==== 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 30-APR-07 2PPQ . COMPND 2 MOLECULE: HOMOSERINE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS STR.; . AUTHOR R.ZHANG,X.XU,H.ZHENG,A.SAVCHENKO,A.EDWARDS,A.JOACHIMIAK,MIDW . 310 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15414.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 14.2 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 18 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 0 0 0 0 1 0 0 2 2 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 0 1 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 5 A T 0 0 69 0, 0.0 2,-0.3 0, 0.0 45,-0.1 0.000 360.0 360.0 360.0 139.4 21.9 32.3 39.5 2 6 A D - 0 0 119 85,-0.1 2,-0.3 23,-0.0 29,-0.0 -0.799 360.0-147.4-120.8 162.8 23.0 29.6 42.0 3 7 A I - 0 0 2 -2,-0.3 2,-0.2 83,-0.0 83,-0.0 -0.975 16.2-124.0-129.1 147.2 21.3 26.6 43.6 4 8 A T > - 0 0 62 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.535 24.9-115.2 -87.1 155.7 21.8 25.0 47.1 5 9 A E H > S+ 0 0 104 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.870 113.6 46.6 -57.3 -42.3 22.6 21.3 47.6 6 10 A D H > S+ 0 0 109 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 111.0 51.4 -71.9 -42.1 19.4 20.5 49.4 7 11 A E H > S+ 0 0 74 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.911 112.8 46.0 -57.5 -48.4 17.1 22.3 46.9 8 12 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.922 111.6 51.2 -65.9 -42.4 18.8 20.4 44.0 9 13 A R H X S+ 0 0 126 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.930 112.6 46.5 -61.1 -42.6 18.6 17.0 45.8 10 14 A N H >< S+ 0 0 99 -4,-2.5 3,-1.0 1,-0.2 4,-0.4 0.922 109.7 54.8 -62.2 -46.0 14.8 17.6 46.5 11 15 A F H >< S+ 0 0 1 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.890 104.3 54.6 -51.7 -42.9 14.4 18.7 42.8 12 16 A L H >< S+ 0 0 13 -4,-2.2 3,-1.3 1,-0.3 5,-0.4 0.671 92.4 69.6 -73.6 -16.4 15.9 15.4 41.6 13 17 A T T << S+ 0 0 79 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.605 90.2 65.0 -71.6 -13.8 13.4 13.3 43.6 14 18 A Q T < S+ 0 0 42 -3,-1.5 64,-3.1 -4,-0.4 65,-0.3 0.458 106.9 48.9 -80.5 -5.7 10.8 14.6 41.1 15 19 A Y B < S-A 77 0A 7 -3,-1.3 2,-0.8 62,-0.2 62,-0.1 -0.851 85.3-118.3-130.8 163.0 12.7 12.7 38.4 16 20 A D + 0 0 142 60,-0.5 2,-0.2 -2,-0.3 -3,-0.1 -0.718 67.5 116.4-107.8 84.0 14.1 9.2 37.9 17 21 A V - 0 0 24 -2,-0.8 3,-0.1 -5,-0.4 -2,-0.1 -0.699 69.2 -70.7-133.6 178.7 17.8 9.8 37.6 18 22 A G - 0 0 13 22,-0.3 2,-0.4 -2,-0.2 -1,-0.3 0.040 60.9 -84.6 -60.0 178.9 20.9 8.8 39.6 19 23 A S - 0 0 76 1,-0.1 19,-1.1 -6,-0.0 20,-0.2 -0.767 56.4 -94.9 -81.6 144.1 21.8 10.4 42.9 20 24 A L E +B 37 0B 33 -2,-0.4 17,-0.3 17,-0.2 3,-0.1 -0.338 50.0 162.3 -59.7 126.2 23.6 13.7 42.6 21 25 A T E - 0 0 91 15,-2.9 2,-0.3 1,-0.4 16,-0.2 0.634 66.4 -0.5-113.4 -23.1 27.4 13.4 42.8 22 26 A S E -B 36 0B 30 14,-1.6 14,-2.4 2,-0.0 -1,-0.4 -0.985 52.3-169.6-163.5 146.0 28.5 16.8 41.3 23 27 A Y E +B 35 0B 60 -2,-0.3 2,-0.4 12,-0.2 12,-0.2 -0.948 7.8 179.9-148.9 140.3 27.1 20.0 39.9 24 28 A K E -B 34 0B 129 10,-1.7 10,-2.5 -2,-0.3 2,-0.2 -0.997 30.7-121.5-137.1 128.9 28.9 22.9 38.1 25 29 A G E -B 33 0B 58 -2,-0.4 2,-0.3 8,-0.2 8,-0.2 -0.538 39.4-157.2 -62.8 134.4 27.6 26.1 36.6 26 30 A I E B 32 0B 77 6,-2.4 6,-0.5 -2,-0.2 -1,-0.0 -0.876 360.0 360.0-120.8 155.5 28.6 26.1 32.9 27 31 A A 0 0 152 -2,-0.3 -1,-0.1 4,-0.1 6,-0.0 0.746 360.0 360.0 -64.7 360.0 29.1 28.8 30.3 28 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 29 35 A E 0 0 179 0, 0.0 19,-2.0 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-172.1 17.7 33.3 28.4 30 36 A N E - C 0 47B 49 17,-0.2 2,-0.4 18,-0.1 17,-0.2 -0.951 360.0-132.4-153.8 153.5 19.1 30.7 30.9 31 37 A S E - C 0 46B 21 15,-2.2 15,-3.1 -2,-0.3 2,-0.4 -0.959 34.7-162.0-110.8 132.8 21.3 29.4 33.7 32 38 A N E -BC 26 45B 45 -6,-0.5 -6,-2.4 -2,-0.4 2,-0.4 -0.923 10.9-170.8-125.9 140.5 22.8 26.0 33.0 33 39 A F E -BC 25 44B 8 11,-2.5 11,-2.6 -2,-0.4 2,-0.6 -0.987 17.7-141.4-130.1 137.6 24.3 23.3 35.3 34 40 A L E -BC 24 43B 41 -10,-2.5 -10,-1.7 -2,-0.4 2,-0.4 -0.917 26.2-163.6 -97.5 116.8 26.1 20.1 34.4 35 41 A L E -BC 23 42B 0 7,-2.8 7,-2.1 -2,-0.6 2,-0.4 -0.822 11.1-158.0-100.5 138.9 25.2 17.4 36.8 36 42 A H E +B 22 0B 89 -14,-2.4 -15,-2.9 -2,-0.4 -14,-1.6 -0.932 20.9 174.2-106.9 144.7 27.0 14.2 37.5 37 43 A T E -B 20 0B 16 -2,-0.4 -17,-0.2 -17,-0.3 -14,-0.0 -0.779 50.2 -96.4-135.7 177.7 25.0 11.3 39.0 38 44 A T S S+ 0 0 101 -19,-1.1 -18,-0.1 -2,-0.2 -2,-0.0 0.494 121.6 30.5 -76.4 -4.1 25.4 7.7 39.9 39 45 A K S S- 0 0 136 1,-0.3 -2,-0.1 -20,-0.2 -22,-0.1 0.371 125.6 -19.1-114.7-107.3 23.6 7.0 36.6 40 46 A D - 0 0 95 -4,-0.1 -1,-0.3 1,-0.1 -22,-0.3 -0.726 67.0-103.3-104.8 157.9 24.1 9.5 33.6 41 47 A P - 0 0 46 0, 0.0 55,-0.7 0, 0.0 2,-0.3 -0.329 42.9-165.7 -71.1 162.2 25.1 13.1 33.5 42 48 A L E -CD 35 95B 6 -7,-2.1 -7,-2.8 53,-0.2 2,-0.5 -0.947 20.5-125.8-144.9 162.5 22.4 15.7 33.1 43 49 A I E -CD 34 94B 29 51,-2.9 51,-2.9 -2,-0.3 2,-0.5 -0.953 18.0-160.1-113.2 131.5 21.8 19.2 32.2 44 50 A L E -CD 33 93B 0 -11,-2.6 -11,-2.5 -2,-0.5 2,-0.5 -0.973 9.9-166.4-107.6 128.1 19.7 21.5 34.6 45 51 A T E -CD 32 92B 3 47,-2.4 47,-1.8 -2,-0.5 2,-0.6 -0.959 10.6-162.5-118.8 123.1 18.3 24.6 33.0 46 52 A L E -CD 31 91B 0 -15,-3.1 -15,-2.2 -2,-0.5 2,-0.8 -0.935 21.9-136.8 -98.7 117.9 16.8 27.5 35.0 47 53 A Y E -C 30 0B 7 43,-2.8 2,-2.5 -2,-0.6 -17,-0.2 -0.673 7.4-157.7 -81.4 108.6 14.7 29.6 32.7 48 54 A E 0 0 61 -19,-2.0 -1,-0.1 -2,-0.8 -18,-0.1 -0.345 360.0 360.0 -82.4 60.8 15.6 33.3 33.5 49 55 A K 0 0 198 -2,-2.5 -1,-0.2 41,-0.1 -19,-0.0 0.673 360.0 360.0 -75.6 360.0 12.3 34.0 32.0 50 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 51 59 A K 0 0 225 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -2.5 3.7 31.3 29.0 52 60 A N > + 0 0 114 2,-0.1 4,-1.2 1,-0.1 5,-0.1 0.205 360.0 89.9-104.5 11.2 3.1 28.6 26.3 53 61 A D H > S+ 0 0 66 2,-0.2 4,-2.9 1,-0.2 3,-0.2 0.961 82.0 52.2 -78.8 -48.1 6.6 28.8 24.9 54 62 A L H >>S+ 0 0 34 1,-0.2 4,-3.0 2,-0.2 5,-0.6 0.891 107.5 52.1 -56.1 -43.6 8.2 26.2 27.2 55 63 A P H >5S+ 0 0 46 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.926 113.0 47.2 -57.8 -38.6 5.6 23.5 26.4 56 64 A F H X5S+ 0 0 1 -4,-1.2 4,-2.5 -3,-0.2 -2,-0.2 0.973 117.6 40.4 -61.4 -55.2 6.3 24.2 22.7 57 65 A F H X5S+ 0 0 10 -4,-2.9 4,-2.2 2,-0.2 -3,-0.2 0.911 121.9 39.5 -63.8 -48.4 10.1 24.1 23.1 58 66 A L H X5S+ 0 0 0 -4,-3.0 4,-2.1 -5,-0.2 -1,-0.2 0.886 117.0 50.9 -71.5 -38.7 10.3 21.1 25.5 59 67 A G H X<>S+ 0 0 0 -4,-2.6 5,-1.8 2,-0.2 3,-0.9 0.938 113.7 47.8 -65.9 -48.3 12.2 15.1 17.6 65 73 A A H ><5S+ 0 0 27 -4,-2.5 3,-2.8 1,-0.3 -2,-0.2 0.961 107.4 56.8 -56.1 -50.7 14.1 12.8 20.0 66 74 A A H 3<5S+ 0 0 91 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.729 107.2 51.2 -50.6 -25.6 11.1 10.3 19.8 67 75 A K T <<5S- 0 0 118 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.193 127.7 -96.0-100.1 14.8 11.7 10.3 16.0 68 76 A G T < 5S+ 0 0 67 -3,-2.8 -3,-0.2 1,-0.3 -2,-0.1 0.194 74.7 142.9 95.9 -16.9 15.5 9.6 16.2 69 77 A L < - 0 0 23 -5,-1.8 2,-1.4 -6,-0.1 -1,-0.3 -0.297 56.7-121.2 -57.1 139.0 16.9 13.2 16.0 70 78 A S + 0 0 58 132,-0.0 131,-2.2 27,-0.0 -1,-0.1 -0.694 66.3 121.6 -82.9 90.1 19.9 13.6 18.2 71 79 A C - 0 0 7 -2,-1.4 131,-0.2 129,-0.2 24,-0.1 -0.968 70.0 -75.7-144.1 162.4 18.8 16.4 20.4 72 80 A P - 0 0 14 0, 0.0 -7,-0.2 0, 0.0 24,-0.1 -0.326 42.0-143.0 -66.7 140.5 18.4 16.7 24.2 73 81 A L - 0 0 73 -8,-0.1 22,-2.5 -9,-0.1 2,-0.3 -0.895 13.4-127.0-102.2 122.5 15.4 15.0 25.8 74 82 A P B -E 94 0B 8 0, 0.0 20,-0.3 0, 0.0 18,-0.0 -0.547 32.7-122.3 -62.4 124.7 13.5 16.7 28.7 75 83 A L - 0 0 34 18,-2.3 18,-0.3 -2,-0.3 2,-0.2 -0.480 29.1-108.5 -73.3 140.5 13.4 14.0 31.5 76 84 A P - 0 0 102 0, 0.0 -60,-0.5 0, 0.0 2,-0.3 -0.473 27.2-129.9 -75.0 140.9 9.8 13.1 32.6 77 85 A R B > -A 15 0A 25 4,-0.6 3,-1.7 -2,-0.2 -62,-0.2 -0.649 11.2-130.0 -87.3 143.9 8.5 14.3 36.1 78 86 A K T 3 S+ 0 0 160 -64,-3.1 -1,-0.1 -2,-0.3 -63,-0.1 0.916 110.8 53.2 -54.4 -42.7 6.9 11.9 38.5 79 87 A D T 3 S- 0 0 91 -65,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.339 112.1-120.5 -80.8 6.7 4.0 14.3 38.9 80 88 A G < + 0 0 68 -3,-1.7 -1,-0.1 1,-0.2 -2,-0.1 0.345 69.6 132.2 74.0 -8.1 3.4 14.5 35.2 81 89 A E - 0 0 130 1,-0.1 -4,-0.6 2,-0.1 -1,-0.2 -0.294 60.1-132.2 -69.7 163.1 4.0 18.2 35.0 82 90 A L S S+ 0 0 57 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.830 82.5 29.3 -83.8 -35.6 6.4 19.6 32.3 83 91 A L - 0 0 48 9,-0.1 2,-0.2 -6,-0.0 9,-0.2 -0.855 58.0-158.4-127.7 156.3 8.4 21.8 34.6 84 92 A G E -F 91 0B 11 7,-2.8 7,-2.4 -2,-0.3 2,-0.4 -0.481 24.9-119.6-108.4-169.6 9.6 22.1 38.1 85 93 A E E -F 90 0B 136 5,-0.3 2,-0.3 -2,-0.2 -39,-0.0 -0.996 24.4-179.5-135.7 140.7 10.7 25.2 39.9 86 94 A L E > S-F 89 0B 9 3,-2.4 3,-1.9 -2,-0.4 -78,-0.0 -0.980 70.3 -17.8-143.1 132.2 14.1 26.0 41.5 87 95 A S T 3 S- 0 0 37 -2,-0.3 2,-0.2 1,-0.3 -85,-0.1 0.864 128.6 -48.2 33.9 56.3 15.1 29.2 43.4 88 96 A G T 3 S+ 0 0 58 1,-0.2 -1,-0.3 0, 0.0 0, 0.0 -0.098 119.0 98.6 91.2 -34.6 12.2 31.2 41.9 89 97 A R E < S- F 0 86B 91 -3,-1.9 -3,-2.4 -2,-0.2 -1,-0.2 -0.487 81.3-101.0 -91.3 152.4 12.7 30.1 38.2 90 98 A P E - F 0 85B 21 0, 0.0 -43,-2.8 0, 0.0 2,-0.3 -0.516 49.3-164.2 -60.6 141.1 11.0 27.5 36.0 91 99 A A E -DF 46 84B 0 -7,-2.4 -7,-2.8 -45,-0.2 2,-0.3 -0.983 17.4-176.6-140.6 143.7 13.4 24.5 35.8 92 100 A A E -D 45 0B 3 -47,-1.8 -47,-2.4 -2,-0.3 2,-0.4 -0.997 21.3-137.1-137.8 140.6 13.9 21.4 33.7 93 101 A L E -D 44 0B 1 -2,-0.3 -18,-2.3 -18,-0.3 2,-0.3 -0.859 29.6-172.5 -91.0 137.1 16.2 18.4 33.7 94 102 A I E -DE 43 74B 8 -51,-2.9 -51,-2.9 -2,-0.4 -2,-0.0 -0.954 27.2-100.7-134.3 144.0 17.5 17.6 30.2 95 103 A S E -D 42 0B 31 -22,-2.5 2,-0.5 -2,-0.3 -53,-0.2 -0.197 39.4-114.1 -63.1 157.1 19.5 14.6 28.9 96 104 A F - 0 0 79 -55,-0.7 2,-0.4 -24,-0.1 -1,-0.1 -0.850 25.1-156.3 -99.5 124.6 23.2 15.2 28.3 97 105 A L - 0 0 27 -2,-0.5 2,-0.1 2,-0.1 103,-0.1 -0.856 14.5-130.7 -99.2 137.7 24.5 15.0 24.7 98 106 A E + 0 0 135 -2,-0.4 2,-0.2 101,-0.2 94,-0.1 -0.382 61.6 60.8 -76.1 161.8 28.2 14.2 24.0 99 107 A G - 0 0 23 -2,-0.1 2,-0.3 93,-0.1 95,-0.2 -0.454 67.3-105.9 110.6 177.4 30.3 16.3 21.7 100 108 A X B -G 193 0C 105 93,-2.3 93,-2.2 -2,-0.2 2,-0.2 -0.976 27.7-106.8-143.5 151.2 31.5 19.8 21.4 101 109 A W - 0 0 80 -2,-0.3 2,-0.5 91,-0.2 91,-0.2 -0.585 42.2-109.3 -82.7 144.9 30.7 22.8 19.3 102 110 A L - 0 0 28 86,-0.5 -1,-0.1 89,-0.4 89,-0.1 -0.627 26.8-175.4 -85.2 120.4 33.2 23.8 16.6 103 111 A R S S+ 0 0 141 -2,-0.5 -1,-0.2 1,-0.2 85,-0.1 0.823 91.8 28.7 -74.0 -33.7 35.3 26.9 17.0 104 112 A K S S- 0 0 155 2,-0.0 -1,-0.2 0, 0.0 2,-0.0 -0.596 82.9-174.3-129.9 68.7 36.9 26.4 13.5 105 113 A P - 0 0 14 0, 0.0 2,-0.2 0, 0.0 83,-0.0 -0.351 9.6-151.1 -68.1 147.2 34.3 24.5 11.3 106 114 A E >> - 0 0 103 -2,-0.0 4,-1.5 1,-0.0 3,-1.2 -0.649 34.1 -95.3-113.0 167.3 35.4 23.5 7.9 107 115 A A H 3> S+ 0 0 22 1,-0.3 4,-1.5 -2,-0.2 3,-0.1 0.868 122.8 60.8 -56.9 -34.8 33.3 23.0 4.8 108 116 A K H 3> S+ 0 0 109 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.839 104.2 50.7 -63.1 -30.9 32.9 19.3 5.5 109 117 A H H <> S+ 0 0 7 -3,-1.2 4,-2.2 1,-0.2 -1,-0.3 0.878 103.0 58.7 -71.1 -38.2 31.3 20.1 8.8 110 118 A C H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.823 101.7 56.0 -59.2 -34.8 28.9 22.5 7.1 111 119 A R H X S+ 0 0 76 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.910 106.0 49.5 -62.3 -44.9 27.6 19.6 5.0 112 120 A E H X S+ 0 0 42 -4,-1.2 4,-2.6 2,-0.2 -2,-0.2 0.914 109.8 52.9 -58.6 -40.9 26.8 17.7 8.2 113 121 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.901 108.9 48.5 -62.0 -45.5 24.9 20.8 9.4 114 122 A G H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.912 111.7 49.2 -60.8 -46.2 22.9 20.9 6.3 115 123 A K H X S+ 0 0 69 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.931 113.7 46.7 -56.3 -49.4 22.0 17.2 6.5 116 124 A A H X S+ 0 0 13 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.835 109.6 52.7 -62.7 -42.1 21.0 17.6 10.2 117 125 A L H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.930 112.1 46.3 -60.4 -47.9 18.9 20.8 9.6 118 126 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.922 111.7 51.3 -59.0 -44.5 16.9 19.0 6.8 119 127 A A H X S+ 0 0 36 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.899 110.5 49.7 -61.0 -42.1 16.5 15.9 9.0 120 128 A X H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.911 109.0 51.3 -60.8 -44.8 15.2 18.2 11.8 121 129 A H H < S+ 0 0 8 -4,-2.4 60,-0.3 1,-0.2 4,-0.3 0.922 114.4 43.8 -59.3 -45.7 12.7 19.8 9.4 122 130 A L H >< S+ 0 0 90 -4,-2.5 3,-1.1 1,-0.2 -2,-0.2 0.880 113.1 51.4 -64.0 -42.6 11.4 16.3 8.3 123 131 A A H 3< S+ 0 0 14 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.758 98.4 66.6 -67.4 -25.9 11.3 15.0 11.8 124 132 A S T >< S+ 0 0 5 -4,-1.6 3,-1.6 57,-0.2 -1,-0.2 0.587 75.0 111.4 -76.8 -10.3 9.3 18.0 13.1 125 133 A E T < S+ 0 0 154 -3,-1.1 3,-0.1 -4,-0.3 55,-0.0 -0.415 74.9 29.9 -62.9 136.0 6.3 16.9 10.9 126 134 A G T 3 S+ 0 0 45 1,-0.3 2,-0.5 -2,-0.1 -1,-0.2 0.277 84.3 122.9 96.5 -10.7 3.4 15.8 13.1 127 135 A F < - 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