==== 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 PROTEINASE INHIBITOR 26-APR-93 2ACH . COMPND 2 MOLECULE: ALPHA 1-ANTICHYMOTRYPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR U.BAUMANN,R.HUBER,W.BODE,D.GROSSE,M.LESJAK,C.B.LAURELL . 372 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15833.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 79.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 97 26.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 . 44 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 2 0 0 0 2 1 0 1 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 2 0 2 2 1 1 1 0 0 1 1 0 2 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 1 0 1 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 24 A L >> 0 0 146 0, 0.0 3,-1.3 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0-169.0 53.8 62.5 46.5 2 25 A G H >> + 0 0 61 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.926 360.0 48.7 -59.5 -51.6 57.5 61.6 46.4 3 26 A L H 3> S+ 0 0 30 1,-0.3 4,-0.9 2,-0.2 -1,-0.3 0.431 103.6 65.0 -71.1 3.1 58.6 63.8 49.3 4 27 A A H <> S+ 0 0 4 -3,-1.3 4,-1.4 2,-0.2 -1,-0.3 0.719 95.4 56.9 -91.3 -27.8 55.7 62.3 51.3 5 28 A S H X S+ 0 0 40 -4,-1.8 4,-1.6 2,-0.2 3,-0.7 0.983 108.1 54.6 -72.1 -56.7 65.1 53.5 67.1 18 41 A L H 3X S+ 0 0 13 -4,-2.7 4,-1.4 1,-0.3 -1,-0.2 0.712 111.3 48.9 -49.0 -27.2 62.6 54.3 69.8 19 42 A V H 3< S+ 0 0 15 -4,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.861 100.4 60.7 -83.4 -38.2 61.9 50.6 70.1 20 43 A L H << S+ 0 0 130 -4,-1.4 -2,-0.2 -3,-0.7 -1,-0.2 0.860 106.2 53.8 -53.8 -33.8 65.6 49.6 70.3 21 44 A K H < S- 0 0 116 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.991 134.2 -2.9 -65.6 -64.8 65.5 51.8 73.4 22 45 A A >< + 0 0 28 -4,-1.4 3,-0.8 1,-0.1 -1,-0.2 -0.704 67.1 171.0-135.9 83.8 62.6 50.2 75.3 23 46 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.904 77.3 59.8 -55.5 -48.3 61.1 47.4 73.2 24 47 A D T 3 S+ 0 0 121 -5,-0.1 2,-0.1 2,-0.0 -5,-0.0 0.744 95.8 80.2 -53.6 -30.3 58.9 46.2 76.0 25 48 A K S < S- 0 0 113 -3,-0.8 -3,-0.1 -6,-0.1 2,-0.1 -0.371 85.4-103.0 -86.4 160.7 57.1 49.5 76.3 26 49 A N - 0 0 12 343,-0.1 2,-0.3 -2,-0.1 341,-0.2 -0.341 35.3-144.1 -69.0 164.8 54.3 51.1 74.3 27 50 A V E +A 366 0A 3 339,-2.0 339,-1.0 -2,-0.1 2,-0.2 -0.858 24.5 163.7-131.8 154.4 55.1 53.8 71.8 28 51 A I E +A 365 0A 0 -2,-0.3 2,-0.3 337,-0.2 337,-0.2 -0.700 17.1 129.0-173.5 121.9 53.3 57.0 70.7 29 52 A F E -A 364 0A 1 335,-1.1 335,-1.1 -2,-0.2 286,-0.1 -0.942 50.5-114.3-166.0 161.5 54.7 59.9 68.8 30 53 A S > - 0 0 0 -2,-0.3 4,-0.8 333,-0.2 333,-0.2 -0.915 18.2-165.6-106.5 127.5 53.7 62.0 65.8 31 54 A P H >> S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 3,-0.6 0.937 86.2 57.1 -77.5 -42.7 56.2 61.7 63.0 32 55 A L H 3> S+ 0 0 4 329,-1.1 4,-2.4 330,-0.5 5,-0.2 0.860 103.9 53.7 -51.8 -41.3 54.9 64.7 61.0 33 56 A S H 3> S+ 0 0 2 329,-0.4 4,-2.0 2,-0.2 -1,-0.3 0.871 110.0 46.4 -63.3 -42.4 55.5 67.0 64.0 34 57 A I H X S+ 0 0 0 -4,-2.5 3,-1.0 2,-0.2 4,-0.5 0.938 112.7 47.0 -65.8 -49.7 61.9 74.4 60.3 41 64 A L H >< S+ 0 0 4 -4,-2.4 3,-2.3 1,-0.3 4,-0.5 0.918 106.9 59.0 -57.9 -44.2 65.2 74.3 62.1 42 65 A S H >< S+ 0 0 0 -4,-1.3 3,-0.9 1,-0.3 -1,-0.3 0.751 88.7 73.0 -57.9 -25.7 66.9 73.4 58.8 43 66 A L H << S+ 0 0 17 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.813 104.6 39.8 -59.0 -28.8 65.5 76.7 57.5 44 67 A G T << S+ 0 0 0 -3,-2.3 255,-1.4 -4,-0.5 256,-0.7 0.498 100.3 96.2 -97.8 -4.0 68.2 78.3 59.6 45 68 A A < - 0 0 0 -3,-0.9 2,-0.3 -4,-0.5 252,-0.2 -0.445 51.0-164.3 -90.8 159.3 71.1 75.8 59.0 46 69 A H >> - 0 0 67 250,-2.2 3,-0.7 -2,-0.1 4,-0.7 -0.961 46.3 -14.3-141.8 155.5 73.9 75.9 56.5 47 70 A N H 3> S- 0 0 110 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 -0.348 125.2 -9.4 62.1-121.6 76.6 73.7 54.9 48 71 A T H 3> S+ 0 0 60 2,-0.2 4,-2.9 -2,-0.2 5,-0.3 0.909 132.8 61.0 -78.5 -43.4 77.0 70.3 56.7 49 72 A T H <> S+ 0 0 0 -3,-0.7 4,-1.2 1,-0.2 241,-0.2 0.847 113.3 43.7 -49.2 -32.0 74.9 71.2 59.7 50 73 A L H X S+ 0 0 20 -4,-0.7 4,-2.6 2,-0.2 5,-0.3 0.967 109.7 51.3 -77.1 -58.4 72.3 71.5 56.9 51 74 A T H X S+ 0 0 50 -4,-2.4 4,-0.7 1,-0.2 5,-0.2 0.913 109.2 55.0 -46.5 -49.7 73.1 68.4 54.8 52 75 A E H >X S+ 0 0 51 -4,-2.9 4,-2.3 2,-0.2 3,-1.7 0.926 111.3 38.2 -50.0 -64.3 72.9 66.3 57.9 53 76 A I H 3X S+ 0 0 0 -4,-1.2 4,-1.6 1,-0.3 3,-0.4 0.950 115.3 54.4 -55.8 -49.3 69.4 67.2 59.1 54 77 A L H 3<>S+ 0 0 3 -4,-2.6 5,-0.9 1,-0.3 -1,-0.3 0.628 116.3 40.4 -62.7 -9.4 68.1 67.3 55.6 55 78 A K H X<5S+ 0 0 126 -3,-1.7 3,-1.2 -4,-0.7 -1,-0.3 0.644 106.4 59.9-108.7 -21.4 69.5 63.8 55.3 56 79 A G H 3<5S+ 0 0 2 -4,-2.3 -2,-0.2 -3,-0.4 -3,-0.2 0.687 100.4 61.0 -76.1 -17.6 68.5 62.5 58.7 57 80 A L T 3<5S- 0 0 0 -4,-1.6 -47,-0.4 -5,-0.3 -1,-0.3 0.334 119.2-112.7 -86.9 0.2 65.0 63.3 57.5 58 81 A K T < 5 + 0 0 54 -3,-1.2 2,-0.2 1,-0.2 -3,-0.2 0.703 62.9 152.3 73.9 24.8 65.3 60.8 54.7 59 82 A F < - 0 0 13 -5,-0.9 2,-0.9 -53,-0.1 -1,-0.2 -0.576 45.6-132.5 -85.4 149.8 65.3 63.3 51.8 60 83 A N >> - 0 0 68 -2,-0.2 3,-2.4 1,-0.2 4,-1.4 -0.727 23.5-179.4-103.1 82.2 67.1 62.5 48.5 61 84 A L T 34 S+ 0 0 52 -2,-0.9 -1,-0.2 1,-0.3 -6,-0.0 0.772 74.0 76.4 -53.2 -27.1 69.1 65.7 47.8 62 85 A T T 34 S+ 0 0 139 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.837 115.3 20.3 -53.1 -31.7 70.4 64.1 44.6 63 86 A E T <4 S+ 0 0 143 -3,-2.4 2,-0.4 1,-0.1 -1,-0.2 0.510 123.1 61.3-116.2 -9.9 67.0 64.9 43.2 64 87 A T < - 0 0 14 -4,-1.4 2,-0.2 4,-0.0 -1,-0.1 -0.970 63.6-149.9-126.7 135.4 65.7 67.6 45.5 65 88 A S > - 0 0 51 -2,-0.4 4,-1.7 1,-0.1 5,-0.1 -0.476 35.4-106.7 -88.2 169.7 67.1 71.1 46.3 66 89 A E H > S+ 0 0 67 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.762 119.2 55.1 -69.9 -24.5 66.6 72.7 49.7 67 90 A A H > S+ 0 0 51 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.920 105.0 51.0 -76.5 -42.4 64.0 75.1 48.2 68 91 A E H > S+ 0 0 91 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.925 112.2 48.8 -58.3 -42.1 61.8 72.3 46.8 69 92 A I H X S+ 0 0 1 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.927 110.5 48.0 -64.8 -48.0 61.9 70.6 50.2 70 93 A H H X S+ 0 0 8 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.901 111.7 52.3 -59.8 -38.7 61.0 73.8 52.1 71 94 A Q H X S+ 0 0 96 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.895 102.0 59.4 -62.0 -43.6 58.2 74.3 49.6 72 95 A S H X S+ 0 0 33 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.934 105.6 50.5 -51.3 -45.1 56.9 70.8 50.2 73 96 A F H X S+ 0 0 3 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.847 108.4 50.0 -67.4 -30.5 56.4 71.7 53.8 74 97 A Q H X S+ 0 0 59 -4,-1.4 4,-2.4 -3,-0.2 -1,-0.2 0.941 111.1 48.2 -74.7 -40.5 54.5 74.9 53.1 75 98 A H H X S+ 0 0 136 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.936 114.3 47.6 -62.9 -43.2 52.1 73.2 50.7 76 99 A L H X S+ 0 0 27 -4,-2.3 4,-2.4 -5,-0.3 5,-0.3 0.886 111.5 47.4 -64.6 -44.2 51.5 70.4 53.2 77 100 A L H X S+ 0 0 18 -4,-2.1 4,-1.3 -5,-0.2 -1,-0.2 0.898 114.6 51.1 -65.1 -34.5 51.0 72.6 56.2 78 101 A R H < S+ 0 0 139 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.956 112.7 43.6 -65.0 -50.7 48.6 74.6 53.9 79 102 A T H < S+ 0 0 56 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.887 122.2 33.6 -63.8 -46.6 46.6 71.6 52.8 80 103 A L H < S+ 0 0 13 -4,-2.4 2,-2.2 1,-0.2 -1,-0.2 0.519 88.8 94.3 -92.2 -9.8 46.2 69.8 56.1 81 104 A N < + 0 0 78 -4,-1.3 2,-0.3 -5,-0.3 -1,-0.2 -0.303 68.8 98.5 -79.7 56.1 45.9 72.7 58.5 82 105 A Q - 0 0 125 -2,-2.2 2,-0.6 8,-0.1 8,-0.1 -0.847 63.7-144.2-153.9 114.2 42.1 72.7 58.3 83 106 A S - 0 0 55 -2,-0.3 5,-0.3 6,-0.3 -2,-0.1 -0.623 19.3-155.7 -77.5 115.3 39.5 71.2 60.6 84 107 A S - 0 0 61 3,-1.8 -1,-0.1 -2,-0.6 5,-0.1 0.239 38.6 -87.1 -69.1-157.8 36.6 69.8 58.7 85 108 A D S S+ 0 0 148 1,-0.1 139,-0.1 3,-0.1 -2,-0.0 0.976 125.0 22.8 -78.8 -61.4 33.2 69.5 60.4 86 109 A E S S+ 0 0 100 137,-0.1 84,-0.9 1,-0.1 2,-0.3 0.183 123.4 58.4 -90.3 12.5 33.6 66.1 62.0 87 110 A L E -I 169 0B 7 82,-0.2 -3,-1.8 135,-0.1 2,-0.6 -0.909 65.5-157.6-149.2 115.9 37.4 66.1 62.0 88 111 A Q E +I 168 0B 67 80,-3.4 80,-2.4 -2,-0.3 2,-0.4 -0.856 15.6 171.7 -99.3 122.9 39.7 68.6 63.7 89 112 A L E +I 167 0B 11 -2,-0.6 2,-0.4 78,-0.2 -6,-0.3 -0.989 4.9 172.4-126.5 132.2 43.2 69.0 62.4 90 113 A S E -I 166 0B 13 76,-1.3 76,-1.8 -2,-0.4 2,-0.4 -0.996 8.2-177.7-145.4 135.3 45.4 71.8 63.7 91 114 A M E -I 165 0B 15 -2,-0.4 2,-0.4 74,-0.2 74,-0.2 -0.997 7.5-179.9-134.7 132.7 49.1 72.5 63.2 92 115 A G E -I 164 0B 7 72,-2.2 72,-1.9 -2,-0.4 2,-0.4 -0.989 11.6-171.9-139.2 146.8 51.1 75.4 64.7 93 116 A N E +I 163 0B 5 23,-0.5 25,-1.8 -2,-0.4 2,-0.3 -0.999 13.6 166.8-134.5 133.9 54.7 76.7 64.6 94 117 A A E -Ij 162 118B 0 68,-1.7 68,-2.9 -2,-0.4 2,-0.5 -0.987 24.0-143.2-146.3 152.1 56.1 79.4 66.8 95 118 A M E -Ij 161 119B 1 23,-2.8 25,-1.5 -2,-0.3 2,-0.8 -0.960 7.8-156.5-122.7 116.1 59.6 80.7 67.6 96 119 A F E -Ij 160 120B 0 64,-2.4 64,-1.5 -2,-0.5 2,-0.4 -0.802 19.6-176.7 -94.1 109.4 60.4 82.0 71.1 97 120 A V E -Ij 159 121B 11 23,-2.4 25,-3.8 -2,-0.8 62,-0.2 -0.919 28.1-116.5-111.2 134.7 63.3 84.4 70.8 98 121 A K E > - j 0 122B 28 60,-2.7 3,-1.1 -2,-0.4 25,-0.2 -0.414 31.7-116.6 -67.9 140.0 65.1 86.1 73.7 99 122 A E T 3 S+ 0 0 132 23,-2.9 -1,-0.1 1,-0.2 24,-0.1 0.817 106.7 61.4 -43.6 -50.8 64.7 89.8 73.6 100 123 A Q T 3 S+ 0 0 147 22,-0.2 -1,-0.2 2,-0.0 2,-0.2 0.839 88.9 89.7 -49.0 -40.0 68.4 90.7 73.1 101 124 A L < - 0 0 38 -3,-1.1 2,-0.5 57,-0.2 -4,-0.0 -0.397 56.1-163.4 -75.5 131.2 68.7 88.9 69.8 102 125 A S - 0 0 109 -2,-0.2 2,-0.4 199,-0.0 3,-0.1 -0.956 18.8-152.7-109.8 123.1 68.1 90.3 66.4 103 126 A L - 0 0 27 -2,-0.5 198,-0.3 1,-0.1 5,-0.1 -0.791 26.3 -90.5-102.7 144.2 67.6 87.6 63.8 104 127 A L > - 0 0 71 196,-1.5 4,-1.8 -2,-0.4 -1,-0.1 0.004 30.7-131.0 -44.1 147.6 68.3 87.9 60.1 105 128 A D H > S+ 0 0 116 2,-0.2 4,-2.9 1,-0.2 5,-0.4 0.970 104.6 60.4 -71.5 -50.1 65.4 89.0 58.0 106 129 A R H > S+ 0 0 174 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.847 110.8 46.9 -41.6 -39.3 65.7 86.2 55.3 107 130 A F H > S+ 0 0 3 192,-0.2 4,-2.2 193,-0.2 -1,-0.2 0.930 110.8 47.0 -71.6 -52.6 65.1 83.9 58.3 108 131 A T H X S+ 0 0 40 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.895 117.7 44.8 -58.6 -40.8 62.1 85.7 60.0 109 132 A E H X S+ 0 0 122 -4,-2.9 4,-2.2 2,-0.2 5,-0.4 0.924 111.4 50.5 -68.5 -50.9 60.4 86.0 56.6 110 133 A D H X>S+ 0 0 56 -4,-2.2 4,-1.5 -5,-0.4 5,-0.9 0.878 108.6 55.0 -56.9 -35.2 61.0 82.5 55.5 111 134 A A H X>S+ 0 0 0 -4,-2.2 6,-1.6 3,-0.2 4,-1.1 0.960 112.0 44.2 -61.1 -48.8 59.6 81.4 58.8 112 135 A K H X5S+ 0 0 110 -4,-1.7 4,-1.2 4,-0.2 -2,-0.2 0.971 121.1 32.6 -59.6 -67.5 56.4 83.3 58.1 113 136 A R H <5S+ 0 0 207 -4,-2.2 -3,-0.2 2,-0.1 -2,-0.1 0.950 128.2 37.7 -58.4 -51.6 55.6 82.5 54.4 114 137 A L H <5S+ 0 0 20 -4,-1.5 -3,-0.2 -5,-0.4 -37,-0.2 0.967 133.9 13.1 -70.4 -59.7 57.0 78.9 54.5 115 138 A Y H < + 0 0 64 -2,-0.3 3,-1.0 -25,-0.2 7,-0.5 -0.666 27.8 170.4-108.9 76.3 63.1 86.8 78.5 124 147 A F T 3 + 0 0 1 -2,-0.8 3,-0.4 1,-0.2 33,-0.3 0.440 68.4 81.6 -65.5 2.5 65.0 83.5 78.6 125 148 A Q T 3 S+ 0 0 98 1,-0.3 2,-1.4 31,-0.1 -1,-0.2 0.959 89.9 46.3 -71.1 -52.5 66.9 85.3 81.4 126 149 A D S X> S- 0 0 72 -3,-1.0 3,-1.4 1,-0.2 4,-1.2 -0.570 80.2-167.8 -91.3 73.8 64.3 84.6 84.0 127 150 A S H 3> S+ 0 0 50 -2,-1.4 4,-2.7 -3,-0.4 -1,-0.2 0.722 77.4 65.6 -26.8 -53.5 63.7 80.9 83.2 128 151 A A H 3> S+ 0 0 73 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.901 111.1 33.4 -39.0 -59.3 60.6 80.6 85.4 129 152 A A H <> S+ 0 0 48 -3,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.916 113.2 55.7 -68.0 -55.0 58.6 83.0 83.1 130 153 A A H X S+ 0 0 2 -4,-1.2 4,-1.8 -7,-0.5 -1,-0.2 0.943 109.3 54.0 -45.2 -48.6 60.0 82.2 79.7 131 154 A K H >X S+ 0 0 63 -4,-2.7 4,-1.6 1,-0.2 3,-1.4 0.939 106.2 46.1 -48.5 -76.8 59.0 78.6 80.5 132 155 A K H 3X S+ 0 0 133 -4,-1.6 4,-2.1 1,-0.3 -1,-0.2 0.752 108.3 60.0 -37.4 -43.0 55.3 79.1 81.3 133 156 A L H 3X S+ 0 0 69 -4,-2.3 4,-1.8 2,-0.2 -1,-0.3 0.948 107.7 42.9 -54.5 -52.2 55.0 81.3 78.2 134 157 A I H S+ 0 0 70 -4,-2.5 5,-2.8 2,-0.2 6,-0.4 0.875 115.5 53.9 -60.4 -36.4 48.6 73.7 75.8 140 163 A N H ><5S+ 0 0 113 -4,-3.4 3,-1.5 -5,-0.3 -1,-0.2 0.985 113.1 42.3 -61.4 -54.1 46.6 76.5 74.2 141 164 A G H 3<5S+ 0 0 8 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.752 114.2 51.5 -66.4 -26.3 47.2 75.1 70.7 142 165 A T T 3<5S- 0 0 0 -4,-2.4 3,-0.3 4,-0.2 -1,-0.3 0.220 110.3-117.0 -97.6 20.5 46.6 71.5 71.8 143 166 A R T < 5S- 0 0 124 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.879 80.7 -40.6 50.0 44.4 43.2 72.2 73.5 144 167 A G S - 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