==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-DEC-10 3Q4I . COMPND 2 MOLECULE: PHOSPHOHYDROLASE (MUTT/NUDIX FAMILY PROTEIN); . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR K.C.DUONG-LY,S.B.GABELLI,L.M.AMZEL . 408 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19738.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 276 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 61 15.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 0.5 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 . 29 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 0 0 0 0 1 0 0 2 2 0 0 0 0 3 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 0 0 0 0 2 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 . 0 4 2 1 0 1 0 0 0 2 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 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 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 2 A T 0 0 99 0, 0.0 255,-1.6 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 143.6 70.9 17.0 44.1 2 3 A I > + 0 0 67 253,-0.1 3,-0.7 1,-0.1 4,-0.4 -0.077 360.0 115.7-124.2 30.2 68.6 13.9 44.0 3 4 A K T >> + 0 0 125 1,-0.2 4,-1.5 2,-0.2 3,-0.9 0.790 63.9 76.5 -64.4 -27.0 65.2 15.7 43.6 4 5 A W H 3> S+ 0 0 1 1,-0.3 4,-3.1 2,-0.2 5,-0.3 0.838 80.1 66.9 -54.7 -38.8 65.0 13.9 40.3 5 6 A I H <> S+ 0 0 4 -3,-0.7 4,-2.3 1,-0.2 -1,-0.3 0.892 104.4 44.5 -49.3 -47.1 64.1 10.6 41.9 6 7 A D H <> S+ 0 0 78 -3,-0.9 4,-2.5 -4,-0.4 -1,-0.2 0.884 112.4 51.2 -67.4 -43.7 60.8 12.0 43.1 7 8 A W H X S+ 0 0 30 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.962 112.3 46.0 -57.3 -52.6 60.0 13.7 39.7 8 9 A V H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.909 111.5 52.9 -59.8 -41.4 60.7 10.5 37.8 9 10 A K H X S+ 0 0 10 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.920 110.4 47.7 -58.1 -44.0 58.6 8.5 40.3 10 11 A Q H X S+ 0 0 59 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.947 110.7 51.4 -62.1 -49.4 55.7 11.0 39.8 11 12 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.921 112.3 45.3 -54.0 -50.8 56.0 10.8 36.0 12 13 A Q H X S+ 0 0 0 -4,-2.6 4,-3.5 1,-0.2 -1,-0.2 0.924 111.3 53.1 -61.3 -45.5 55.9 7.0 36.0 13 14 A S H X S+ 0 0 7 -4,-2.4 4,-2.5 -5,-0.2 51,-0.4 0.905 112.0 44.6 -55.5 -46.3 53.0 6.9 38.5 14 15 A I H X S+ 0 0 8 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.870 114.0 49.9 -66.3 -39.2 50.9 9.2 36.3 15 16 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.934 111.1 49.5 -63.2 -46.5 51.8 7.3 33.2 16 17 A Q H X S+ 0 0 3 -4,-3.5 4,-1.1 2,-0.2 -2,-0.2 0.917 112.4 48.6 -55.4 -46.0 50.8 4.0 35.0 17 18 A A H >X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 3,-0.9 0.949 109.6 51.7 -59.2 -52.5 47.5 5.7 35.9 18 19 A G H 3X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.3 -1,-0.2 0.886 107.9 52.1 -51.2 -43.8 46.9 6.9 32.4 19 20 A L H 3< S+ 0 0 40 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.762 113.5 44.9 -67.1 -26.1 47.5 3.4 31.0 20 21 A T H << S+ 0 0 50 -4,-1.1 -2,-0.2 -3,-0.9 -1,-0.2 0.857 127.3 23.8 -83.5 -39.6 44.9 2.0 33.5 21 22 A Y H < S+ 0 0 101 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.699 92.1 99.4-110.0 -25.0 42.2 4.6 33.1 22 23 A S < - 0 0 5 -4,-2.8 3,-0.0 -5,-0.4 0, 0.0 -0.441 41.8-174.9 -65.8 139.7 42.5 6.2 29.6 23 24 A K + 0 0 179 -2,-0.1 2,-0.6 5,-0.0 -1,-0.1 0.160 55.2 99.8-116.6 12.0 40.2 4.7 27.0 24 25 A D >> - 0 0 72 1,-0.1 4,-3.3 205,-0.0 3,-0.6 -0.908 66.0-146.3-107.4 117.4 41.6 6.7 24.1 25 26 A V H 3> S+ 0 0 107 -2,-0.6 4,-1.2 1,-0.3 -1,-0.1 0.759 99.1 48.9 -54.5 -30.2 44.0 4.8 21.9 26 27 A Y H 3> S+ 0 0 149 2,-0.2 4,-1.4 3,-0.1 -1,-0.3 0.859 115.2 42.6 -80.9 -33.3 46.1 7.9 21.1 27 28 A D H <> S+ 0 0 2 -3,-0.6 4,-2.8 2,-0.2 5,-0.2 0.873 109.7 56.0 -78.8 -40.5 46.4 9.0 24.8 28 29 A I H X S+ 0 0 60 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.942 109.0 50.8 -49.2 -46.4 47.0 5.5 26.0 29 30 A E H X S+ 0 0 106 -4,-1.2 4,-2.6 -5,-0.3 -2,-0.2 0.901 107.7 51.0 -59.2 -45.1 49.9 5.7 23.5 30 31 A R H X S+ 0 0 42 -4,-1.4 4,-2.8 1,-0.2 -2,-0.2 0.937 109.9 50.3 -59.3 -47.4 51.2 9.0 24.9 31 32 A F H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.899 108.9 51.8 -56.7 -44.7 51.2 7.5 28.4 32 33 A Q H X S+ 0 0 74 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.942 110.1 47.7 -59.7 -47.9 53.1 4.5 27.2 33 34 A Q H X S+ 0 0 89 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.936 112.4 51.8 -57.5 -42.9 55.7 6.7 25.6 34 35 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.878 107.4 51.2 -60.5 -39.2 55.7 8.6 28.9 35 36 A R H X S+ 0 0 28 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.941 110.5 49.0 -64.0 -45.1 56.3 5.4 30.9 36 37 A D H X S+ 0 0 54 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.888 107.4 53.6 -62.7 -42.4 59.3 4.4 28.7 37 38 A I H X S+ 0 0 13 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.957 108.2 51.8 -55.7 -46.7 60.9 7.9 29.0 38 39 A S H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.851 109.6 48.9 -60.0 -36.6 60.6 7.4 32.8 39 40 A I H X S+ 0 0 0 -4,-1.8 4,-3.6 2,-0.2 5,-0.2 0.932 110.9 50.7 -65.3 -43.8 62.3 4.0 32.6 40 41 A S H X S+ 0 0 28 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.925 111.4 46.6 -62.3 -46.1 65.1 5.5 30.4 41 42 A M H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.924 116.4 46.2 -57.0 -45.5 65.7 8.4 32.9 42 43 A M H X S+ 0 0 0 -4,-2.1 4,-1.2 -5,-0.2 5,-0.2 0.954 112.6 49.0 -64.8 -50.6 65.7 5.9 35.8 43 44 A S H X>S+ 0 0 22 -4,-3.6 5,-2.6 1,-0.2 4,-0.6 0.851 115.9 44.4 -54.8 -39.2 68.0 3.4 34.0 44 45 A H H <5S+ 0 0 66 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.862 114.6 44.5 -78.8 -39.0 70.5 6.1 33.1 45 46 A Y H <5S+ 0 0 2 -4,-2.2 213,-2.7 1,-0.2 -1,-0.2 0.463 120.7 39.7 -94.1 -2.3 70.7 8.0 36.4 46 47 A T H <5S- 0 0 0 -4,-1.2 214,-0.6 211,-0.2 215,-0.2 0.443 106.5-123.0-110.6 -9.6 71.0 4.9 38.5 47 48 A K T <5 + 0 0 149 -4,-0.6 2,-0.4 1,-0.2 -3,-0.2 0.960 62.5 144.3 63.1 54.0 73.3 3.0 36.1 48 49 A T < - 0 0 27 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.2 -0.985 58.5 -98.2-131.5 135.1 70.9 0.2 35.8 49 50 A D > - 0 0 89 -2,-0.4 4,-2.5 1,-0.1 3,-0.4 -0.225 33.2-125.3 -51.9 133.5 70.0 -2.0 32.8 50 51 A W H > S+ 0 0 71 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.857 108.1 47.7 -50.9 -50.3 66.8 -0.9 31.1 51 52 A E H > S+ 0 0 113 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.847 110.9 53.0 -65.0 -35.5 65.0 -4.2 31.2 52 53 A V H > S+ 0 0 53 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.932 110.3 48.1 -63.8 -46.2 65.9 -4.5 34.9 53 54 A V H X>S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.7 0.952 109.1 52.7 -58.3 -50.8 64.4 -1.1 35.5 54 55 A E H X5S+ 0 0 70 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.890 112.3 46.8 -51.6 -44.7 61.2 -1.9 33.6 55 56 A K H X5S+ 0 0 130 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.954 121.8 32.8 -58.8 -54.8 60.8 -5.0 35.7 56 57 A L H <5S+ 0 0 19 -4,-2.3 211,-0.2 1,-0.2 -2,-0.2 0.597 132.6 25.0 -85.2 -17.1 61.4 -3.4 39.1 57 58 A F H <5S+ 0 0 11 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.550 130.2 25.5-128.6 -20.3 60.0 0.1 38.6 58 59 A A H < S-E 79 0B 86 3,-2.3 3,-1.6 -2,-0.5 -2,-0.0 -0.985 80.1 -25.1-121.1 118.7 55.6 -10.6 76.8 77 78 A N T 3 S- 0 0 145 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.906 126.9 -45.7 44.6 60.9 55.9 -9.3 80.4 78 79 A E T 3 S+ 0 0 146 1,-0.2 93,-0.5 92,-0.1 2,-0.4 0.517 115.8 112.2 66.3 10.0 56.8 -5.7 79.4 79 80 A K E < -E 76 0B 89 -3,-1.6 -3,-2.3 91,-0.2 2,-0.4 -0.923 61.7-131.1-117.8 144.0 59.4 -6.8 76.7 80 81 A L E -EF 75 169B 0 89,-3.2 89,-2.2 -2,-0.4 2,-0.4 -0.738 20.9-117.7-100.2 134.3 59.0 -6.4 73.0 81 82 A L E + F 0 168B 0 -7,-2.4 2,-0.3 -2,-0.4 -7,-0.3 -0.557 38.6 172.6 -75.6 122.2 59.6 -9.1 70.5 82 83 A F E - F 0 167B 0 85,-3.0 85,-1.3 -2,-0.4 2,-0.4 -0.883 17.8-159.1-125.2 158.3 62.4 -8.6 67.9 83 84 A V E -GF 92 166B 6 9,-2.9 9,-3.3 -2,-0.3 2,-0.4 -0.991 14.5-138.6-133.1 138.8 64.2 -10.7 65.3 84 85 A K E -G 91 0B 60 81,-1.9 2,-0.3 -2,-0.4 7,-0.2 -0.854 26.3-146.8 -95.8 135.5 67.6 -10.2 63.8 85 86 A E > - 0 0 69 5,-1.5 4,-2.1 -2,-0.4 3,-0.5 -0.826 20.0-107.0-116.1 152.5 67.8 -10.7 60.0 86 87 A K T 4 S+ 0 0 191 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.712 109.4 42.2 -33.7 -57.7 70.4 -12.0 57.6 87 88 A S T 4 S+ 0 0 115 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.902 122.0 31.6 -67.7 -48.5 71.5 -8.8 55.9 88 89 A D T 4 S- 0 0 74 -3,-0.5 -2,-0.2 2,-0.2 -1,-0.2 0.902 76.4-143.0 -78.7 -45.0 71.8 -6.3 58.7 89 90 A G S < S+ 0 0 35 -4,-2.1 2,-0.3 1,-0.4 87,-0.1 0.617 71.7 119.5 71.8 17.1 72.8 -8.3 61.8 90 91 A K - 0 0 84 -5,-0.5 -5,-1.5 85,-0.1 -1,-0.4 -0.746 67.6-105.1-116.9 161.5 70.3 -5.7 63.2 91 92 A W E +Gh 84 177B 21 85,-3.5 87,-2.6 -2,-0.3 2,-0.3 -0.670 36.4 167.9-100.2 139.8 67.0 -6.2 65.0 92 93 A A E -G 83 0B 7 -9,-3.3 -9,-2.9 -2,-0.3 3,-0.1 -0.988 39.3-100.6-142.7 152.9 63.5 -5.7 63.8 93 94 A L - 0 0 1 -2,-0.3 -11,-0.2 -11,-0.2 -20,-0.1 -0.345 60.3 -87.0 -58.5 148.8 59.9 -6.4 64.8 94 95 A P S S+ 0 0 0 0, 0.0 -22,-2.8 0, 0.0 2,-0.3 -0.366 85.5 80.2 -60.7 142.7 58.5 -9.4 62.9 95 96 A G E +B 71 0A 5 16,-0.3 2,-0.3 -24,-0.2 -24,-0.2 -0.985 36.7 174.8 157.1-161.5 57.0 -8.5 59.6 96 97 A G E -B 70 0A 12 -26,-1.7 -26,-3.0 -2,-0.3 2,-0.1 -0.981 53.3 -6.5 157.5-158.5 57.7 -7.6 56.0 97 98 A W E -B 69 0A 88 -2,-0.3 2,-0.6 -28,-0.2 -28,-0.2 -0.381 67.7-113.7 -66.2 142.6 55.8 -7.0 52.7 98 99 A A - 0 0 0 -30,-2.7 2,-0.3 173,-0.1 -30,-0.2 -0.701 33.7-134.6 -78.2 120.9 52.1 -7.4 52.7 99 100 A D > - 0 0 30 -2,-0.6 3,-1.8 171,-0.2 171,-0.1 -0.591 17.8-110.6 -79.0 134.9 51.2 -10.3 50.4 100 101 A V T 3 S+ 0 0 64 169,-0.5 3,-0.1 -2,-0.3 -1,-0.1 -0.379 107.3 33.9 -54.7 135.6 48.4 -10.1 47.8 101 102 A G T 3 S+ 0 0 58 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.239 101.8 97.2 95.7 -10.4 45.5 -12.3 49.0 102 103 A Y < - 0 0 94 -3,-1.8 -1,-0.2 2,-0.0 5,-0.0 -0.931 69.0-129.9-119.9 132.4 46.2 -11.7 52.7 103 104 A T > - 0 0 10 -2,-0.4 4,-2.3 1,-0.1 3,-0.3 -0.309 37.5-101.9 -69.9 160.3 44.5 -9.3 55.1 104 105 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.912 124.8 47.3 -50.9 -43.4 46.7 -7.0 57.2 105 106 A T H > S+ 0 0 16 304,-2.5 4,-2.6 1,-0.2 5,-0.1 0.840 108.2 55.5 -69.5 -31.8 46.1 -9.3 60.3 106 107 A E H > S+ 0 0 92 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.901 106.5 50.0 -64.9 -39.9 46.9 -12.4 58.3 107 108 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.950 111.1 50.4 -62.5 -45.4 50.2 -11.0 57.2 108 109 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.907 111.5 47.6 -56.3 -48.2 51.0 -10.2 60.8 109 110 A A H X S+ 0 0 31 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.955 113.8 46.9 -57.9 -52.7 50.0 -13.7 61.9 110 111 A K H X S+ 0 0 44 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.912 112.5 49.0 -58.2 -44.8 52.1 -15.4 59.2 111 112 A E H X S+ 0 0 22 -4,-2.9 4,-2.5 1,-0.2 -16,-0.3 0.861 111.4 48.6 -70.4 -34.3 55.2 -13.3 59.8 112 113 A V H X>S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.2 5,-0.7 0.926 114.9 45.7 -66.6 -44.2 55.2 -13.9 63.6 113 114 A F H X5S+ 0 0 127 -4,-2.4 4,-2.3 4,-0.2 -2,-0.2 0.974 118.0 42.6 -62.4 -54.6 54.8 -17.6 63.1 114 115 A E H <5S+ 0 0 112 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.867 122.6 36.5 -57.8 -44.2 57.5 -17.8 60.4 115 116 A E H <5S+ 0 0 29 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.662 137.4 13.0 -89.9 -15.9 60.0 -15.5 62.1 116 117 A T H <5S- 0 0 0 -4,-1.8 42,-1.3 2,-0.2 -3,-0.2 0.492 88.6-122.7-138.8 -15.8 59.5 -16.5 65.7 117 118 A G << + 0 0 17 -4,-2.3 39,-1.1 -5,-0.7 -4,-0.2 0.286 68.2 131.2 82.0 -11.6 57.4 -19.7 65.9 118 119 A Y E -C 155 0A 23 -6,-0.7 2,-0.5 37,-0.3 -1,-0.3 -0.447 53.0-138.1 -74.1 147.4 54.7 -18.0 68.0 119 120 A E E -C 154 0A 101 35,-2.9 34,-2.6 -2,-0.1 35,-0.8 -0.913 28.8-171.1-106.4 130.0 51.1 -18.2 67.2 120 121 A V E +C 152 0A 13 -2,-0.5 2,-0.2 32,-0.2 32,-0.2 -0.848 19.2 147.1-128.2 160.3 49.1 -15.0 67.5 121 122 A D E +C 151 0A 70 30,-1.7 30,-2.6 -2,-0.3 -2,-0.0 -0.869 42.7 80.0-163.8-168.9 45.5 -13.5 67.5 122 123 A H E S- 0 0 101 -2,-0.2 2,-0.2 28,-0.2 -1,-0.2 0.972 70.7-157.2 53.5 64.2 43.4 -10.7 69.1 123 124 A F E - 0 0 46 27,-0.1 2,-0.4 285,-0.1 27,-0.2 -0.463 16.2-165.2 -82.4 142.4 44.8 -8.0 66.8 124 125 A K E -C 149 0A 78 25,-1.8 25,-2.6 -2,-0.2 2,-0.6 -0.977 21.6-128.9-125.1 134.1 44.9 -4.3 67.5 125 126 A L E +C 148 0A 0 281,-0.4 281,-0.2 -2,-0.4 23,-0.2 -0.758 35.4 167.5 -79.4 120.8 45.6 -1.5 65.0 126 127 A L E - 0 0 6 21,-2.6 76,-0.6 -2,-0.6 2,-0.3 0.758 50.8 -30.1-109.9 -32.7 48.3 0.6 66.6 127 128 A A E -Cd 147 202A 0 20,-1.0 20,-2.7 74,-0.2 -1,-0.4 -0.938 36.4-138.8-175.8 156.1 49.7 3.1 64.0 128 129 A I E -Cd 146 203A 0 74,-1.8 76,-1.5 -2,-0.3 2,-0.3 -0.952 28.6-171.6-127.2 115.7 50.4 3.7 60.4 129 130 A F E -C 145 0A 7 16,-2.5 16,-3.3 -2,-0.4 2,-0.6 -0.809 24.1-124.6-103.3 146.3 53.8 5.3 59.8 130 131 A D E > -C 144 0A 3 -2,-0.3 4,-1.8 14,-0.2 3,-0.5 -0.815 15.6-152.3 -87.1 122.5 55.1 6.7 56.5 131 132 A K H > S+ 0 0 32 12,-3.1 4,-2.8 -2,-0.6 -1,-0.1 0.890 93.3 53.4 -64.3 -39.0 58.4 5.1 55.7 132 133 A E H 4 S+ 0 0 38 11,-0.5 -1,-0.2 1,-0.2 12,-0.1 0.738 111.7 46.0 -73.3 -21.4 59.7 8.0 53.7 133 134 A K H 4 S+ 0 0 124 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.811 125.0 29.2 -83.4 -34.3 59.0 10.4 56.5 134 135 A H H < S+ 0 0 58 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.836 134.4 21.6-100.9 -42.2 60.5 8.3 59.3 135 136 A Q S < S- 0 0 7 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.1 -0.555 85.2-172.3-124.5 66.6 63.3 6.2 57.8 136 137 A P + 0 0 93 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.266 16.3 150.7 -64.0 140.5 64.2 8.2 54.6 137 138 A S - 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