==== 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 OXIDOREDUCTASE 27-JUN-05 2CX4 . COMPND 2 MOLECULE: BACTERIOFERRITIN COMIGRATORY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: AEROPYRUM PERNIX; . AUTHOR E.MIZOHATA,K.MURAYAMA,M.IDAKA,A.TATSUGUCHI,T.TERADA,M.SHIROU . 1284 8 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55820.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 835 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 92 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 200 15.6 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 . 14 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 0.7 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 . 107 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 154 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 242 18.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.5 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 7 9 3 0 0 0 4 6 7 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 1 7 7 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 . 17 5 10 5 11 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 ANTIPARALLEL BRIDGES PER LADDER . 15 1 2 3 2 2 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 3 A G 0 0 58 0, 0.0 2,-1.0 0, 0.0 102,-0.1 0.000 360.0 360.0 360.0 2.1 54.3 18.3 19.6 2 4 A L + 0 0 166 1,-0.1 2,-2.2 2,-0.0 102,-0.1 -0.579 360.0 167.2-101.2 73.0 57.6 19.7 20.8 3 5 A V - 0 0 2 -2,-1.0 3,-0.1 100,-0.1 6,-0.1 -0.399 23.0-178.5 -83.4 63.3 59.9 19.2 17.8 4 6 A E > - 0 0 102 -2,-2.2 3,-1.1 1,-0.1 127,-0.3 -0.211 35.9 -90.8 -64.1 153.6 62.5 21.5 19.4 5 7 A L T 3 S+ 0 0 88 1,-0.2 127,-0.2 129,-0.1 -1,-0.1 -0.480 113.6 17.4 -67.7 130.3 65.8 22.2 17.5 6 8 A G T 3 S+ 0 0 41 125,-2.9 2,-0.5 1,-0.2 -1,-0.2 0.054 102.9 105.1 96.6 -26.5 68.4 19.7 18.4 7 9 A E S < S- 0 0 118 -3,-1.1 124,-0.5 123,-0.1 -1,-0.2 -0.786 84.5 -90.6 -95.0 130.3 66.0 17.2 19.8 8 10 A K B -A 130 0A 143 -2,-0.5 122,-0.3 122,-0.2 -4,-0.1 0.042 40.0-117.8 -40.2 132.3 65.1 14.1 17.8 9 11 A A - 0 0 0 120,-3.1 -1,-0.1 1,-0.1 2,-0.1 -0.600 33.5-103.1 -78.9 127.1 62.2 14.3 15.4 10 12 A P - 0 0 41 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 -0.270 39.2-126.7 -51.6 116.7 59.3 12.0 16.1 11 13 A D + 0 0 57 -2,-0.1 2,-0.3 13,-0.1 12,-0.0 -0.315 38.0 170.5 -65.5 150.9 59.5 9.1 13.5 12 14 A F - 0 0 19 2,-0.0 12,-2.8 88,-0.0 2,-0.4 -0.937 27.9-138.7-153.1 172.4 56.3 8.4 11.5 13 15 A T E +B 23 0B 71 -2,-0.3 10,-0.2 10,-0.2 87,-0.0 -0.966 26.6 165.4-144.1 124.5 54.9 6.5 8.6 14 16 A L E -B 22 0B 14 8,-1.8 8,-2.8 -2,-0.4 81,-0.1 -0.847 34.8 -93.9-133.8 169.2 52.5 7.8 6.0 15 17 A P - 0 0 43 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.493 36.1-128.4 -59.0-151.2 51.1 6.9 2.5 16 18 A N > - 0 0 1 77,-0.1 3,-3.2 5,-0.1 64,-0.2 -0.954 32.8 -95.9-160.1 163.9 52.4 8.1 -0.8 17 19 A Q T 3 S+ 0 0 0 1,-0.3 63,-0.3 -2,-0.3 76,-0.1 0.804 136.1 43.4 -57.4 -23.1 51.0 9.7 -3.9 18 20 A D T 3 S- 0 0 61 2,-0.1 -1,-0.3 74,-0.1 59,-0.1 0.047 125.7-105.8-108.0 21.3 51.0 6.1 -5.0 19 21 A F S < S+ 0 0 64 -3,-3.2 -2,-0.1 1,-0.2 74,-0.0 0.843 71.4 148.3 56.9 38.5 49.6 4.8 -1.7 20 22 A E - 0 0 99 1,-0.0 -1,-0.2 -6,-0.0 -2,-0.1 -0.911 51.7-114.7-107.6 126.6 53.0 3.4 -0.7 21 23 A P - 0 0 105 0, 0.0 2,-0.4 0, 0.0 -5,-0.1 -0.369 32.6-169.5 -60.5 129.6 54.0 3.3 3.0 22 24 A V E -B 14 0B 11 -8,-2.8 -8,-1.8 -7,-0.2 2,-0.4 -0.980 4.5-160.9-124.4 134.3 56.9 5.6 3.8 23 25 A N E > -B 13 0B 36 -2,-0.4 4,-3.0 -10,-0.2 -10,-0.2 -0.975 12.7-143.3-121.1 128.8 58.7 5.6 7.2 24 26 A L H > S+ 0 0 1 -12,-2.8 4,-1.9 -2,-0.4 5,-0.2 0.962 99.1 34.4 -50.1 -76.7 60.9 8.5 8.5 25 27 A Y H > S+ 0 0 82 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.774 117.0 59.1 -54.2 -27.6 63.8 6.8 10.3 26 28 A E H >4 S+ 0 0 84 2,-0.2 3,-1.2 1,-0.2 -1,-0.2 0.976 107.4 44.0 -64.4 -54.7 63.6 4.0 7.7 27 29 A V H >< S+ 0 0 14 -4,-3.0 3,-1.1 1,-0.3 5,-0.3 0.789 110.1 57.4 -61.5 -27.4 64.2 6.4 4.9 28 30 A L H >< S+ 0 0 8 -4,-1.9 3,-2.4 1,-0.2 -1,-0.3 0.767 88.0 75.2 -74.3 -23.8 67.0 7.9 7.1 29 31 A K T << S+ 0 0 173 -3,-1.2 -1,-0.2 -4,-1.1 -2,-0.2 0.547 78.5 77.1 -64.4 -5.1 68.6 4.5 7.2 30 32 A R T < S- 0 0 117 -3,-1.1 -1,-0.3 2,-0.2 -2,-0.2 0.731 111.6-118.0 -75.9 -22.4 69.7 5.3 3.7 31 33 A G S < S+ 0 0 41 -3,-2.4 -2,-0.1 1,-0.4 -3,-0.1 0.079 80.0 104.8 108.0 -23.2 72.3 7.6 5.2 32 34 A R S S- 0 0 91 -5,-0.3 -1,-0.4 1,-0.1 -2,-0.2 -0.530 74.1-104.3 -89.9 158.7 71.1 10.9 3.7 33 35 A P - 0 0 3 0, 0.0 34,-1.6 0, 0.0 2,-0.3 -0.237 34.0-121.5 -74.1 167.8 69.3 13.6 5.7 34 36 A A E -cD 67 125C 2 91,-2.1 91,-0.9 32,-0.2 2,-0.5 -0.859 13.9-158.5-116.8 149.9 65.5 14.3 5.4 35 37 A V E -cD 68 124C 3 32,-2.1 34,-3.6 -2,-0.3 2,-1.0 -0.960 3.5-162.8-129.1 114.4 63.6 17.3 4.3 36 38 A L E -cD 69 123C 1 87,-2.7 2,-1.3 -2,-0.5 87,-1.3 -0.774 5.8-170.7-100.2 92.3 59.9 17.6 5.4 37 39 A I E -cD 70 122C 0 -2,-1.0 34,-2.1 32,-0.8 85,-0.2 -0.658 10.8-164.9 -83.3 89.7 58.3 20.3 3.2 38 40 A F E -cD 71 121C 0 83,-3.1 83,-0.6 -2,-1.3 34,-0.2 -0.468 9.4-179.7 -75.3 148.4 54.9 20.8 4.8 39 41 A F - 0 0 0 32,-1.8 34,-0.3 81,-0.2 79,-0.3 -0.976 31.4-132.1-152.1 136.3 52.3 22.6 2.8 40 42 A P S S- 0 0 4 0, 0.0 33,-0.5 0, 0.0 78,-0.4 0.918 82.2 -8.2 -50.8 -56.1 48.7 23.7 3.5 41 43 A A > - 0 0 2 31,-0.1 3,-1.3 76,-0.1 6,-0.2 -0.938 62.9-116.2-158.8 132.2 47.0 22.5 0.3 42 44 A A T 3 S+ 0 0 0 -2,-0.3 194,-0.1 1,-0.3 196,-0.1 -0.219 103.9 25.1 -58.0 148.5 47.8 21.1 -3.1 43 45 A F T 3 S+ 0 0 28 1,-0.3 -1,-0.3 2,-0.1 198,-0.0 0.631 91.3 141.0 66.9 15.5 46.8 23.3 -6.0 44 46 A S <> - 0 0 12 -3,-1.3 4,-1.9 1,-0.1 5,-0.3 -0.534 64.5-114.4 -83.1 151.8 47.0 26.3 -3.7 45 47 A P H > S+ 0 0 73 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.942 113.2 25.7 -53.0 -53.8 48.5 29.5 -5.1 46 48 A V H > S+ 0 0 2 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.867 114.9 63.7 -81.2 -38.9 51.7 29.5 -2.9 47 49 A C H > S+ 0 0 0 1,-0.2 4,-2.3 -6,-0.2 5,-0.3 0.913 106.9 45.2 -50.6 -47.6 51.9 25.8 -2.2 48 50 A T H X S+ 0 0 32 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.915 111.5 52.2 -63.9 -43.8 52.4 25.2 -6.0 49 51 A K H X S+ 0 0 91 -4,-1.0 4,-2.0 -5,-0.3 -2,-0.2 0.924 111.7 48.8 -57.9 -44.4 55.0 28.0 -6.2 50 52 A E H X S+ 0 0 0 -4,-3.0 4,-2.0 2,-0.2 3,-0.5 0.986 115.9 38.2 -61.3 -64.8 56.9 26.5 -3.2 51 53 A L H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.846 113.4 58.9 -57.3 -34.0 57.1 22.8 -4.4 52 54 A C H >X S+ 0 0 22 -4,-2.6 4,-2.0 -5,-0.3 3,-0.5 0.922 105.9 48.4 -59.1 -43.7 57.6 24.1 -8.0 53 55 A T H 3X S+ 0 0 31 -4,-2.0 4,-1.7 -3,-0.5 -1,-0.2 0.900 108.1 55.0 -62.9 -39.7 60.7 25.9 -6.7 54 56 A F H 3< S+ 0 0 4 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.725 109.3 48.3 -66.2 -20.5 61.7 22.7 -4.9 55 57 A R H X< S+ 0 0 84 -4,-1.2 3,-0.6 -3,-0.5 -1,-0.2 0.819 113.6 45.7 -85.8 -35.0 61.5 21.0 -8.3 56 58 A D H 3< S+ 0 0 105 -4,-2.0 3,-0.4 1,-0.2 -2,-0.2 0.635 108.7 56.5 -83.1 -16.1 63.5 23.7 -10.1 57 59 A K T 3< S+ 0 0 63 -4,-1.7 -1,-0.2 1,-0.2 4,-0.1 -0.261 71.6 104.8-109.9 44.8 66.2 23.8 -7.4 58 60 A X <> + 0 0 25 -3,-0.6 4,-3.4 2,-0.2 5,-0.4 0.673 60.0 79.3 -94.2 -20.3 67.2 20.2 -7.5 59 61 A A T 4 S+ 0 0 79 -3,-0.4 4,-0.5 1,-0.3 -1,-0.1 0.884 112.1 25.3 -51.4 -40.6 70.4 20.9 -9.4 60 62 A Q T 4 S+ 0 0 105 2,-0.1 -1,-0.3 1,-0.1 -2,-0.2 0.493 120.7 59.8-101.3 -8.7 71.9 21.9 -6.0 61 63 A L T 4 S+ 0 0 7 2,-0.1 5,-0.3 -4,-0.1 3,-0.2 0.730 104.2 49.7 -90.2 -24.5 69.5 19.8 -4.0 62 64 A E S >< S+ 0 0 114 -4,-3.4 3,-1.1 1,-0.2 -2,-0.1 0.788 105.4 54.7 -82.2 -33.3 70.6 16.5 -5.6 63 65 A K T 3 S+ 0 0 127 -4,-0.5 -1,-0.2 -5,-0.4 -2,-0.1 0.387 99.6 65.7 -80.9 4.0 74.3 17.2 -5.1 64 66 A A T 3 S- 0 0 1 -3,-0.2 -1,-0.3 -6,-0.2 -2,-0.2 0.564 101.2-142.3 -95.9 -16.0 73.3 17.6 -1.4 65 67 A N < + 0 0 86 -3,-1.1 2,-0.2 1,-0.1 -3,-0.1 0.964 48.1 123.7 48.7 86.6 72.4 13.9 -1.4 66 68 A A - 0 0 22 -5,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.695 62.2 -97.4-147.9-161.7 69.3 13.8 0.8 67 69 A E E -c 34 0C 43 -34,-1.6 -32,-2.1 -2,-0.2 2,-0.3 -0.815 30.4-159.9-138.7 95.3 65.6 12.7 0.9 68 70 A V E +c 35 0C 13 -2,-0.3 23,-0.7 -34,-0.2 2,-0.3 -0.574 12.4 177.3 -77.6 132.5 62.9 15.4 0.2 69 71 A L E -ce 36 91C 8 -34,-3.6 -32,-0.8 -2,-0.3 23,-0.2 -0.841 10.2-164.6-142.1 101.6 59.4 14.6 1.4 70 72 A A E -ce 37 92C 0 21,-1.5 23,-2.5 -2,-0.3 2,-0.3 -0.462 15.9-170.8 -78.0 155.9 56.6 17.1 1.1 71 73 A I E +ce 38 93C 2 -34,-2.1 -32,-1.8 21,-0.2 2,-0.2 -0.944 17.1 154.2-158.7 134.6 53.5 16.6 3.1 72 74 A S E - e 0 94C 0 21,-1.6 23,-2.4 -2,-0.3 -31,-0.1 -0.748 51.3-101.3-139.2-174.3 49.9 17.9 3.6 73 75 A V S S+ 0 0 1 -33,-0.5 2,-0.2 -34,-0.3 21,-0.1 0.151 79.2 117.6-102.2 18.2 46.6 16.7 4.8 74 76 A D S S- 0 0 6 19,-0.2 22,-0.3 1,-0.1 -2,-0.2 -0.548 75.4 -91.9 -84.1 152.4 45.2 16.0 1.3 75 77 A S > - 0 0 2 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.148 36.3-107.9 -59.3 156.0 44.1 12.5 0.2 76 78 A P H > S+ 0 0 2 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.814 121.7 55.0 -55.5 -28.8 46.7 10.3 -1.5 77 79 A W H > S+ 0 0 23 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.924 104.2 48.5 -72.1 -47.2 44.7 11.0 -4.7 78 80 A a H > S+ 0 0 2 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.925 116.2 47.5 -59.7 -39.3 44.7 14.8 -4.6 79 81 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.907 105.0 55.7 -66.8 -47.9 48.5 14.5 -4.0 80 82 A K H X S+ 0 0 74 -4,-2.3 4,-1.4 -63,-0.3 5,-0.2 0.882 110.1 48.2 -53.4 -40.4 49.2 12.0 -6.8 81 83 A K H X S+ 0 0 57 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.893 107.0 56.5 -67.9 -39.3 47.5 14.4 -9.2 82 84 A F H X S+ 0 0 0 -4,-1.6 4,-1.7 -5,-0.2 -2,-0.2 0.868 103.6 55.3 -60.0 -39.2 49.5 17.3 -7.8 83 85 A K H >X>S+ 0 0 30 -4,-2.0 4,-1.1 1,-0.2 3,-0.8 0.991 112.4 37.5 -59.2 -67.8 52.9 15.6 -8.6 84 86 A D H 3<5S+ 0 0 61 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.790 107.8 71.1 -56.3 -26.8 52.4 14.9 -12.3 85 87 A E H 3<5S+ 0 0 75 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.960 122.0 11.7 -53.2 -53.8 50.7 18.3 -12.4 86 88 A N H <<5S- 0 0 23 -4,-1.7 -1,-0.2 -3,-0.8 -2,-0.2 0.209 108.9-120.9-108.4 11.8 54.1 20.0 -11.8 87 89 A R T <5 - 0 0 171 -4,-1.1 -3,-0.2 -5,-0.1 2,-0.2 0.946 41.2-171.6 42.4 74.4 56.0 16.8 -12.5 88 90 A L < - 0 0 11 -5,-0.7 -1,-0.1 1,-0.1 -36,-0.1 -0.526 22.9-151.9 -90.3 158.8 57.8 16.6 -9.2 89 91 A A S S+ 0 0 73 -2,-0.2 -1,-0.1 2,-0.1 2,-0.1 0.803 71.2 71.3 -99.2 -38.9 60.6 14.1 -8.4 90 92 A F S S- 0 0 13 1,-0.1 -21,-0.1 -7,-0.0 2,-0.1 -0.335 88.5 -95.1 -80.2 162.2 60.2 13.6 -4.6 91 93 A N E -e 69 0C 52 -23,-0.7 -21,-1.5 -2,-0.1 2,-0.5 -0.411 25.0-146.4 -77.8 151.6 57.4 11.8 -2.8 92 94 A L E -e 70 0C 0 -23,-0.2 2,-0.3 -2,-0.1 -21,-0.2 -0.970 14.9-158.1-120.8 111.9 54.4 13.6 -1.4 93 95 A L E -e 71 0C 1 -23,-2.5 -21,-1.6 -2,-0.5 2,-0.4 -0.657 7.0-140.8 -92.4 148.3 53.0 12.0 1.9 94 96 A S E -e 72 0C 1 -2,-0.3 -21,-0.2 -23,-0.2 3,-0.1 -0.868 15.7-172.5-110.7 139.9 49.4 12.5 3.1 95 97 A D > + 0 0 2 -23,-2.4 3,-3.0 -2,-0.4 6,-0.2 -0.395 20.0 160.8-124.8 53.3 48.3 13.0 6.6 96 98 A Y T 3 S+ 0 0 14 1,-0.3 -1,-0.1 -22,-0.3 -23,-0.1 0.681 75.9 55.5 -46.0 -22.6 44.6 12.8 6.1 97 99 A N T 3 S- 0 0 40 -3,-0.1 -1,-0.3 178,-0.0 -24,-0.1 0.158 108.2-121.4-101.9 16.6 44.3 12.2 9.8 98 100 A R S <> S+ 0 0 26 -3,-3.0 4,-0.8 18,-0.1 -2,-0.1 0.771 72.1 132.1 49.1 30.4 46.2 15.3 11.1 99 101 A E H > + 0 0 123 2,-0.2 4,-1.2 1,-0.1 -1,-0.1 0.920 69.2 36.1 -76.5 -49.2 48.7 12.9 12.8 100 102 A V H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.2 -1,-0.1 0.686 115.6 54.8 -80.6 -21.9 52.1 14.4 11.7 101 103 A I H 4>S+ 0 0 0 2,-0.2 5,-2.2 -6,-0.2 6,-0.3 0.832 112.1 42.7 -80.7 -31.4 50.9 18.0 11.9 102 104 A K H <5S+ 0 0 118 -4,-0.8 3,-0.2 3,-0.2 -2,-0.2 0.827 118.3 48.7 -77.6 -32.3 49.7 17.6 15.5 103 105 A L H <5S+ 0 0 56 -4,-1.2 -2,-0.2 1,-0.2 -3,-0.2 0.941 117.7 37.4 -69.3 -53.6 52.9 15.7 16.2 104 106 A Y T <5S- 0 0 0 -4,-2.5 -1,-0.2 -102,-0.1 -2,-0.2 0.284 108.3-126.4 -84.2 10.1 55.3 18.2 14.5 105 107 A N T 5S+ 0 0 64 -3,-0.2 -3,-0.2 1,-0.1 -4,-0.1 0.901 71.5 121.7 42.9 63.0 53.2 21.1 15.8 106 108 A V < + 0 0 0 -5,-2.2 13,-3.5 -6,-0.1 2,-0.4 -0.273 33.3 127.2-145.3 50.0 52.7 22.8 12.5 107 109 A Y E -G 118 0D 67 11,-0.3 2,-0.5 -6,-0.3 11,-0.3 -0.920 55.7-127.5-117.3 137.4 48.9 23.0 12.0 108 110 A H E -G 117 0D 22 9,-4.9 9,-1.3 -2,-0.4 8,-0.6 -0.674 11.4-144.1 -81.4 125.7 46.7 26.0 11.3 109 111 A E E S- 0 0 140 -2,-0.5 7,-0.7 1,-0.2 2,-0.3 0.874 84.9 -8.9 -54.7 -37.6 43.9 26.3 13.7 110 112 A D E -G 115 0D 79 5,-0.2 2,-0.3 7,-0.1 -1,-0.2 -0.971 63.1-170.6-160.5 146.3 41.8 27.6 10.8 111 113 A L E > S-G 114 0D 22 3,-3.3 3,-3.6 -2,-0.3 -3,-0.0 -0.910 74.4 -28.9-149.6 117.0 42.4 28.6 7.2 112 114 A K T 3 S- 0 0 65 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.750 127.2 -48.5 47.8 29.3 39.9 30.2 4.9 113 115 A G T 3 S+ 0 0 41 1,-0.4 -1,-0.3 144,-0.0 2,-0.2 0.219 117.1 118.5 98.2 -13.2 37.2 28.5 6.9 114 116 A L E < -G 111 0D 5 -3,-3.6 -3,-3.3 143,-0.0 -1,-0.4 -0.603 55.7-138.3 -86.9 146.5 39.0 25.1 6.7 115 117 A K E +G 110 0D 93 -2,-0.2 -5,-0.2 -5,-0.2 -6,-0.1 -0.793 67.4 13.3-109.8 151.0 40.1 23.4 9.9 116 118 A X E S+ 0 0 35 -7,-0.7 2,-0.4 -8,-0.6 -1,-0.2 0.977 74.3 165.7 50.0 82.0 43.3 21.5 10.8 117 119 A V E -G 108 0D 2 -9,-1.3 -9,-4.9 -3,-0.2 2,-0.4 -0.960 42.2-107.7-126.8 140.9 45.6 22.4 8.0 118 120 A A E -G 107 0D 0 -78,-0.4 -11,-0.3 -2,-0.4 -45,-0.1 -0.534 34.2-135.3 -69.3 122.1 49.4 22.0 7.8 119 121 A K - 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