==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-AUG-98 1BSH . COMPND 2 MOLECULE: PROTEIN (EPSILON SUBUNIT); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.WILKENS,R.A.CAPALDI . 138 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9299.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 79 57.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 19.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 . 7 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 14.5 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 2 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 3 1 0 0 3 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 1 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 A 0 0 143 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.3 -23.6 0.6 10.1 2 2 A M + 0 0 133 33,-0.1 2,-0.3 20,-0.0 35,-0.0 -0.027 360.0 69.1-148.9 36.4 -20.0 -0.5 9.7 3 3 A T + 0 0 43 33,-0.1 2,-0.3 32,-0.1 18,-0.2 -0.993 44.9 167.9-152.7 158.5 -19.4 -1.1 6.0 4 4 A Y E -A 20 0A 14 16,-1.6 16,-1.3 -2,-0.3 2,-0.6 -0.956 41.0 -90.1-159.6 175.1 -19.0 1.0 2.8 5 5 A H E -Ab 19 75A 57 69,-2.3 71,-1.6 -2,-0.3 2,-0.3 -0.844 41.8-175.3 -99.4 124.8 -17.9 0.5 -0.9 6 6 A L E -A 18 0A 5 12,-2.0 12,-1.6 -2,-0.6 71,-0.2 -0.795 10.5-169.3-114.7 159.9 -14.3 1.3 -1.5 7 7 A D E +A 17 0A 35 69,-0.4 71,-1.8 -2,-0.3 2,-0.5 -0.645 8.6 174.1-150.3 90.2 -12.5 1.3 -4.9 8 8 A V E +Ac 16 78A 12 8,-2.0 8,-1.3 69,-0.2 7,-1.0 -0.830 17.3 146.5-100.1 132.2 -8.6 1.5 -5.0 9 9 A V E - c 0 79A 19 69,-1.4 71,-1.2 -2,-0.5 2,-0.1 -0.951 40.0-141.5-152.8 171.5 -6.9 1.3 -8.4 10 10 A S S S- 0 0 4 -2,-0.3 73,-0.2 69,-0.2 69,-0.1 -0.518 72.6 -51.9-141.2 72.6 -3.9 2.5 -10.3 11 11 A A S S+ 0 0 65 2,-0.1 3,-0.1 -2,-0.1 -1,-0.1 0.886 130.8 0.3 61.8 101.1 -4.7 3.3 -14.0 12 12 A E S S+ 0 0 178 1,-0.2 2,-0.3 -3,-0.0 -1,-0.0 0.980 108.5 122.4 55.2 58.2 -6.3 0.2 -15.5 13 13 A Q - 0 0 103 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.992 48.5-160.5-147.4 154.2 -6.2 -1.8 -12.3 14 14 A Q + 0 0 144 -2,-0.3 3,-0.2 -5,-0.1 -5,-0.2 -0.598 32.8 143.1-137.8 76.9 -8.7 -3.6 -10.0 15 15 A M S S- 0 0 33 -7,-1.0 2,-0.4 1,-0.3 -6,-0.1 0.973 77.6 -3.3 -79.7 -63.7 -7.2 -4.2 -6.5 16 16 A F E +A 8 0A 11 -8,-1.3 -8,-2.0 2,-0.0 2,-0.3 -0.965 69.3 150.5-135.2 121.9 -10.2 -3.6 -4.2 17 17 A S E +A 7 0A 47 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.772 45.6 46.9-152.8 103.2 -13.7 -2.6 -5.4 18 18 A G E S-A 6 0A 21 -12,-1.6 -12,-2.0 -2,-0.3 -14,-0.1 -0.984 95.8 -10.7 158.9-164.2 -16.9 -3.6 -3.6 19 19 A L E +A 5 0A 85 -2,-0.3 2,-0.2 -14,-0.2 -14,-0.2 -0.163 63.8 176.2 -56.6 155.9 -18.3 -3.7 -0.0 20 20 A V E -A 4 0A 0 -16,-1.3 -16,-1.6 34,-0.2 34,-0.3 -0.743 32.0-160.5-168.4 116.9 -15.6 -3.1 2.6 21 21 A E S S- 0 0 57 32,-1.9 2,-0.3 1,-0.3 33,-0.2 0.958 80.2 -34.6 -66.5 -47.5 -15.8 -2.8 6.4 22 22 A K B -F 53 0B 90 31,-1.3 31,-1.9 13,-0.1 -1,-0.3 -0.907 52.3-150.7-173.0 144.4 -12.4 -1.0 6.6 23 23 A I - 0 0 20 11,-0.9 10,-0.4 29,-0.3 2,-0.2 0.081 21.5-131.2 -98.3-145.7 -9.0 -1.0 4.9 24 24 A Q - 0 0 56 9,-0.2 27,-1.0 8,-0.2 2,-0.5 -0.787 10.3-159.6-174.1 127.3 -5.7 -0.1 6.5 25 25 A V E -G 50 0C 14 -2,-0.2 2,-0.5 25,-0.2 25,-0.2 -0.939 6.1-175.8-116.5 133.3 -2.8 2.2 5.5 26 26 A T E +G 49 0C 54 23,-2.1 23,-1.2 -2,-0.5 2,-0.3 -0.787 27.2 136.5-129.1 91.8 0.7 1.9 7.0 27 27 A G - 0 0 14 3,-1.4 3,-0.3 -2,-0.5 21,-0.1 -0.842 69.4 -92.2-129.4 168.2 3.1 4.6 5.8 28 28 A S S S+ 0 0 133 -2,-0.3 2,-0.7 1,-0.3 -1,-0.1 0.934 123.9 30.4 -45.6 -51.0 5.8 6.7 7.6 29 29 A E S S+ 0 0 138 18,-0.1 -1,-0.3 -3,-0.0 2,-0.1 -0.849 118.0 37.5-114.3 99.5 3.1 9.4 8.2 30 30 A G - 0 0 31 -2,-0.7 -3,-1.4 -3,-0.3 15,-0.0 -0.339 42.0-175.3 136.0 140.9 -0.3 7.9 8.6 31 31 A E + 0 0 159 -5,-0.2 2,-0.3 -2,-0.1 -5,-0.1 0.117 53.7 96.1-152.1 26.7 -1.8 4.8 10.2 32 32 A L - 0 0 97 1,-0.1 -8,-0.2 -8,-0.1 0, 0.0 -0.911 46.4-164.9-121.8 151.0 -5.5 4.7 9.4 33 33 A G - 0 0 3 -10,-0.4 2,-0.3 -2,-0.3 -9,-0.2 0.485 42.2 -73.1 -99.5-114.9 -7.4 2.9 6.6 34 34 A I + 0 0 15 42,-0.0 -11,-0.9 2,-0.0 -1,-0.1 -0.997 44.0 172.6-149.6 152.6 -11.0 3.8 5.7 35 35 A Y > - 0 0 68 -2,-0.3 2,-2.2 -13,-0.2 3,-1.0 -0.938 51.4 -74.1-151.6 171.8 -14.4 3.3 7.2 36 36 A P T 3 S+ 0 0 58 0, 0.0 -33,-0.1 0, 0.0 -14,-0.0 -0.472 125.0 28.1 -73.2 78.2 -18.0 4.4 6.7 37 37 A G T 3 + 0 0 65 -2,-2.2 -33,-0.0 2,-0.1 -3,-0.0 0.512 66.4 144.7 138.3 36.1 -17.6 8.0 7.9 38 38 A H < - 0 0 40 -3,-1.0 3,-0.3 1,-0.2 33,-0.1 0.072 66.2-110.3 -87.1 29.0 -14.0 9.0 7.2 39 39 A A - 0 0 56 1,-0.2 2,-1.8 2,-0.0 -1,-0.2 0.290 45.1 -65.8 59.0 158.3 -15.1 12.6 6.5 40 40 A P S S+ 0 0 113 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.544 77.4 155.8 -78.8 78.7 -15.0 14.0 2.9 41 41 A L + 0 0 69 -2,-1.8 30,-1.7 -3,-0.3 -3,-0.0 -0.507 24.2 178.3-100.3 173.4 -11.2 14.0 2.4 42 42 A L + 0 0 103 28,-0.2 28,-0.1 -2,-0.2 2,-0.1 -0.097 39.7 106.6-171.2 57.2 -9.2 13.9 -0.8 43 43 A T S S- 0 0 92 1,-0.2 26,-1.5 25,-0.1 2,-0.2 0.015 74.3 -52.4-114.6-136.9 -5.4 14.1 -0.3 44 44 A A B -D 68 0A 49 24,-0.2 24,-0.2 1,-0.1 -1,-0.2 -0.659 29.6-144.3-104.4 164.2 -2.7 11.4 -0.7 45 45 A I - 0 0 32 22,-1.4 23,-0.1 -2,-0.2 19,-0.1 0.301 40.9-131.4-109.1 9.8 -2.7 7.9 1.0 46 46 A K - 0 0 92 21,-0.4 -20,-0.1 -21,-0.1 20,-0.1 0.341 27.7 -81.4 55.5 158.3 1.1 7.8 1.5 47 47 A P S S+ 0 0 41 0, 0.0 18,-0.3 0, 0.0 2,-0.3 -0.069 80.0 83.7 -79.7-175.7 3.2 4.8 0.5 48 48 A G E S- H 0 64C 7 16,-1.4 16,-1.5 75,-0.3 -21,-0.2 -0.793 81.8 -46.7 116.1-161.0 3.7 1.6 2.6 49 49 A M E -GH 26 63C 39 -23,-1.2 -23,-2.1 -2,-0.3 2,-0.3 -0.456 48.2-146.0-102.9 179.6 1.5 -1.5 2.9 50 50 A I E -GH 25 62C 8 12,-1.4 12,-0.7 -25,-0.2 2,-0.3 -0.984 8.5-166.6-150.9 138.9 -2.3 -1.8 3.3 51 51 A R E + H 0 61C 107 -27,-1.0 2,-0.3 -2,-0.3 10,-0.3 -0.817 13.3 177.7-119.7 161.3 -4.7 -4.2 5.1 52 52 A I E - H 0 60C 2 8,-1.1 8,-0.7 -2,-0.3 2,-0.4 -0.987 24.2-146.1-157.2 167.8 -8.5 -4.5 4.7 53 53 A V B -F 22 0B 38 -31,-1.9 -32,-1.9 -2,-0.3 -31,-1.3 -0.896 22.3-141.7-142.6 107.1 -11.6 -6.4 5.8 54 54 A K - 0 0 76 -2,-0.4 -34,-0.2 -34,-0.3 -35,-0.1 -0.359 22.1-119.1 -68.7 149.9 -14.4 -6.9 3.3 55 55 A Q S S+ 0 0 64 1,-0.2 -1,-0.1 -51,-0.2 -35,-0.1 0.960 114.9 14.5 -54.3 -52.6 -18.0 -6.7 4.7 56 56 A H S S+ 0 0 168 -37,-0.0 -1,-0.2 -3,-0.0 2,-0.2 0.311 123.3 78.1-105.4 8.7 -18.7 -10.3 3.6 57 57 A G S S- 0 0 34 1,-0.2 3,-0.1 -38,-0.0 -37,-0.0 -0.543 79.8-121.8-108.4 178.0 -15.1 -11.3 3.1 58 58 A H - 0 0 166 -2,-0.2 2,-0.2 1,-0.1 -1,-0.2 0.932 62.0 -69.1 -84.8 -77.1 -12.3 -12.2 5.5 59 59 A E - 0 0 89 -6,-0.2 2,-0.3 2,-0.0 -6,-0.3 -0.837 42.8-171.0-179.6 140.0 -9.4 -9.7 5.0 60 60 A E E -H 52 0C 53 -8,-0.7 -8,-1.1 -2,-0.2 2,-0.4 -0.959 12.2-145.6-138.2 156.8 -6.8 -8.8 2.4 61 61 A F E +H 51 0C 38 -2,-0.3 25,-1.3 -10,-0.3 -10,-0.3 -0.974 17.0 178.1-128.7 125.9 -3.7 -6.5 2.3 62 62 A I E -H 50 0C 4 -12,-0.7 -12,-1.4 -2,-0.4 2,-0.2 0.041 18.1-134.6-100.5-146.8 -2.5 -4.6 -0.8 63 63 A Y E +H 49 0C 12 -14,-0.3 21,-1.0 21,-0.2 2,-0.2 -0.820 23.6 165.6-175.5 132.4 0.4 -2.2 -1.2 64 64 A L E -HI 48 83C 16 -16,-1.5 -16,-1.4 -2,-0.2 19,-0.2 -0.743 20.0-160.1-139.1-171.8 1.0 1.2 -2.8 65 65 A S S S+ 0 0 20 17,-0.6 2,-0.4 -18,-0.3 -1,-0.1 0.440 71.0 3.1-139.8 -64.8 3.5 4.1 -2.7 66 66 A G S S+ 0 0 45 16,-0.2 15,-1.2 -20,-0.1 16,-0.4 -0.995 74.2 116.8-135.8 136.5 2.2 7.5 -4.0 67 67 A G E - E 0 80A 21 -2,-0.4 -22,-1.4 13,-0.2 -21,-0.4 -0.956 48.7-109.0 178.3 165.6 -1.3 8.4 -5.1 68 68 A I E -DE 44 79A 91 11,-1.1 11,-1.0 -2,-0.3 2,-0.3 -0.393 28.3-149.1-101.6-176.2 -4.3 10.7 -4.3 69 69 A L E - E 0 78A 17 -26,-1.5 9,-0.2 9,-0.2 2,-0.2 -0.950 13.0-168.2-148.6 169.4 -7.7 9.8 -2.9 70 70 A E E - E 0 77A 94 7,-1.5 7,-1.7 -2,-0.3 2,-0.3 -0.772 10.3-160.2-163.7 111.7 -11.4 10.9 -2.9 71 71 A V E - E 0 76A 23 -30,-1.7 5,-0.3 5,-0.3 -65,-0.1 -0.761 9.4-164.8 -99.5 144.6 -14.1 9.6 -0.6 72 72 A Q - 0 0 92 3,-1.6 2,-1.7 -2,-0.3 3,-0.1 -0.629 40.2 -78.7-117.5 178.3 -17.9 9.9 -1.4 73 73 A P S S+ 0 0 126 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.557 121.5 2.0 -79.1 81.6 -21.1 9.5 0.6 74 74 A G S S+ 0 0 53 -2,-1.7 -69,-2.3 -69,-0.1 2,-0.3 0.116 133.9 38.4 128.2 -21.7 -21.3 5.7 0.8 75 75 A N B -b 5 0A 47 -71,-0.2 -3,-1.6 -3,-0.1 -69,-0.3 -0.946 64.9-147.3-159.4 135.7 -18.2 4.6 -1.0 76 76 A V E - E 0 71A 7 -71,-1.6 -69,-0.4 -2,-0.3 2,-0.3 -0.552 15.5-176.1 -99.2 168.6 -14.6 5.9 -1.2 77 77 A T E + E 0 70A 37 -7,-1.7 -7,-1.5 -71,-0.2 2,-0.3 -0.932 4.0 176.6-164.1 137.7 -12.2 5.7 -4.2 78 78 A V E -cE 8 69A 21 -71,-1.8 -69,-1.4 -2,-0.3 2,-0.3 -0.932 15.4-143.3-140.8 165.3 -8.6 6.6 -4.9 79 79 A L E +cE 9 68A 95 -11,-1.0 -11,-1.1 -2,-0.3 2,-0.3 -0.963 20.2 168.6-131.6 149.5 -6.1 6.4 -7.8 80 80 A A E - E 0 67A 10 -71,-1.2 -13,-0.2 -2,-0.3 3,-0.1 -0.905 35.2-127.6-148.3 176.7 -2.3 5.7 -7.8 81 81 A D S S+ 0 0 141 -15,-1.2 2,-0.6 1,-0.3 -1,-0.1 0.882 95.5 32.5 -96.9 -56.6 0.5 4.8 -10.2 82 82 A T + 0 0 72 -16,-0.4 -17,-0.6 2,-0.0 2,-0.4 -0.884 65.1 170.4-105.1 123.1 2.1 1.7 -8.7 83 83 A A B +I 64 0C 18 -2,-0.6 2,-0.3 -73,-0.2 -19,-0.2 -0.788 4.9 171.4-134.0 93.9 -0.2 -0.7 -6.9 84 84 A I - 0 0 54 -21,-1.0 2,-0.3 -2,-0.4 -21,-0.2 -0.743 16.2-151.8-101.6 150.7 1.3 -4.1 -6.0 85 85 A R > - 0 0 107 -2,-0.3 3,-0.8 -23,-0.2 2,-0.6 -0.862 44.6 -71.6-119.7 155.9 -0.5 -6.6 -3.7 86 86 A G T 3 S+ 0 0 2 -25,-1.3 -25,-0.1 -2,-0.3 42,-0.1 -0.149 123.4 40.3 -44.5 93.5 0.9 -9.3 -1.4 87 87 A Q T 3 + 0 0 74 -2,-0.6 -1,-0.2 40,-0.2 -3,-0.0 -0.360 56.5 177.4 162.3 -72.9 2.2 -11.6 -4.2 88 88 A D < - 0 0 37 -3,-0.8 2,-0.5 1,-0.1 -1,-0.1 0.906 64.2 -97.8 40.7 50.6 3.7 -9.8 -7.2 89 89 A L S S+ 0 0 164 2,-0.0 -1,-0.1 0, 0.0 0, 0.0 -0.132 112.4 63.7 43.2 -93.7 4.5 -13.3 -8.7 90 90 A D + 0 0 70 -2,-0.5 -3,-0.1 1,-0.1 0, 0.0 -0.051 59.6 169.3 -49.5 159.6 8.1 -13.4 -7.5 91 91 A E S > S+ 0 0 106 -5,-0.0 3,-0.7 41,-0.0 4,-0.4 0.466 71.9 33.6-141.3 -56.7 8.5 -13.4 -3.7 92 92 A A T 3> S+ 0 0 83 1,-0.2 4,-0.6 2,-0.2 3,-0.4 0.668 107.9 70.4 -82.7 -14.3 12.0 -14.2 -2.5 93 93 A R T 34 S+ 0 0 177 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.647 93.0 58.4 -76.6 -10.6 13.5 -12.4 -5.6 94 94 A A T X> S+ 0 0 30 -3,-0.7 3,-1.1 1,-0.2 4,-0.8 0.724 91.1 68.5 -89.0 -21.7 12.3 -9.1 -4.0 95 95 A M T 34 S+ 0 0 62 -3,-0.4 4,-0.4 -4,-0.4 3,-0.2 0.825 92.7 60.0 -66.4 -27.7 14.3 -9.6 -0.9 96 96 A E T 3X S+ 0 0 82 -4,-0.6 4,-2.1 1,-0.2 3,-0.3 0.699 92.3 69.9 -73.7 -15.2 17.5 -9.2 -2.9 97 97 A A H <> S+ 0 0 31 -3,-1.1 4,-1.6 1,-0.2 5,-0.2 0.946 92.3 54.3 -68.0 -45.7 16.3 -5.7 -3.8 98 98 A K H < S+ 0 0 100 -4,-0.8 -1,-0.2 -3,-0.2 4,-0.2 0.739 111.7 48.9 -61.2 -17.0 16.8 -4.4 -0.3 99 99 A R H >> S+ 0 0 156 -4,-0.4 4,-0.8 -3,-0.3 3,-0.8 0.864 110.1 46.5 -89.9 -40.2 20.4 -5.6 -0.7 100 100 A K H 3< S+ 0 0 129 -4,-2.1 4,-0.2 1,-0.2 -2,-0.2 0.666 107.6 60.9 -75.7 -12.2 21.1 -4.1 -4.1 101 101 A A T 3X S+ 0 0 27 -4,-1.6 4,-1.4 -5,-0.2 3,-0.4 0.665 91.3 68.2 -86.9 -15.4 19.6 -0.8 -2.8 102 102 A E H <> S+ 0 0 102 -3,-0.8 4,-1.8 1,-0.2 3,-0.4 0.950 87.3 63.1 -68.9 -46.7 22.3 -0.6 -0.1 103 103 A E H < S+ 0 0 123 -4,-0.8 4,-0.5 1,-0.3 -1,-0.2 0.797 107.4 47.9 -49.5 -23.3 25.1 0.0 -2.6 104 104 A H H 4 S+ 0 0 124 -3,-0.4 3,-0.3 -4,-0.2 -1,-0.3 0.855 110.2 48.1 -86.7 -36.9 23.1 3.2 -3.3 105 105 A I H < S+ 0 0 51 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.588 112.4 52.5 -79.0 -6.6 22.6 4.2 0.4 106 106 A S S < S+ 0 0 71 -4,-1.8 2,-0.5 -5,-0.1 -1,-0.2 0.626 93.3 82.7-101.1 -16.5 26.4 3.6 0.9 107 107 A S - 0 0 66 -4,-0.5 2,-0.5 -5,-0.3 7,-0.4 -0.750 67.7-152.9 -91.4 130.7 27.6 5.8 -1.9 108 108 A S + 0 0 89 -2,-0.5 3,-0.1 1,-0.1 -3,-0.1 -0.864 32.7 148.3-104.1 131.5 27.8 9.5 -1.2 109 109 A H - 0 0 161 -2,-0.5 2,-0.3 1,-0.4 -1,-0.1 0.137 68.9 -24.0-146.6 21.8 27.4 12.0 -4.0 110 110 A G S S- 0 0 44 1,-0.1 -1,-0.4 2,-0.0 5,-0.2 -0.943 78.6 -73.8 156.0-176.6 25.8 15.1 -2.5 111 111 A D S S+ 0 0 139 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.0 0.818 132.9 25.4 -81.1 -29.4 23.6 16.2 0.5 112 112 A V S > S+ 0 0 92 3,-0.1 4,-0.7 -3,-0.1 -1,-0.2 0.092 97.7 104.9-119.4 22.9 20.4 14.7 -1.1 113 113 A D H >> S- 0 0 64 -3,-0.2 3,-1.2 2,-0.2 4,-0.7 0.881 103.2 -1.9 -67.8 -99.1 22.1 12.0 -3.2 114 114 A Y H 3> S+ 0 0 91 -7,-0.4 4,-1.0 1,-0.3 3,-0.4 0.768 127.2 75.7 -65.3 -18.9 21.6 8.6 -1.6 115 115 A A H >4 S+ 0 0 45 1,-0.3 3,-0.6 2,-0.2 4,-0.3 0.907 95.8 46.0 -58.9 -39.1 19.9 10.6 1.2 116 116 A Q H X< S+ 0 0 135 -3,-1.2 3,-0.6 -4,-0.7 4,-0.5 0.711 104.9 63.0 -77.1 -17.5 16.9 10.9 -1.2 117 117 A A H 3X S+ 0 0 32 -4,-0.7 4,-0.9 -3,-0.4 3,-0.5 0.712 84.1 76.5 -79.3 -17.8 17.1 7.2 -2.0 118 118 A S H S+ 0 0 63 -3,-0.6 4,-0.6 -4,-0.3 -1,-0.2 0.817 107.0 49.7 -75.9 -27.9 12.7 7.1 1.0 120 120 A E H 4 S+ 0 0 122 -3,-0.5 4,-0.3 -4,-0.5 -1,-0.2 0.588 110.9 52.8 -85.5 -8.2 12.7 4.7 -1.9 121 121 A L H >X S+ 0 0 34 -4,-0.9 4,-1.7 -3,-0.3 3,-0.9 0.922 108.7 42.1 -90.4 -57.9 14.2 2.0 0.2 122 122 A A H 3< S+ 0 0 71 -4,-1.7 4,-0.1 1,-0.3 -2,-0.1 0.776 117.2 52.0 -61.8 -22.3 12.0 1.9 3.3 123 123 A K T 3< S+ 0 0 56 -4,-0.6 4,-0.3 -5,-0.2 -75,-0.3 0.712 104.8 55.2 -87.1 -19.5 9.0 2.1 0.9 124 124 A A T X4 S+ 0 0 45 -3,-0.9 3,-0.9 -4,-0.3 4,-0.4 0.861 103.6 53.0 -80.8 -34.6 10.2 -0.8 -1.2 125 125 A I T 3X S+ 0 0 50 -4,-1.7 4,-1.0 1,-0.2 3,-0.5 0.591 88.9 84.0 -75.9 -6.1 10.4 -3.2 1.7 126 126 A A H 3> S+ 0 0 15 1,-0.2 4,-1.0 -5,-0.2 3,-0.3 0.873 90.7 47.5 -64.8 -33.5 6.8 -2.3 2.5 127 127 A Q H <> S+ 0 0 11 -3,-0.9 4,-1.3 -4,-0.3 -1,-0.2 0.670 103.0 64.5 -81.4 -14.3 5.5 -4.8 -0.1 128 128 A L H > S+ 0 0 19 -3,-0.5 4,-1.2 -4,-0.4 -1,-0.2 0.783 98.2 54.5 -78.7 -25.0 7.9 -7.5 1.4 129 129 A R H X S+ 0 0 182 -4,-1.0 4,-0.9 -3,-0.3 -2,-0.2 0.936 111.2 42.1 -74.2 -45.7 6.0 -7.5 4.7 130 130 A V H < S+ 0 0 0 -4,-1.0 3,-0.2 1,-0.2 -2,-0.2 0.853 116.8 49.0 -70.4 -32.1 2.6 -8.2 3.2 131 131 A I H >< S+ 0 0 6 -4,-1.3 3,-0.8 1,-0.2 -1,-0.2 0.784 104.4 59.5 -78.2 -25.4 4.0 -10.8 0.8 132 132 A E H >< S+ 0 0 94 -4,-1.2 3,-0.6 1,-0.2 -1,-0.2 0.765 102.3 53.2 -74.7 -22.1 6.0 -12.5 3.6 133 133 A L G >< S+ 0 0 76 -4,-0.9 3,-0.5 1,-0.2 -1,-0.2 0.473 91.1 76.5 -90.5 0.4 2.7 -13.3 5.5 134 134 A T G X> + 0 0 18 -3,-0.8 3,-1.0 1,-0.2 4,-0.6 0.415 69.7 87.9 -89.1 4.6 1.2 -14.9 2.4 135 135 A K G <4 S+ 0 0 137 -3,-0.6 3,-0.3 1,-0.2 -1,-0.2 0.844 88.5 48.5 -71.5 -30.1 3.3 -18.0 3.0 136 136 A K G <4 S+ 0 0 169 -3,-0.5 -1,-0.2 1,-0.2 -2,-0.1 0.309 91.1 86.7 -91.3 11.6 0.6 -19.5 5.3 137 137 A A T <4 0 0 69 -3,-1.0 -1,-0.2 1,-0.1 -2,-0.2 0.942 360.0 360.0 -76.2 -47.3 -2.1 -18.6 2.7 138 138 A M < 0 0 217 -4,-0.6 -2,-0.1 -3,-0.3 -3,-0.1 0.842 360.0 360.0 -98.7 360.0 -1.8 -21.9 0.7