.1 3,-4.7 -3,-0.1 4,-1.0 -0.637 22.3-116.2 -86.8 139.5 48.8 21.6 -4.0 105 105 A L G >4 S+ 0 0 107 1,-0.3 3,-1.1 -2,-0.3 -1,-0.1 0.880 119.1 54.0 -37.0 -54.4 48.6 18.8 -1.4 106 106 A D G 34 S+ 0 0 140 1,-0.2 -1,-0.3 3,-0.1 -2,-0.0 0.417 106.6 56.2 -65.2 4.0 50.0 16.4 -4.0 107 107 A Q G <4 S+ 0 0 52 -3,-4.7 -23,-0.4 2,-0.1 -1,-0.2 0.661 88.1 78.8-106.6 -27.4 52.9 18.8 -4.4 108 108 A L S << S- 0 0 41 -3,-1.1 2,-0.4 -4,-1.0 -25,-0.1 -0.716 86.5-121.6 -81.6 134.6 54.2 19.0 -0.8 109 109 A P - 0 0 54 0, 0.0 2,-0.5 0, 0.0 -28,-0.1 -0.622 24.9-167.6 -83.0 129.5 56.3 15.9 0.0 110 110 A I - 0 0 72 -2,-0.4 3,-0.1 1,-0.1 -31,-0.0 -0.972 12.1-160.6-118.6 121.6 55.2 13.7 2.9 111 111 A K - 0 0 148 -2,-0.5 2,-0.2 1,-0.3 -1,-0.1 0.562 50.5-107.0 -76.1 -9.3 57.7 11.2 4.1 112 112 A G - 0 0 29 2,-0.0 19,-0.4 -3,-0.0 -1,-0.3 -0.665 53.9 -30.4 114.9-172.0 55.0 9.2 5.9 113 113 A D - 0 0 62 -2,-0.2 2,-0.6 18,-0.2 -52,-0.2 -0.484 54.8-124.1 -83.3 156.3 53.9 8.6 9.4 114 114 A T E -h 61 0B 0 -54,-1.6 -52,-1.9 17,-0.2 2,-0.5 -0.891 29.9-168.1-100.2 122.7 56.3 8.6 12.4 115 115 A I E -hi 62 133B 59 17,-2.7 19,-3.4 -2,-0.6 2,-0.6 -0.944 13.0-173.6-123.1 121.3 56.2 5.4 14.3 116 116 A I E -hi 63 134B 5 -54,-2.7 -52,-2.6 -2,-0.5 19,-0.2 -0.931 20.7-145.2-110.6 115.1 57.8 4.8 17.8 117 117 A G - 0 0 10 17,-2.8 -53,-1.0 -2,-0.6 3,-0.4 0.343 29.2 -74.3 -60.6-162.5 57.5 1.2 19.0 118 118 A N S S+ 0 0 26 1,-0.2 19,-3.3 -54,-0.2 20,-0.3 -0.639 106.6 20.6 -99.3 158.6 57.1 -0.1 22.5 119 119 A D S S+ 0 0 2 -54,-2.7 2,-0.4 -2,-0.2 176,-0.3 0.800 86.1 153.1 56.3 31.3 59.6 -0.2 25.3 120 120 A V - 0 0 1 -3,-0.4 -52,-2.0 -55,-0.3 2,-0.5 -0.747 33.9-154.9 -95.5 136.4 61.7 2.4 23.6 121 121 A W E -cd 68 139A 38 17,-2.7 19,-3.2 -2,-0.4 2,-0.6 -0.955 8.6-169.3-111.9 120.6 64.0 4.8 25.5 122 122 A I E -cd 69 140A 2 -54,-2.3 -52,-2.6 -2,-0.5 19,-0.2 -0.940 19.9-129.9-113.9 115.8 64.7 8.2 23.9 123 123 A G > - 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