==== 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 INHIBITOR 29-MAR-06 2CJ8 . COMPND 2 MOLECULE: INVERTASE INHIBITOR; . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA TABACUM; . AUTHOR M.HOTHORN,K.SCHEFFZEK . 292 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 240 82.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 1 2 0 2 0 0 0 0 3 0 0 1 1 1 0 0 0 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 4 A N > 0 0 111 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -59.8 -15.9 20.9 -20.4 2 5 A N H > + 0 0 135 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.947 360.0 40.3 -61.5 -54.7 -15.6 24.2 -18.5 3 6 A L H > S+ 0 0 75 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.838 113.1 56.5 -61.6 -34.4 -17.3 22.2 -15.7 4 7 A V H > S+ 0 0 2 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.979 109.1 43.8 -64.6 -55.3 -15.2 19.1 -16.4 5 8 A E H X S+ 0 0 95 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.923 117.4 46.1 -50.8 -52.6 -11.9 20.9 -16.0 6 9 A T H X S+ 0 0 72 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.916 113.4 49.8 -59.5 -49.8 -13.1 22.7 -12.8 7 10 A T H >< S+ 0 0 1 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.890 112.4 47.5 -52.1 -45.3 -14.6 19.5 -11.5 8 11 A a H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.2 5,-0.3 0.768 101.3 63.7 -76.4 -26.9 -11.3 17.6 -12.2 9 12 A K H 3< S+ 0 0 131 -4,-1.9 2,-0.3 1,-0.3 -1,-0.2 0.782 96.1 61.8 -62.3 -29.4 -9.1 20.4 -10.5 10 13 A N T << S+ 0 0 89 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.1 -0.218 95.3 84.2 -92.3 42.1 -10.9 19.5 -7.3 11 14 A T S < S- 0 0 19 -3,-0.8 3,-0.4 -2,-0.3 127,-0.1 -0.971 85.6-116.5-141.1 155.4 -9.5 16.0 -7.3 12 15 A P S S+ 0 0 95 0, 0.0 126,-0.1 0, 0.0 2,-0.1 0.367 111.4 38.6 -71.1 1.5 -6.4 14.1 -6.2 13 16 A N > + 0 0 45 -5,-0.3 4,-2.5 1,-0.1 3,-0.3 -0.537 63.0 174.7-153.4 81.7 -5.6 13.1 -9.9 14 17 A Y H > S+ 0 0 54 -3,-0.4 4,-2.1 1,-0.2 5,-0.1 0.848 82.3 49.1 -53.0 -43.1 -6.5 15.9 -12.4 15 18 A Q H > S+ 0 0 156 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.811 112.2 46.2 -71.2 -36.0 -5.1 14.0 -15.4 16 19 A L H > S+ 0 0 32 -3,-0.3 4,-1.7 2,-0.2 5,-0.2 0.846 112.5 50.8 -77.4 -36.8 -6.9 10.8 -14.6 17 20 A a H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.964 115.4 42.6 -61.7 -51.6 -10.2 12.6 -14.0 18 21 A L H X S+ 0 0 35 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.841 114.0 49.1 -61.1 -46.9 -9.9 14.5 -17.3 19 22 A K H X S+ 0 0 151 -4,-2.0 4,-0.6 2,-0.2 -1,-0.2 0.854 116.3 45.7 -62.0 -37.5 -8.7 11.5 -19.4 20 23 A T H >< S+ 0 0 23 -4,-1.7 3,-0.7 -5,-0.2 4,-0.3 0.983 118.3 39.0 -69.9 -56.7 -11.6 9.4 -18.0 21 24 A L H >< S+ 0 0 0 -4,-3.0 3,-1.5 1,-0.2 6,-0.4 0.897 114.7 52.5 -61.2 -43.4 -14.4 12.0 -18.4 22 25 A L H 3< S+ 0 0 101 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.693 102.7 60.6 -71.0 -14.9 -13.2 13.4 -21.8 23 26 A S T << S+ 0 0 99 -3,-0.7 2,-0.5 -4,-0.6 -1,-0.3 0.534 93.9 76.9 -88.1 -6.2 -13.2 9.9 -23.2 24 27 A D S X S- 0 0 44 -3,-1.5 3,-1.6 -4,-0.3 4,-0.2 -0.909 75.4-141.5-108.8 130.2 -16.9 9.4 -22.5 25 28 A K G > S+ 0 0 96 -2,-0.5 3,-0.9 1,-0.2 4,-0.4 0.729 96.2 69.7 -58.7 -24.9 -19.5 11.0 -24.8 26 29 A R G 3> S+ 0 0 94 1,-0.2 4,-1.5 2,-0.1 -1,-0.2 0.607 84.0 71.0 -70.7 -14.3 -21.8 11.8 -21.8 27 30 A S G <4 S+ 0 0 8 -3,-1.6 -1,-0.2 -6,-0.4 -2,-0.1 0.645 81.1 70.5 -80.4 -17.8 -19.4 14.5 -20.4 28 31 A A T <4 S+ 0 0 65 -3,-0.9 -1,-0.2 -4,-0.2 -2,-0.1 0.948 121.4 11.0 -66.2 -47.6 -20.0 17.1 -23.0 29 32 A T T 4 S+ 0 0 133 -4,-0.4 -2,-0.2 -3,-0.1 -3,-0.1 0.875 100.9 115.9 -94.0 -50.3 -23.6 18.0 -21.8 30 33 A G < - 0 0 15 -4,-1.5 2,-0.1 4,-0.1 -3,-0.0 0.325 59.5-130.2 -29.3 136.7 -23.8 16.1 -18.5 31 34 A D >> - 0 0 100 1,-0.0 4,-1.5 -28,-0.0 3,-0.7 -0.264 45.0 -85.4 -72.6 176.9 -24.2 17.9 -15.1 32 35 A I H 3> S+ 0 0 33 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.753 129.7 59.5 -67.7 -24.8 -21.8 17.0 -12.3 33 36 A T H 3> S+ 0 0 42 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.886 105.4 50.5 -67.4 -36.7 -24.0 14.0 -11.2 34 37 A T H <> S+ 0 0 36 -3,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.902 107.9 52.2 -64.2 -40.5 -23.5 12.6 -14.7 35 38 A L H X S+ 0 0 1 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.870 108.3 52.5 -61.2 -39.6 -19.6 13.2 -14.4 36 39 A A H X S+ 0 0 2 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.930 109.9 47.2 -59.1 -47.2 -19.8 11.2 -11.1 37 40 A L H X S+ 0 0 36 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.833 107.9 56.3 -68.5 -34.4 -21.7 8.3 -12.8 38 41 A I H X S+ 0 0 4 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.916 109.6 46.4 -61.5 -45.6 -19.1 8.3 -15.7 39 42 A M H >X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 3,-1.1 0.954 110.3 51.9 -59.1 -50.7 -16.3 7.8 -13.1 40 43 A V H 3X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.3 -2,-0.2 0.905 107.9 52.7 -56.4 -43.1 -18.2 5.1 -11.3 41 44 A D H 3X S+ 0 0 64 -4,-2.3 4,-1.4 2,-0.2 -1,-0.3 0.729 108.4 51.9 -58.4 -28.9 -18.6 3.3 -14.7 42 45 A A H < S+ 0 0 2 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.901 110.7 48.2 -71.2 -41.4 -5.2 -16.8 -12.5 58 61 A R H 3< S+ 0 0 98 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.717 113.4 47.0 -69.1 -26.4 -6.7 -19.1 -9.9 59 62 A H T 3< S+ 0 0 149 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.315 97.8 70.9-100.7 4.0 -7.8 -21.8 -12.4 60 63 A S S < S- 0 0 35 -3,-0.8 -1,-0.2 -4,-0.3 -2,-0.1 -0.213 122.1 -85.4-117.8 42.4 -4.6 -22.0 -14.4 61 64 A N - 0 0 137 -3,-0.3 -2,-0.1 1,-0.1 -3,-0.1 0.983 60.3-155.1 58.2 68.2 -2.5 -23.7 -11.8 62 65 A P - 0 0 28 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.363 25.7 -88.4 -75.6 151.8 -1.4 -20.5 -9.9 63 66 A P >> - 0 0 33 0, 0.0 3,-1.4 0, 0.0 4,-0.6 -0.262 36.9-118.7 -53.1 145.8 1.9 -20.3 -7.8 64 67 A A G >4 S+ 0 0 92 1,-0.3 3,-0.6 2,-0.2 4,-0.5 0.792 114.7 61.6 -57.3 -28.4 1.2 -21.4 -4.2 65 68 A A G 34 S+ 0 0 62 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.766 103.3 46.9 -66.6 -31.0 2.3 -17.9 -3.3 66 69 A W G <> S+ 0 0 1 -3,-1.4 4,-2.3 1,-0.2 5,-0.2 0.517 90.7 86.2 -90.0 -5.8 -0.6 -16.2 -5.2 67 70 A K H S+ 0 0 38 -4,-0.5 4,-2.6 -3,-0.2 5,-0.2 0.963 118.0 47.4 -64.4 -55.5 -4.1 -16.7 -0.6 69 72 A P H > S+ 0 0 16 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.832 114.0 47.9 -57.2 -36.0 -3.9 -13.2 -2.2 70 73 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.863 111.2 50.4 -74.3 -40.9 -6.0 -14.2 -5.2 71 74 A K H X S+ 0 0 133 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.1 0.979 115.7 42.1 -55.6 -57.2 -8.6 -15.9 -3.0 72 75 A N H >X S+ 0 0 71 -4,-2.6 4,-1.9 1,-0.2 3,-0.5 0.887 114.4 51.5 -58.5 -44.2 -8.9 -12.8 -0.8 73 76 A b H 3X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.837 102.0 60.5 -64.5 -36.0 -8.8 -10.4 -3.9 74 77 A A H 3X S+ 0 0 32 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.876 108.5 45.1 -53.0 -38.3 -11.6 -12.4 -5.5 75 78 A F H S+ 0 0 43 -4,-2.3 5,-2.3 2,-0.2 4,-1.5 0.937 113.3 48.9 -58.9 -48.2 -17.7 -6.5 -2.6 80 83 A I H <>S+ 0 0 0 -4,-2.4 5,-2.6 3,-0.2 -2,-0.2 0.951 120.0 35.7 -56.4 -49.6 -16.7 -3.6 -5.0 81 84 A L H <5S+ 0 0 28 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.829 126.2 32.8 -81.1 -37.8 -18.9 -4.9 -7.8 82 85 A T H <5S+ 0 0 104 -4,-2.4 -1,-0.2 -5,-0.2 -3,-0.2 0.518 135.2 14.5-101.8 -5.0 -22.0 -6.3 -6.1 83 86 A A T X5S+ 0 0 50 -4,-1.5 4,-1.9 -5,-0.3 -3,-0.2 0.612 123.3 40.3-127.9 -64.4 -22.2 -3.9 -3.0 84 87 A S H > S+ 0 0 54 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.896 111.9 50.2 -54.5 -38.1 -24.2 -0.6 -7.1 87 90 A E H X S+ 0 0 95 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.923 110.1 48.7 -63.6 -46.8 -24.9 1.4 -3.9 88 91 A A H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.817 113.2 48.1 -62.1 -33.3 -23.0 4.5 -5.2 89 92 A I H X S+ 0 0 46 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.892 110.9 51.3 -73.1 -42.2 -25.0 4.2 -8.4 90 93 A E H X S+ 0 0 61 -4,-2.7 4,-2.2 -5,-0.3 5,-0.4 0.913 112.8 46.4 -53.9 -43.3 -28.2 3.8 -6.4 91 94 A A H X S+ 0 0 9 -4,-2.4 4,-0.7 3,-0.2 -1,-0.2 0.771 114.1 44.7 -81.2 -28.6 -27.3 7.0 -4.4 92 95 A L H < S+ 0 0 16 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.889 119.0 42.8 -77.5 -44.5 -26.3 9.2 -7.4 93 96 A T H < S- 0 0 100 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.872 140.9 -3.1 -70.4 -41.4 -29.3 8.2 -9.5 94 97 A K H < S+ 0 0 95 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.1 0.352 124.7 42.1-137.6 5.2 -32.1 8.3 -6.8 95 98 A G S < S- 0 0 59 -4,-0.7 -4,-0.1 -5,-0.4 -3,-0.1 0.240 90.3 -66.5-122.1-125.0 -30.6 9.1 -3.3 96 99 A D > - 0 0 63 1,-0.1 3,-1.6 0, 0.0 4,-0.5 -0.959 37.8-114.3-143.1 131.8 -28.0 11.5 -2.0 97 100 A P T >> S+ 0 0 29 0, 0.0 3,-3.3 0, 0.0 4,-1.2 0.771 98.5 83.7 -12.5 -70.8 -24.1 11.7 -2.5 98 101 A K H 3> S+ 0 0 64 1,-0.3 4,-1.5 2,-0.2 -10,-0.0 0.636 96.2 43.0 -17.8 -51.5 -23.2 10.9 1.1 99 102 A F H <> S+ 0 0 32 -3,-1.6 4,-2.4 2,-0.2 -1,-0.3 0.805 107.6 58.7 -76.3 -31.1 -23.6 7.1 0.4 100 103 A A H <> S+ 0 0 0 -3,-3.3 4,-2.2 -4,-0.5 5,-0.2 0.946 104.8 51.6 -58.2 -46.8 -21.8 7.3 -3.0 101 104 A E H X S+ 0 0 35 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.913 108.0 52.8 -55.5 -43.4 -18.8 8.6 -1.1 102 105 A D H X S+ 0 0 108 -4,-1.5 4,-2.3 -5,-0.3 -2,-0.2 0.944 110.3 46.8 -56.2 -50.2 -19.1 5.6 1.2 103 106 A G H X S+ 0 0 1 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.775 114.5 47.2 -60.7 -32.3 -19.1 3.2 -1.8 104 107 A M H X S+ 0 0 0 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.748 110.2 52.3 -79.7 -30.9 -16.1 5.1 -3.3 105 108 A V H X S+ 0 0 63 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.918 112.9 47.4 -66.1 -41.4 -14.3 5.0 0.1 106 109 A G H X S+ 0 0 23 -4,-2.3 4,-2.8 -5,-0.2 -2,-0.2 0.909 110.7 47.3 -64.4 -49.3 -14.9 1.2 0.2 107 110 A S H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.814 111.2 52.6 -68.3 -34.0 -13.8 0.3 -3.4 108 111 A S H X S+ 0 0 1 -4,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.901 112.9 44.6 -66.2 -46.6 -10.6 2.4 -2.9 109 112 A G H X S+ 0 0 36 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.894 112.8 50.9 -61.5 -44.2 -9.8 0.6 0.3 110 113 A D H X S+ 0 0 32 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.874 109.9 49.9 -63.9 -41.9 -10.6 -2.9 -1.2 111 114 A A H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.905 114.2 44.7 -66.1 -44.1 -8.4 -2.4 -4.3 112 115 A Q H X S+ 0 0 82 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.874 110.5 53.2 -61.4 -46.3 -5.5 -1.3 -2.2 113 116 A E H X S+ 0 0 93 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.861 108.8 51.4 -60.0 -36.0 -5.9 -4.1 0.4 114 117 A b H >< S+ 0 0 0 -4,-1.9 3,-0.5 2,-0.2 4,-0.4 0.932 111.3 46.4 -64.5 -45.3 -5.9 -6.6 -2.6 115 118 A E H >X S+ 0 0 51 -4,-1.7 3,-1.8 1,-0.2 4,-0.5 0.913 105.9 61.6 -61.6 -45.7 -2.6 -5.1 -3.9 116 119 A E H >< S+ 0 0 118 -4,-2.7 3,-0.8 1,-0.3 -1,-0.2 0.766 91.1 66.6 -49.9 -35.9 -1.2 -5.1 -0.3 117 120 A Y T << S+ 0 0 79 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.733 100.7 50.2 -59.4 -25.2 -1.5 -9.0 -0.1 118 121 A F T X4 S+ 0 0 4 -3,-1.8 3,-1.6 -4,-0.4 -1,-0.2 0.550 79.2 127.8 -89.9 -13.8 1.2 -9.3 -2.9 119 122 A K T << S+ 0 0 178 -3,-0.8 3,-0.1 -4,-0.5 -3,-0.0 -0.144 71.7 32.1 -39.0 128.6 3.6 -6.9 -1.0 120 123 A G T 3 S+ 0 0 90 1,-0.4 -1,-0.3 3,-0.0 2,-0.3 0.481 122.2 53.2 93.2 4.1 7.0 -8.7 -0.7 121 124 A S S < S- 0 0 56 -3,-1.6 2,-0.4 98,-0.0 -1,-0.4 -0.837 103.6 -69.7-150.6 179.4 6.4 -10.5 -4.1 122 125 A K - 0 0 33 -2,-0.3 -3,-0.0 -3,-0.1 0, 0.0 -0.773 46.2-139.1 -84.6 130.2 5.6 -9.7 -7.7 123 126 A S > - 0 0 16 -2,-0.4 3,-0.8 1,-0.1 -8,-0.1 -0.845 5.9-149.5 -96.5 114.7 1.9 -8.5 -7.9 124 127 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.650 86.7 21.5 -62.9 -24.6 0.2 -9.9 -11.0 125 128 A F T 3> S+ 0 0 13 1,-0.1 4,-1.9 2,-0.1 5,-0.2 -0.377 71.4 147.4-144.4 57.5 -2.3 -7.1 -11.9 126 129 A S H <> + 0 0 37 -3,-0.8 4,-2.5 1,-0.2 5,-0.2 0.876 68.9 56.1 -64.4 -42.8 -1.0 -4.0 -10.3 127 130 A A H > S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.869 108.9 49.9 -63.9 -34.3 -2.2 -1.5 -12.9 128 131 A L H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.887 110.9 46.8 -71.5 -41.8 -5.7 -2.7 -12.4 129 132 A N H X S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.913 115.8 47.5 -60.9 -43.9 -5.6 -2.5 -8.5 130 133 A I H X S+ 0 0 70 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.879 111.2 50.0 -64.1 -42.1 -4.1 1.0 -8.8 131 134 A A H X S+ 0 0 20 -4,-2.1 4,-3.0 -5,-0.2 5,-0.3 0.917 111.2 48.1 -62.2 -45.1 -6.6 2.2 -11.4 132 135 A V H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.915 115.3 46.7 -61.7 -42.9 -9.6 1.0 -9.2 133 136 A H H X S+ 0 0 36 -4,-2.0 4,-1.6 2,-0.2 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