==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-JAN-09 3FTB . COMPND 2 MOLECULE: HISTIDINOL-PHOSPHATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM ACETOBUTYLICUM; . AUTHOR R.ZHANG,L.BIGELOW,S.MOY,A.JOACHIMIAK,MIDWEST CENTER FOR . 1335 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53834.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 969 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 102 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 4 0.3 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 . 84 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 192 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 418 31.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 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 3 3 4 4 5 8 6 4 0 2 2 0 3 1 0 0 0 0 1 2 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 6 4 4 4 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 . 1 4 2 5 8 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 . 4 0 4 0 0 4 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 28 A L 0 0 148 0, 0.0 2,-0.7 0, 0.0 293,-0.2 0.000 360.0 360.0 360.0 100.3 18.0 -25.7 55.0 2 29 A L E -a 294 0A 28 291,-2.1 293,-2.4 290,-0.2 2,-0.9 -0.818 360.0-153.8 -85.2 115.3 21.6 -25.2 54.0 3 30 A D E > +a 295 0A 61 -2,-0.7 3,-0.6 291,-0.2 293,-0.1 -0.800 22.3 170.2 -94.8 101.7 21.8 -23.5 50.6 4 31 A Y T 3 S+ 0 0 0 291,-2.4 309,-1.0 -2,-0.9 293,-0.3 0.325 77.0 66.9 -92.4 4.6 25.1 -24.5 49.0 5 32 A S T 3 S+ 0 0 31 291,-0.3 2,-0.5 307,-0.2 -1,-0.2 0.510 89.6 82.6 -91.4 -9.4 23.9 -23.0 45.7 6 33 A S < - 0 0 38 -3,-0.6 2,-0.2 289,-0.2 307,-0.1 -0.826 59.4-169.2 -98.1 127.8 24.0 -19.6 47.5 7 34 A N + 0 0 9 -2,-0.5 2,-0.3 306,-0.1 264,-0.1 -0.359 35.6 135.1-112.4 52.7 27.4 -17.8 47.7 8 35 A I - 0 0 17 -2,-0.2 181,-0.1 356,-0.1 180,-0.1 -0.769 67.8 -89.4 -96.2 147.8 26.6 -15.0 50.2 9 36 A N > - 0 0 6 179,-2.0 3,-0.7 -2,-0.3 306,-0.1 -0.340 30.1-152.9 -57.4 128.3 29.1 -14.2 53.0 10 37 A P T 3 S+ 0 0 37 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.698 84.6 79.2 -78.5 -22.9 28.2 -16.3 56.1 11 38 A L T 3 S- 0 0 54 1,-0.2 -2,-0.1 226,-0.1 229,-0.0 0.290 97.2-137.7 -74.1 12.4 29.7 -13.7 58.5 12 39 A G < - 0 0 30 -3,-0.7 -1,-0.2 352,-0.1 3,-0.1 0.129 41.6 -15.5 67.9-174.7 26.5 -11.8 58.1 13 40 A I S S- 0 0 42 178,-0.1 178,-0.1 1,-0.1 5,-0.1 -0.387 80.3 -95.6 -65.6 133.4 25.6 -8.1 57.7 14 41 A P >> - 0 0 0 0, 0.0 3,-2.2 0, 0.0 4,-0.8 -0.206 25.5-130.8 -51.6 135.3 28.4 -5.6 58.5 15 42 A K H 3> S+ 0 0 135 1,-0.3 4,-1.6 2,-0.2 -2,-0.1 0.723 105.2 68.4 -63.3 -17.2 28.1 -4.3 62.1 16 43 A S H 34 S+ 0 0 16 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.546 90.5 60.2 -81.7 -7.6 28.5 -0.9 60.6 17 44 A F H <4 S+ 0 0 0 -3,-2.2 3,-0.4 2,-0.2 -1,-0.2 0.869 105.3 46.6 -84.3 -41.3 25.1 -1.0 58.8 18 45 A L H >< S+ 0 0 83 -4,-0.8 3,-2.1 1,-0.2 4,-0.3 0.952 108.3 58.2 -57.7 -49.9 23.2 -1.5 62.1 19 46 A N T 3< S+ 0 0 123 -4,-1.6 -1,-0.2 1,-0.3 3,-0.2 0.718 113.4 37.4 -58.6 -24.8 25.2 1.4 63.6 20 47 A N T 3> S+ 0 0 49 -4,-0.5 4,-1.6 -3,-0.4 -1,-0.3 0.064 76.5 114.6-116.3 25.0 24.1 3.8 60.9 21 48 A I H <> S+ 0 0 26 -3,-2.1 4,-2.6 1,-0.2 5,-0.2 0.778 73.8 62.7 -64.6 -26.1 20.5 2.7 60.4 22 49 A D H > S+ 0 0 121 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.945 100.2 51.9 -61.5 -49.5 19.4 6.1 61.8 23 50 A E H > S+ 0 0 45 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.942 111.0 48.6 -49.5 -53.4 21.1 7.8 58.9 24 51 A G H < S+ 0 0 0 -4,-1.6 4,-0.4 1,-0.2 -2,-0.2 0.920 111.6 47.3 -54.5 -52.3 19.2 5.5 56.5 25 52 A I H >< S+ 0 0 34 -4,-2.6 3,-1.2 1,-0.2 4,-0.4 0.881 108.7 55.8 -58.7 -41.3 15.8 6.1 58.1 26 53 A K H >< S+ 0 0 164 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.944 105.8 50.1 -56.5 -51.2 16.2 9.8 58.2 27 54 A N G >< S+ 0 0 41 -4,-1.9 3,-1.2 1,-0.3 502,-0.4 0.506 86.3 89.1 -71.3 -3.8 16.9 10.1 54.5 28 55 A L G < S+ 0 0 0 -3,-1.2 501,-1.5 -4,-0.4 502,-0.5 0.848 83.6 58.1 -54.7 -34.3 13.8 8.0 53.8 29 56 A G G < S+ 0 0 25 -3,-1.5 2,-0.3 -4,-0.4 -1,-0.2 0.561 107.5 44.8 -81.4 -10.3 11.9 11.3 53.8 30 57 A V S < S- 0 0 87 -3,-1.2 499,-0.2 -4,-0.1 192,-0.1 -0.917 86.0 -98.1-134.4 158.6 13.8 12.9 51.0 31 58 A Y - 0 0 64 -2,-0.3 3,-0.1 497,-0.1 498,-0.1 -0.534 45.3-118.7 -68.1 135.3 15.2 12.3 47.5 32 59 A P - 0 0 14 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.144 50.2 -67.8 -63.4 172.2 19.0 11.4 47.6 33 60 A D > - 0 0 80 1,-0.2 3,-0.9 2,-0.1 185,-0.1 -0.473 42.5-136.8 -58.7 127.6 21.4 13.7 45.8 34 61 A V T 3 S+ 0 0 67 1,-0.2 184,-0.2 -2,-0.2 -1,-0.2 0.665 107.3 43.1 -64.1 -13.3 20.6 13.2 42.1 35 62 A N T 3 S- 0 0 122 182,-0.1 -1,-0.2 183,-0.1 5,-0.1 0.494 96.0-143.6-107.3 -9.5 24.4 13.1 41.6 36 63 A Y <> + 0 0 9 -3,-0.9 4,-2.7 1,-0.1 3,-0.4 0.783 36.1 163.1 52.9 36.2 25.3 10.9 44.6 37 64 A R H > S+ 0 0 185 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.855 71.0 49.1 -54.8 -41.9 28.5 12.8 45.3 38 65 A R H > S+ 0 0 135 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.861 112.4 49.0 -70.2 -32.6 28.9 11.4 48.8 39 66 A L H > S+ 0 0 0 -3,-0.4 4,-1.8 2,-0.2 3,-0.5 0.963 110.7 49.4 -66.5 -51.7 28.4 7.9 47.7 40 67 A N H X S+ 0 0 28 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.848 106.9 56.6 -56.4 -37.9 30.9 8.2 44.8 41 68 A K H X S+ 0 0 98 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.867 104.4 52.6 -63.2 -36.8 33.5 9.6 47.2 42 69 A S H X S+ 0 0 9 -4,-1.3 4,-1.8 -3,-0.5 -2,-0.2 0.946 112.0 44.6 -64.6 -48.1 33.2 6.5 49.5 43 70 A I H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 5,-0.3 0.918 111.3 53.7 -59.8 -46.1 33.8 4.2 46.5 44 71 A E H X>S+ 0 0 40 -4,-2.6 5,-2.1 1,-0.2 4,-0.7 0.859 113.2 43.9 -56.1 -37.0 36.7 6.4 45.3 45 72 A N H <5S+ 0 0 65 -4,-1.9 -1,-0.2 3,-0.2 -2,-0.2 0.756 111.8 53.6 -79.0 -28.4 38.2 6.1 48.8 46 73 A Y H <5S+ 0 0 52 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.874 120.8 31.4 -71.6 -39.9 37.4 2.4 48.8 47 74 A L H <5S- 0 0 18 -4,-3.0 -2,-0.2 2,-0.2 -1,-0.2 0.484 102.8-129.5 -96.0 -5.3 39.3 2.0 45.5 48 75 A K T <5 + 0 0 164 -4,-0.7 2,-0.3 -5,-0.3 -3,-0.2 0.957 66.6 124.6 50.2 55.0 41.8 4.8 46.1 49 76 A L < - 0 0 27 -5,-2.1 2,-0.2 -6,-0.1 -1,-0.2 -0.993 38.0-174.2-144.1 137.2 41.0 6.2 42.7 50 77 A K + 0 0 90 -2,-0.3 3,-0.1 1,-0.2 -9,-0.0 -0.747 64.2 35.2-121.1 171.3 39.9 9.7 41.5 51 78 A D S S+ 0 0 125 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.915 87.1 130.6 48.8 53.5 38.8 11.1 38.1 52 79 A I - 0 0 15 -3,-0.2 2,-0.3 152,-0.1 151,-0.2 -0.922 65.1-102.8-128.3 154.4 37.1 7.9 37.1 53 80 A G E -B 202 0B 6 149,-4.2 149,-1.8 -2,-0.3 2,-0.4 -0.604 38.1-170.3 -71.8 138.1 33.8 7.1 35.6 54 81 A I E -B 201 0B 12 -2,-0.3 2,-0.5 147,-0.2 147,-0.2 -0.997 6.1-169.4-133.0 127.8 31.4 5.6 38.3 55 82 A V E -B 200 0B 1 145,-1.3 145,-2.2 -2,-0.4 2,-0.3 -0.979 12.1-146.6-120.4 129.9 28.1 4.0 37.4 56 83 A L E -B 199 0B 13 -2,-0.5 2,-0.4 143,-0.2 143,-0.2 -0.745 18.4-169.9 -97.1 139.8 25.6 3.2 40.2 57 84 A G E -B 198 0B 0 141,-1.9 2,-2.4 -2,-0.3 141,-1.7 -0.983 38.3-120.5-135.4 143.1 23.3 0.2 39.9 58 85 A N S S- 0 0 12 -2,-0.4 139,-0.3 139,-0.2 4,-0.3 -0.566 103.2 -26.6 -67.8 76.3 20.3 -1.4 41.6 59 86 A G S >> S- 0 0 0 -2,-2.4 3,-0.7 137,-0.5 139,-0.7 -0.078 86.1 -81.8 92.0 161.5 22.5 -4.4 42.1 60 87 A A H >> S+ 0 0 11 137,-0.3 4,-2.1 1,-0.2 3,-0.8 0.798 122.3 78.0 -64.1 -26.6 25.5 -5.5 39.9 61 88 A S H 3> S+ 0 0 12 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.861 88.0 54.2 -47.7 -43.9 22.8 -7.0 37.6 62 89 A E H <> S+ 0 0 33 -3,-0.7 4,-2.5 -4,-0.3 -1,-0.3 0.872 109.5 47.3 -63.6 -36.1 22.0 -3.6 36.2 63 90 A I H < S+ 0 0 2 -4,-2.8 3,-0.6 1,-0.2 -1,-0.2 0.859 115.4 45.3 -65.0 -32.3 27.5 -2.4 29.8 68 95 A I H >< S+ 0 0 0 -4,-1.6 3,-1.3 -5,-0.3 -2,-0.2 0.783 101.0 68.3 -80.0 -25.6 26.7 -5.3 27.5 69 96 A S T 3< S+ 0 0 16 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.645 90.3 67.6 -64.2 -13.6 23.7 -3.3 26.0 70 97 A L T < S+ 0 0 43 -3,-0.6 -1,-0.2 -4,-0.5 2,-0.2 0.670 93.8 61.9 -84.1 -20.2 26.3 -0.9 24.5 71 98 A F < - 0 0 35 -3,-1.3 3,-0.1 -4,-0.2 20,-0.0 -0.694 62.1-146.7-115.3 162.3 27.8 -3.3 22.0 72 99 A E S S+ 0 0 147 1,-0.3 22,-1.7 -2,-0.2 2,-0.3 0.358 88.8 23.8-105.2 2.2 26.7 -5.3 18.9 73 100 A K E -c 94 0B 68 20,-0.2 46,-1.8 -5,-0.1 47,-0.9 -0.855 65.6-176.2-167.9 131.8 29.1 -8.2 19.5 74 101 A I E -cd 95 120B 0 20,-3.6 22,-2.6 -2,-0.3 2,-0.7 -0.968 24.8-134.5-134.6 145.5 30.8 -9.8 22.5 75 102 A L E -cd 96 121B 0 45,-2.6 47,-1.9 -2,-0.4 2,-0.6 -0.893 26.4-162.3 -91.2 116.8 33.3 -12.5 23.3 76 103 A I E -cd 97 122B 0 20,-2.6 22,-2.1 -2,-0.7 2,-0.4 -0.910 11.8-141.6-103.9 120.3 32.0 -14.4 26.3 77 104 A I E -c 98 0B 2 45,-1.4 22,-0.2 -2,-0.6 47,-0.2 -0.705 39.8-123.2 -77.9 130.9 34.5 -16.6 28.2 78 105 A V E S+c 99 0B 5 20,-2.8 22,-2.0 -2,-0.4 2,-0.2 -0.966 84.1 49.9-147.3 148.0 32.6 -19.7 29.2 79 106 A P S S+ 0 0 2 0, 0.0 2,-0.3 0, 0.0 51,-0.1 0.489 92.5 134.7 -50.1 150.5 31.7 -21.6 31.4 80 107 A S - 0 0 8 -2,-0.2 223,-0.3 43,-0.1 -2,-0.1 -0.977 60.9 -49.5-167.0 172.1 30.6 -18.4 33.1 81 108 A Y > - 0 0 65 -2,-0.3 3,-2.1 47,-0.2 4,-0.4 -0.281 52.4-128.7 -51.2 122.1 27.7 -16.7 35.0 82 109 A A T >> S+ 0 0 41 1,-0.3 4,-1.8 2,-0.1 3,-0.5 0.764 99.0 72.3 -44.6 -38.7 24.5 -17.2 33.0 83 110 A E H 3> S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.689 82.8 68.2 -58.5 -24.2 23.7 -13.5 33.0 84 111 A Y H <> S+ 0 0 2 -3,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.986 112.0 30.7 -59.1 -55.2 26.4 -12.5 30.5 85 112 A E H <> S+ 0 0 56 -3,-0.5 4,-2.5 -4,-0.4 5,-0.2 0.803 115.1 60.2 -74.0 -34.9 24.7 -14.3 27.6 86 113 A I H X S+ 0 0 95 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.972 110.7 41.9 -52.7 -55.7 21.1 -13.8 28.8 87 114 A N H X S+ 0 0 5 -4,-2.0 4,-1.0 2,-0.2 6,-0.2 0.875 109.5 57.8 -64.2 -41.2 21.6 -10.1 28.7 88 115 A A H ><>S+ 0 0 0 -4,-1.7 5,-2.4 -5,-0.3 3,-1.6 0.968 111.2 42.1 -49.8 -60.0 23.4 -10.2 25.4 89 116 A K H ><5S+ 0 0 151 -4,-2.5 3,-1.4 1,-0.3 -2,-0.2 0.892 108.8 62.1 -53.3 -41.2 20.4 -11.9 23.8 90 117 A K H 3<5S+ 0 0 66 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.710 114.8 32.4 -57.6 -22.6 18.2 -9.5 25.7 91 118 A H T <<5S- 0 0 77 -3,-1.6 -1,-0.3 -4,-1.0 -2,-0.2 0.173 114.6-106.8-124.3 16.1 19.8 -6.6 23.8 92 119 A G T < 5 + 0 0 64 -3,-1.4 2,-0.3 -4,-0.3 -3,-0.2 0.725 61.7 159.2 66.6 24.3 20.5 -8.2 20.4 93 120 A V < - 0 0 11 -5,-2.4 -20,-0.2 -6,-0.2 -1,-0.2 -0.608 43.4-117.6 -80.2 136.6 24.3 -8.5 20.9 94 121 A S E -c 73 0B 62 -22,-1.7 -20,-3.6 -2,-0.3 2,-0.5 -0.514 30.6-142.8 -71.5 139.7 26.2 -11.0 18.8 95 122 A V E +c 74 0B 47 -22,-0.2 2,-0.4 -2,-0.2 -20,-0.2 -0.915 22.4 176.4-116.2 131.0 27.9 -13.7 20.8 96 123 A V E -c 75 0B 31 -22,-2.6 -20,-2.6 -2,-0.5 2,-0.3 -0.998 23.6-139.8-126.5 130.7 31.2 -15.4 20.3 97 124 A F E -c 76 0B 45 -2,-0.4 2,-0.4 -22,-0.2 -20,-0.2 -0.678 16.2-169.6 -98.4 144.8 32.5 -18.0 22.8 98 125 A S E -c 77 0B 1 -22,-2.1 -20,-2.8 -2,-0.3 2,-0.4 -0.982 23.1-145.3-125.1 121.5 35.9 -18.6 24.3 99 126 A Y E -c 78 0B 116 -2,-0.4 8,-0.1 -22,-0.2 2,-0.1 -0.679 10.7-124.5 -93.2 133.2 36.1 -21.8 26.3 100 127 A L - 0 0 16 -22,-2.0 6,-0.2 -2,-0.4 -1,-0.0 -0.448 40.3-114.9 -58.2 145.5 38.2 -22.5 29.4 101 128 A D > - 0 0 68 4,-2.7 3,-1.5 -2,-0.1 -1,-0.1 0.131 41.7 -74.7 -73.1-165.8 40.4 -25.6 28.7 102 129 A E T 3 S+ 0 0 164 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.762 134.2 50.8 -65.1 -24.6 40.1 -28.9 30.5 103 130 A N T 3 S- 0 0 69 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.342 121.0-105.8 -95.0 8.4 41.8 -27.4 33.6 104 131 A M S < S+ 0 0 25 -3,-1.5 2,-0.4 1,-0.3 -2,-0.1 0.832 74.3 146.6 61.7 37.9 39.4 -24.5 33.8 105 132 A C - 0 0 62 -6,-0.1 -4,-2.7 1,-0.0 -1,-0.3 -0.851 54.4-107.5-101.1 139.1 42.2 -22.2 32.5 106 133 A I - 0 0 25 -2,-0.4 2,-1.2 -6,-0.2 3,-0.2 -0.313 20.2-133.2 -56.8 140.2 41.6 -19.2 30.2 107 134 A D >> + 0 0 74 1,-0.2 4,-2.2 -8,-0.1 3,-1.6 -0.688 32.9 175.4 -92.8 76.8 42.7 -19.8 26.6 108 135 A Y H 3> S+ 0 0 33 -2,-1.2 4,-2.5 1,-0.3 -1,-0.2 0.880 76.6 55.3 -54.1 -40.9 44.5 -16.4 26.5 109 136 A E H 3> S+ 0 0 144 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.748 108.0 50.2 -64.7 -25.5 45.8 -17.1 23.1 110 137 A D H <> S+ 0 0 31 -3,-1.6 4,-0.5 2,-0.2 -2,-0.2 0.884 106.3 52.8 -78.4 -44.0 42.2 -17.7 21.9 111 138 A I H >X S+ 0 0 0 -4,-2.2 3,-1.2 1,-0.2 4,-0.7 0.943 112.4 48.4 -53.1 -47.0 40.9 -14.5 23.4 112 139 A I H >< S+ 0 0 41 -4,-2.5 3,-1.4 1,-0.2 4,-0.3 0.951 108.2 52.2 -53.4 -54.7 43.8 -12.8 21.4 113 140 A S H 3< S+ 0 0 80 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.458 116.4 41.4 -69.1 0.3 42.9 -14.6 18.2 114 141 A K H XX S+ 0 0 42 -3,-1.2 3,-1.9 -4,-0.5 4,-0.5 0.432 83.2 96.8-120.9 -7.3 39.3 -13.5 18.5 115 142 A I T << S+ 0 0 3 -3,-1.4 3,-0.1 -4,-0.7 -2,-0.1 0.650 84.2 51.5 -73.1 -14.6 39.6 -9.9 19.6 116 143 A D T 34 S+ 0 0 111 -4,-0.3 -1,-0.3 1,-0.1 -3,-0.1 0.495 102.1 64.8 -87.4 -7.9 39.3 -8.4 16.1 117 144 A D T <4 S+ 0 0 94 -3,-1.9 2,-0.2 -21,-0.0 -2,-0.2 0.641 105.8 42.1 -84.6 -15.7 36.1 -10.5 15.7 118 145 A V < - 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