==== 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 STRUCTURAL GENOMICS, LIGASE 22-JAN-02 1KUT . COMPND 2 MOLECULE: PHOSPHORIBOSYLAMINOIMIDAZOLE-SUCCINOCARBOXAMIDE . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR R.ZHANG,T.SKARINA,S.BEASLEY,A.EDWARDS,A.JOACHIMIAK, . 435 5 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22736.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 322 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 23.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 31 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.8 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 4 1 0 0 1 0 0 1 0 0 1 1 1 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 4 2 6 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 3 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 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 7 A T 0 0 109 0, 0.0 15,-1.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-155.1 54.0 8.1 74.0 2 8 A K E -A 15 0A 45 13,-0.3 2,-0.4 15,-0.1 13,-0.2 -0.951 360.0-125.1-173.8 157.6 52.1 6.0 76.5 3 9 A I E -A 14 0A 77 11,-2.1 11,-2.3 -2,-0.3 2,-0.3 -0.964 13.4-148.2-124.3 129.5 51.7 2.4 77.8 4 10 A V E +A 13 0A 91 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.640 18.0 176.3 -90.4 147.9 48.5 0.3 78.0 5 11 A K E -A 12 0A 147 7,-1.4 7,-2.3 -2,-0.3 -2,-0.0 -0.840 26.8-127.1-157.0 111.8 48.2 -2.3 80.8 6 12 A V E -A 11 0A 99 -2,-0.3 5,-0.3 5,-0.2 3,-0.1 -0.311 14.7-168.5 -61.4 140.3 45.1 -4.4 81.4 7 13 A T E > -A 10 0A 77 3,-3.7 2,-0.7 1,-0.1 3,-0.6 -0.358 56.0 -88.4-124.0 46.9 43.7 -4.4 85.0 8 14 A G T 3 S+ 0 0 58 1,-0.2 -1,-0.1 2,-0.0 -2,-0.0 -0.745 114.1 12.7 87.6-114.5 41.2 -7.3 84.6 9 15 A D T 3 S+ 0 0 143 -2,-0.7 -1,-0.2 -3,-0.1 2,-0.2 0.711 136.6 34.9 -70.2 -20.2 37.9 -6.1 83.3 10 16 A Y E < S-A 7 0A 102 -3,-0.6 -3,-3.7 49,-0.1 2,-0.3 -0.684 75.5-129.3-126.1 179.3 39.4 -2.7 82.5 11 17 A A E -AB 6 58A 2 47,-2.4 47,-2.3 -5,-0.3 2,-0.5 -0.925 8.4-140.0-131.0 155.5 42.6 -1.3 81.2 12 18 A L E -AB 5 57A 68 -7,-2.3 -7,-1.4 -2,-0.3 2,-0.7 -0.977 11.4-162.8-119.3 121.2 44.8 1.6 82.4 13 19 A L E -AB 4 56A 5 43,-2.7 43,-1.7 -2,-0.5 2,-0.5 -0.889 9.6-163.7-108.0 103.6 46.4 3.8 79.7 14 20 A E E -AB 3 55A 79 -11,-2.3 -11,-2.1 -2,-0.7 2,-0.6 -0.754 9.8-143.9 -90.3 126.9 49.3 5.7 81.2 15 21 A F E -A 2 0A 2 39,-3.5 2,-0.3 -2,-0.5 -13,-0.3 -0.815 16.8-157.8 -93.5 118.5 50.5 8.8 79.2 16 22 A K - 0 0 56 -15,-1.5 6,-0.1 -2,-0.6 7,-0.0 -0.737 22.5-133.2 -98.8 145.9 54.3 9.2 79.4 17 23 A D 0 0 38 -2,-0.3 5,-0.2 1,-0.2 6,-0.2 0.401 360.0 360.0 -73.2 3.7 56.2 12.4 78.8 18 24 A D 0 0 105 2,-0.1 -1,-0.2 -17,-0.1 -16,-0.1 0.885 360.0 360.0 -57.9 360.0 58.6 10.5 76.6 19 ! 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 20 36 A L 0 0 151 0, 0.0 -2,-0.1 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0 11.4 61.6 14.2 78.6 21 37 A T - 0 0 81 176,-0.0 -3,-0.1 177,-0.0 -4,-0.1 -0.138 360.0-107.3-162.9 -94.0 58.9 16.9 79.1 22 38 A G S > S+ 0 0 21 -5,-0.2 4,-0.5 -6,-0.1 3,-0.2 0.344 75.2 118.6 147.4 23.3 55.7 16.7 81.2 23 39 A K H > + 0 0 25 -6,-0.2 4,-3.7 1,-0.2 5,-0.3 0.694 53.5 81.6 -84.7 -22.6 53.1 16.6 78.5 24 40 A G H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.871 93.3 49.4 -51.9 -40.5 51.6 13.2 79.3 25 41 A S H > S+ 0 0 22 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.933 114.6 43.9 -64.8 -46.6 49.5 14.8 82.1 26 42 A I H X S+ 0 0 20 -4,-0.5 4,-2.6 1,-0.2 -2,-0.2 0.920 114.1 50.1 -64.5 -45.8 48.2 17.4 79.7 27 43 A C H X S+ 0 0 1 -4,-3.7 4,-2.4 1,-0.2 144,-0.3 0.868 111.2 48.4 -63.1 -36.6 47.7 15.0 76.9 28 44 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.912 113.0 47.5 -70.3 -40.6 45.7 12.6 79.1 29 45 A E H X S+ 0 0 36 -4,-2.1 4,-2.1 24,-0.3 -2,-0.2 0.887 112.6 49.3 -68.0 -38.8 43.6 15.4 80.5 30 46 A T H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.4 0.961 111.8 48.8 -63.1 -52.5 42.9 16.8 77.0 31 47 A T H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.912 111.3 50.7 -53.7 -44.9 42.0 13.3 75.8 32 48 A A H X S+ 0 0 9 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.881 112.3 46.4 -64.5 -37.1 39.7 12.8 78.7 33 49 A I H X S+ 0 0 15 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.946 117.9 39.5 -72.5 -48.0 37.9 16.1 78.2 34 50 A L H X S+ 0 0 0 -4,-2.8 4,-2.2 137,-0.2 -2,-0.2 0.935 117.0 50.4 -67.5 -41.6 37.3 15.8 74.4 35 51 A X H X S+ 0 0 0 -4,-2.6 4,-1.1 -5,-0.4 -1,-0.2 0.807 109.9 50.6 -65.9 -29.2 36.5 12.1 74.7 36 52 A K H X S+ 0 0 120 -4,-1.3 4,-1.1 -5,-0.3 -1,-0.2 0.848 111.0 48.0 -77.0 -34.6 33.9 12.8 77.5 37 53 A Y H X S+ 0 0 10 -4,-1.7 4,-0.6 1,-0.2 -2,-0.2 0.851 108.5 55.3 -71.1 -36.7 32.2 15.5 75.5 38 54 A L H ><>S+ 0 0 0 -4,-2.2 5,-2.0 1,-0.2 3,-0.6 0.848 102.0 59.2 -63.9 -34.7 32.2 13.2 72.5 39 55 A S H ><5S+ 0 0 47 -4,-1.1 3,-2.0 1,-0.2 -1,-0.2 0.891 100.5 51.7 -64.7 -41.0 30.4 10.6 74.5 40 56 A E H 3<5S+ 0 0 126 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.672 101.9 63.4 -70.3 -12.8 27.4 12.8 75.4 41 57 A K T <<5S- 0 0 83 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.328 127.4-105.3 -88.4 5.8 27.2 13.4 71.6 42 58 A G T < 5S+ 0 0 61 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.365 76.0 140.5 88.3 -5.5 26.5 9.6 71.5 43 59 A I < - 0 0 15 -5,-2.0 2,-0.6 -6,-0.1 -1,-0.3 -0.482 50.0-129.2 -72.6 138.3 29.9 8.7 70.2 44 60 A K + 0 0 103 -2,-0.2 123,-2.6 121,-0.2 2,-0.3 -0.797 35.0 166.4 -94.3 122.2 31.5 5.5 71.6 45 61 A T B -d 167 0B 4 -2,-0.6 123,-0.2 121,-0.2 14,-0.1 -0.860 48.0-114.2-126.6 162.7 35.0 5.8 73.0 46 62 A H S S+ 0 0 4 121,-2.2 13,-2.3 -2,-0.3 2,-0.2 0.392 76.4 124.0 -79.1 9.7 37.1 3.5 75.1 47 63 A L E +C 58 0A 27 11,-0.2 11,-0.2 1,-0.2 -2,-0.2 -0.507 23.6 158.9 -76.1 132.7 37.1 6.2 77.9 48 64 A V E - 0 0 59 9,-3.0 2,-0.3 1,-0.3 10,-0.2 0.682 67.9 -35.6-111.5 -54.8 35.8 5.2 81.3 49 65 A E E -C 57 0A 103 8,-1.8 8,-3.4 2,-0.0 2,-0.5 -0.975 52.8-105.0-169.1 156.8 37.4 8.0 83.4 50 66 A Y E -C 56 0A 54 -2,-0.3 6,-0.2 6,-0.2 -21,-0.0 -0.732 23.1-165.3 -88.9 126.9 40.4 10.2 83.9 51 67 A I E >> -C 55 0A 64 4,-2.6 4,-1.5 -2,-0.5 3,-0.6 -0.849 44.6 -88.0-114.7 93.5 42.7 9.3 86.8 52 68 A P T 34 S+ 0 0 90 0, 0.0 -27,-0.0 0, 0.0 4,-0.0 0.029 92.1 9.5 -45.6 146.8 45.0 12.4 87.3 53 69 A P T 34 S- 0 0 59 0, 0.0 -24,-0.3 0, 0.0 -25,-0.2 -0.994 131.6 -14.1-102.7 -2.3 47.4 13.4 86.3 54 70 A R T <4 S+ 0 0 80 -3,-0.6 -39,-3.5 -26,-0.1 2,-0.3 0.274 98.7 91.7-143.1 18.6 48.3 11.1 83.3 55 71 A T E < -BC 14 51A 22 -4,-1.5 -4,-2.6 -41,-0.2 2,-0.4 -0.873 47.8-156.4-121.3 152.6 46.2 7.9 83.3 56 72 A L E -BC 13 50A 0 -43,-1.7 -43,-2.7 -2,-0.3 2,-0.8 -0.982 15.2-140.7-127.4 134.1 43.0 6.9 81.7 57 73 A K E +BC 12 49A 46 -8,-3.4 -9,-3.0 -2,-0.4 -8,-1.8 -0.846 41.5 172.0 -88.8 116.1 40.6 4.1 82.8 58 74 A V E -BC 11 47A 4 -47,-2.3 -47,-2.4 -2,-0.8 -11,-0.2 -0.904 38.0-107.2-129.6 156.6 39.6 2.7 79.4 59 75 A I - 0 0 27 -13,-2.3 -49,-0.1 -2,-0.3 -50,-0.0 -0.657 49.5 -99.8 -81.9 138.7 37.6 -0.3 78.2 60 76 A P - 0 0 50 0, 0.0 101,-0.3 0, 0.0 2,-0.3 -0.259 47.4-173.6 -57.0 140.5 39.9 -3.0 76.6 61 77 A L - 0 0 33 99,-0.1 2,-0.8 100,-0.1 99,-0.2 -0.994 32.3-132.2-141.9 148.6 40.0 -2.9 72.8 62 78 A K E -E 159 0B 161 97,-2.1 97,-2.9 -2,-0.3 2,-0.2 -0.896 43.4-139.7 -96.5 110.8 41.4 -5.0 70.0 63 79 A X E -E 158 0B 89 -2,-0.8 95,-0.3 95,-0.3 93,-0.0 -0.453 2.9-127.9 -79.6 143.9 42.9 -2.2 67.9 64 80 A F - 0 0 14 93,-2.8 2,-3.1 -2,-0.2 93,-0.2 -0.742 24.6-124.2 -85.5 132.8 42.9 -2.0 64.2 65 81 A P S S+ 0 0 65 0, 0.0 35,-1.9 0, 0.0 2,-0.3 -0.273 77.8 111.6 -75.7 60.4 46.5 -1.5 62.8 66 82 A L E -G 99 0C 3 -2,-3.1 2,-0.6 91,-0.2 91,-0.3 -0.984 58.9-154.2-138.3 142.6 45.1 1.7 61.1 67 83 A E E -G 98 0C 49 31,-3.2 31,-1.8 -2,-0.3 2,-0.6 -0.975 23.0-158.4-113.2 115.9 45.6 5.4 61.4 68 84 A V E -GH 97 155C 1 87,-2.7 87,-2.4 -2,-0.6 2,-0.4 -0.881 7.0-161.0-103.0 120.4 42.4 7.0 60.1 69 85 A V E -GH 96 154C 16 27,-3.3 27,-2.7 -2,-0.6 2,-0.5 -0.811 9.4-165.6-104.7 137.0 42.8 10.6 59.0 70 86 A V E -GH 95 153C 0 83,-2.6 83,-1.7 -2,-0.4 2,-0.4 -0.983 10.4-159.6-120.5 121.8 40.0 13.2 58.5 71 87 A R E +GH 94 152C 17 23,-2.9 23,-2.1 -2,-0.5 81,-0.2 -0.852 21.4 171.7-104.6 137.4 40.9 16.3 56.6 72 88 A L E S+ 0 0 19 79,-3.0 18,-3.1 -2,-0.4 2,-0.3 0.663 78.2 21.2-107.6 -33.9 38.8 19.5 56.8 73 89 A K E S-G 89 0C 22 78,-1.8 2,-0.5 16,-0.3 -1,-0.4 -0.916 92.6 -96.7-132.2 157.7 41.3 21.7 54.9 74 90 A K + 0 0 24 14,-2.3 13,-3.4 11,-0.3 14,-0.4 -0.644 67.9 125.0 -77.0 122.3 44.0 20.8 52.4 75 91 A A >> + 0 0 3 -2,-0.5 3,-2.1 11,-0.2 4,-0.8 -0.886 49.7 10.2-158.9-173.5 47.3 20.7 54.2 76 92 A G H >> S+ 0 0 14 1,-0.3 4,-1.5 -2,-0.3 3,-0.6 0.082 127.1 2.3 36.3-123.1 50.3 18.5 54.9 77 93 A S H 3> S+ 0 0 42 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.661 125.4 68.6 -67.1 -17.5 50.6 15.4 52.8 78 94 A F H <> S+ 0 0 0 -3,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.883 103.9 38.4 -72.0 -40.8 47.4 16.3 50.9 79 95 A V H - 0 0 56 -2,-0.1 3,-2.0 1,-0.1 -11,-0.3 -0.679 55.4-118.2 -87.5 130.2 45.9 25.7 48.1 86 102 A E T 3 S+ 0 0 128 -2,-0.4 -11,-0.2 1,-0.3 3,-0.1 -0.434 101.2 22.6 -65.2 130.0 47.0 25.0 51.7 87 103 A G T 3 S+ 0 0 20 -13,-3.4 2,-0.4 1,-0.3 -1,-0.3 0.394 84.5 144.3 94.3 -4.3 44.1 25.9 54.0 88 104 A E < - 0 0 98 -3,-2.0 -14,-2.3 -14,-0.4 -1,-0.3 -0.586 52.7-119.7 -74.0 126.3 41.5 25.5 51.4 89 105 A D E -G 73 0C 98 -2,-0.4 -16,-0.3 -16,-0.2 -1,-0.1 -0.303 22.7-122.7 -64.8 143.4 38.3 24.0 53.0 90 106 A L E - 0 0 18 -18,-3.1 -1,-0.1 1,-0.1 252,-0.0 -0.656 14.1-125.4 -89.0 145.0 37.1 20.7 51.7 91 107 A P E S- 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.930 98.3 -0.7 -50.7 -47.3 33.5 20.4 50.4 92 108 A V E S- 0 0 84 -21,-0.0 -21,-0.1 -3,-0.0 250,-0.0 -0.975 102.2 -79.4-141.8 148.1 33.0 17.6 52.8 93 109 A P E - 0 0 33 0, 0.0 2,-0.5 0, 0.0 -21,-0.2 -0.169 45.1-137.6 -50.5 140.8 35.4 16.0 55.3 94 110 A L E -G 71 0C 2 -23,-2.1 -23,-2.9 -21,-0.1 2,-0.5 -0.921 12.8-158.1-107.2 125.7 37.9 13.6 53.6 95 111 A V E -G 70 0C 11 -2,-0.5 2,-0.4 -25,-0.2 -25,-0.2 -0.883 12.3-179.5-104.6 132.8 38.7 10.3 55.4 96 112 A E E -G 69 0C 3 -27,-2.7 -27,-3.3 -2,-0.5 2,-0.4 -0.985 15.3-143.9-131.0 142.0 41.9 8.5 54.5 97 113 A F E -G 68 0C 9 12,-0.5 12,-1.8 -2,-0.4 2,-0.4 -0.864 13.9-173.6-109.5 141.1 43.2 5.2 55.9 98 114 A F E -GI 67 108C 30 -31,-1.8 -31,-3.2 -2,-0.4 10,-0.2 -0.998 21.3-131.1-135.5 132.0 46.8 4.3 56.6 99 115 A I E -G 66 0C 21 8,-2.3 2,-1.3 -2,-0.4 -33,-0.2 -0.564 25.4-121.7 -76.9 144.4 48.2 1.0 57.7 100 116 A K + 0 0 83 -35,-1.9 2,-0.3 -2,-0.2 -1,-0.1 -0.721 63.9 130.3 -90.5 90.0 50.6 1.2 60.7 101 117 A D > > - 0 0 42 -2,-1.3 5,-2.3 1,-0.1 3,-1.1 -0.740 31.2-177.5-143.3 89.4 53.7 -0.3 59.1 102 118 A D G > 5S+ 0 0 135 1,-0.3 3,-1.8 -2,-0.3 -1,-0.1 0.894 84.7 57.2 -57.1 -43.3 56.8 1.8 59.7 103 119 A E G 3 5S+ 0 0 151 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.771 116.1 38.1 -59.9 -24.5 59.0 -0.5 57.7 104 120 A R G < 5S- 0 0 69 -3,-1.1 -1,-0.3 203,-0.1 -2,-0.2 0.222 117.4-111.1-110.6 11.5 56.7 0.0 54.8 105 121 A H T < 5 - 0 0 156 -3,-1.8 -3,-0.2 -4,-0.2 -2,-0.1 0.821 56.7 -76.8 63.7 38.4 56.0 3.7 55.4 106 122 A D < - 0 0 54 -5,-2.3 -1,-0.2 1,-0.1 -6,-0.1 0.895 62.0-147.0 39.8 66.4 52.3 3.4 56.5 107 123 A P - 0 0 14 0, 0.0 -8,-2.3 0, 0.0 -1,-0.1 -0.253 13.7-113.1 -61.7 143.3 50.8 2.9 53.0 108 124 A X B -I 98 0C 18 -10,-0.2 2,-0.3 226,-0.0 -10,-0.2 -0.419 33.8-165.3 -73.4 152.7 47.4 4.3 52.3 109 125 A V - 0 0 0 -12,-1.8 -12,-0.5 -2,-0.1 2,-0.1 -0.993 11.3-146.4-143.6 135.6 44.6 1.8 51.7 110 126 A a >> - 0 0 23 -2,-0.3 4,-1.8 225,-0.1 3,-1.3 -0.391 44.6 -89.4 -88.1 176.3 41.0 2.2 50.3 111 127 A V H 3> S+ 0 0 38 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.929 126.2 57.8 -53.4 -51.4 38.2 0.0 51.5 112 128 A D H 3> S+ 0 0 44 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.772 108.2 50.7 -52.9 -24.1 38.7 -2.8 49.0 113 129 A H H <> S+ 0 0 2 -3,-1.3 4,-3.4 2,-0.2 6,-0.3 0.943 103.9 54.2 -77.1 -52.5 42.2 -3.0 50.5 114 130 A L H <>S+ 0 0 0 -4,-1.8 5,-2.0 1,-0.2 6,-1.4 0.894 117.4 39.1 -48.6 -44.7 41.2 -3.2 54.1 115 131 A E H ><5S+ 0 0 78 -4,-2.1 3,-1.9 2,-0.2 -1,-0.2 0.956 115.9 47.9 -72.9 -53.3 39.0 -6.2 53.2 116 132 A I H 3<5S+ 0 0 33 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.823 113.6 51.4 -58.5 -28.8 41.2 -7.9 50.7 117 133 A L T 3<5S- 0 0 54 -4,-3.4 -1,-0.3 -5,-0.1 -2,-0.2 0.503 111.4-121.4 -87.1 -2.9 44.1 -7.5 53.2 118 134 A G T < 5S+ 0 0 68 -3,-1.9 -3,-0.2 2,-0.3 -4,-0.1 0.613 80.4 118.0 74.6 11.2 42.1 -9.1 56.1 119 135 A I S - 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